Entering Gaussian System, Link 0=g16 Input=CMPSCO-S5-4027.914485-2.gjf Output=CMPSCO-S5-4027.914485-2.log Initial command: /rds/easybuild/noarch/apps/software/Gaussian/16.C.01-AVX2/g16/l1.exe "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876815.inp" -scrdir="/rds/general/user/rzepa/ephemeral/1669385.pbs-7/" Entering Link 1 = /rds/easybuild/noarch/apps/software/Gaussian/16.C.01-AVX2/g16/l1.exe PID= 3876816. Copyright (c) 1988-2019, Gaussian, Inc. All Rights Reserved. This is part of the Gaussian(R) 16 program. It is based on the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.), the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.), the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.), the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.), the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.), the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.), the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.), the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon University), and the Gaussian 82(TM) system (copyright 1983, Carnegie Mellon University). Gaussian is a federally registered trademark of Gaussian, Inc. This software contains proprietary and confidential information, including trade secrets, belonging to Gaussian, Inc. This software is provided under written license and may be used, copied, transmitted, or stored only in accord with that written license. The following legend is applicable only to US Government contracts under FAR: RESTRICTED RIGHTS LEGEND Use, reproduction and disclosure by the US Government is subject to restrictions as set forth in subparagraphs (a) and (c) of the Commercial Computer Software - Restricted Rights clause in FAR 52.227-19. Gaussian, Inc. 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492 --------------------------------------------------------------- Warning -- This program may not be used in any manner that competes with the business of Gaussian, Inc. or will provide assistance to any competitor of Gaussian, Inc. The licensee of this program is prohibited from giving any competitor of Gaussian, Inc. access to this program. By using this program, the user acknowledges that Gaussian, Inc. is engaged in the business of creating and licensing software in the field of computational chemistry and represents and warrants to the licensee that it is not a competitor of Gaussian, Inc. and that it will not use this program in any manner prohibited above. --------------------------------------------------------------- Cite this work as: Gaussian 16, Revision C.01, M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2019. ****************************************** Gaussian 16: ES64L-G16RevC.01 3-Jul-2019 8-Feb-2026 ****************************************** %Chk=checkpoint.chk %NProcShared=128 Will use up to 128 processors via shared memory. %Mem=460800MB ---------------------------------------- # pop(savenbos,nbo7read) def2qzvpp mn15l ---------------------------------------- 1/38=1,163=2,172=1/1; 2/12=2,17=6,18=5,40=1/2; 3/5=45,7=202,11=2,25=1,30=1,74=-72/1,2,3; 4//1; 5/5=2,38=5/2; 6/7=2,8=2,9=2,10=2,28=1,40=2,73=1,113=1,114=1,124=2103/1,12; 99/5=1,9=1/99; ------ CMPSCO ------ Symbolic Z-matrix: Charge = 0 Multiplicity = 1 Co 0.56815 0.55925 0.01271 S -0.52682 -0.43102 -1.70112 S -2.47498 0.12927 -1.58189 S -3.27068 -0.98054 -0.04399 S -2.49072 -0.0197 1.5984 S -0.52847 -0.53776 1.66912 C 2.95481 -1.22765 1.52319 C 1.38742 -2.78725 -0.27672 C 3.23928 -0.93066 -1.35773 P 2.0101 -1.09811 -0.02653 C -0.06184 2.42658 0.64885 C 1.20061 2.09529 1.2543 C 2.1419 1.90034 0.20294 C 1.475 2.08344 -1.05212 C 0.11389 2.4307 -0.76153 H 3.69949 -2.03701 1.45763 H 3.46381 -0.27962 1.75039 H 2.25231 -1.45078 2.34246 H 2.20826 -3.49792 -0.08773 H 0.55134 -2.98748 0.40798 H 1.03383 -2.90281 -1.31062 H 3.92242 -1.79513 -1.36426 H 2.70022 -0.88862 -2.31876 H 3.82354 -0.00602 -1.24523 H -1.00346 2.58113 1.1725 H 1.39143 1.96881 2.31821 H 3.18667 1.6197 0.33354 H -0.67583 2.57883 -1.49586 H 1.91449 1.96005 -2.04063 Input orientation: --------------------------------------------------------------------- Center Atomic Atomic Coordinates (Angstroms) Number Number Type X Y Z --------------------------------------------------------------------- 1 27 0 0.568154 0.559254 0.012705 2 16 0 -0.526815 -0.431015 -1.701120 3 16 0 -2.474975 0.129266 -1.581886 4 16 0 -3.270681 -0.980542 -0.043992 5 16 0 -2.490721 -0.019696 1.598400 6 16 0 -0.528468 -0.537763 1.669116 7 6 0 2.954810 -1.227649 1.523185 8 6 0 1.387420 -2.787247 -0.276717 9 6 0 3.239276 -0.930656 -1.357730 10 15 0 2.010097 -1.098114 -0.026531 11 6 0 -0.061840 2.426577 0.648849 12 6 0 1.200611 2.095285 1.254296 13 6 0 2.141899 1.900342 0.202937 14 6 0 1.474998 2.083436 -1.052115 15 6 0 0.113894 2.430699 -0.761532 16 1 0 3.699490 -2.037011 1.457631 17 1 0 3.463813 -0.279620 1.750393 18 1 0 2.252311 -1.450775 2.342458 19 1 0 2.208261 -3.497918 -0.087733 20 1 0 0.551338 -2.987477 0.407976 21 1 0 1.033830 -2.902809 -1.310623 22 1 0 3.922423 -1.795130 -1.364257 23 1 0 2.700223 -0.888620 -2.318765 24 1 0 3.823543 -0.006016 -1.245231 25 1 0 -1.003459 2.581125 1.172499 26 1 0 1.391428 1.968806 2.318211 27 1 0 3.186669 1.619703 0.333544 28 1 0 -0.675826 2.578826 -1.495861 29 1 0 1.914487 1.960048 -2.040633 --------------------------------------------------------------------- Distance matrix (angstroms): 1 2 3 4 5 1 Co 0.000000 2 S 2.262031 0.000000 3 S 3.462404 2.030630 0.000000 4 S 4.136525 3.252208 2.056682 0.000000 5 S 3.493756 3.861728 3.183812 2.056457 0.000000 6 S 2.269300 3.371927 3.847445 3.263514 2.030722 7 C 3.342260 4.811703 6.400410 6.424472 5.578406 8 C 3.457460 3.353364 5.012745 5.001625 5.120096 9 C 3.351539 3.814577 5.816042 6.641381 6.511637 10 P 2.197182 3.112104 4.903209 5.282116 4.905176 11 C 2.070861 3.728859 4.009618 4.731295 3.575662 12 C 2.073871 4.254489 5.041735 5.580207 4.268194 13 C 2.076386 4.022772 5.257169 6.136488 5.205289 14 C 2.068656 3.278861 4.438662 5.738096 5.212995 15 C 2.075597 3.079406 3.559750 4.858681 4.284593 16 H 4.316673 5.515305 7.214945 7.207932 6.512149 17 H 3.479671 5.278350 6.822058 7.004607 5.962142 18 H 3.507756 5.011385 6.343835 6.034874 5.009787 19 H 4.377292 4.414697 6.109145 6.029751 6.084530 20 H 3.568728 3.485140 4.778306 4.340494 4.413497 21 H 3.735496 2.949215 4.645296 4.881422 5.403445 22 H 4.323224 4.665834 6.684113 7.358492 7.284087 23 H 3.475314 3.317328 5.325576 6.390206 6.560877 24 H 3.535462 4.394778 6.308959 7.260901 6.925053 25 H 2.811237 4.190210 3.970341 4.393816 3.026154 26 H 2.824885 5.059033 5.791695 6.001160 4.420786 27 H 2.843257 4.704813 6.159910 6.971454 6.043198 28 H 2.811037 3.020510 3.040507 4.637919 4.429516 29 H 2.826842 3.434007 4.778032 6.286463 6.047132 6 7 8 9 10 6 S 0.000000 7 C 3.553936 0.000000 8 C 3.537947 2.851088 0.000000 9 C 4.848923 2.910120 2.836352 0.000000 10 P 3.103792 1.819583 1.817551 1.819619 0.000000 11 C 3.169542 4.818507 5.490081 5.118080 4.143972 12 C 3.177221 3.767148 5.120353 4.487221 3.534626 13 C 3.901909 3.491161 4.772085 3.413864 3.010111 14 C 4.276641 4.448067 4.932795 3.505828 3.385323 15 C 3.890044 5.164712 5.392947 4.628409 4.072878 16 H 4.490891 1.101777 2.986048 3.059751 2.436865 17 H 4.001444 1.099757 3.835202 3.183503 2.437351 18 H 3.003284 1.102043 3.065008 3.864714 2.407311 19 H 4.397581 2.882102 1.102065 3.044129 2.408749 20 H 2.959316 3.180780 1.099059 3.817491 2.426204 21 H 4.112549 3.811403 1.098791 2.958986 2.420519 22 H 5.531072 3.097682 2.931430 1.101838 2.435638 23 H 5.143028 3.865273 3.081914 1.102694 2.403019 24 H 5.264615 3.148208 3.822036 1.099538 2.442641 25 H 3.193698 5.504329 6.052764 6.060979 4.904691 26 H 3.223385 3.646033 5.417906 5.033286 3.909804 27 H 4.498962 3.094579 4.799054 3.060638 2.983371 28 H 4.444313 6.065098 5.876907 5.259617 4.784663 29 H 5.096011 4.893310 5.091759 3.252321 3.663073 11 12 13 14 15 11 C 0.000000 12 C 1.438785 0.000000 13 C 2.309161 1.424564 0.000000 14 C 2.317951 2.322705 1.432981 0.000000 15 C 1.421293 2.314523 2.307441 1.434446 0.000000 16 H 5.892822 4.833385 4.416231 5.312746 6.143421 17 H 4.578988 3.317886 2.982333 4.170548 4.987740 18 H 4.822599 3.855478 3.977402 4.961652 5.410492 19 H 6.387140 5.839548 5.406487 5.711324 6.323676 20 H 5.453988 5.193485 5.144191 5.357161 5.560192 21 H 5.782939 5.620282 5.156446 5.012394 5.440045 22 H 6.144083 5.422214 4.391227 4.596803 5.720647 23 H 5.237008 4.890735 3.801186 3.455242 4.486864 24 H 4.959965 4.188421 2.925631 3.149407 4.464643 25 H 1.088458 2.258463 3.361070 3.367395 2.238656 26 H 2.260157 1.088266 2.245502 3.373310 3.366044 27 H 3.362034 2.240176 1.089661 2.250537 3.361377 28 H 2.236054 3.364252 3.359439 2.251303 1.088503 29 H 3.369990 3.374087 2.255856 1.088826 2.258262 16 17 18 19 20 16 H 0.000000 17 H 1.797130 0.000000 18 H 1.794692 1.786024 0.000000 19 H 2.597338 3.913127 3.177824 0.000000 20 H 3.451959 4.197271 2.999497 1.803239 0.000000 21 H 3.939363 4.706990 4.115592 1.796915 1.787051 22 H 2.840996 3.494015 4.080146 2.732646 3.990829 23 H 4.071671 4.184734 4.716317 3.468136 4.056849 24 H 3.383163 3.029526 4.174639 4.017750 4.725413 25 H 6.597440 5.336136 5.312726 6.989856 5.831914 26 H 4.702586 3.110083 3.526364 6.028338 5.377684 27 H 3.859808 2.385728 3.786370 5.227313 5.308165 28 H 7.012307 5.987110 6.288431 6.872234 6.009514 29 H 5.603621 4.667805 5.564110 5.804267 5.686112 21 22 23 24 25 21 H 0.000000 22 H 3.094156 0.000000 23 H 2.801816 1.796279 0.000000 24 H 4.022211 1.795793 1.786984 0.000000 25 H 6.355311 7.060528 6.159977 5.986540 0.000000 26 H 6.085141 5.842407 5.601730 4.744810 2.724532 27 H 5.271728 3.883934 3.682806 2.353954 4.380108 28 H 5.745046 6.347653 4.908977 5.195050 2.688400 29 H 4.995583 4.311688 2.968105 2.853518 4.384560 26 27 28 29 26 H 0.000000 27 H 2.698827 0.000000 28 H 4.380960 4.380126 0.000000 29 H 4.390124 2.714958 2.718342 0.000000 Stoichiometry C8H14CoPS5 Framework group C1[X(C8H14CoPS5)] Deg. of freedom 81 Full point group C1 NOp 1 Largest Abelian subgroup C1 NOp 1 Largest concise Abelian subgroup C1 NOp 1 Standard orientation: --------------------------------------------------------------------- Center Atomic Atomic Coordinates (Angstroms) Number Number Type X Y Z --------------------------------------------------------------------- 1 27 0 0.568154 0.559254 0.012705 2 16 0 -0.526815 -0.431015 -1.701120 3 16 0 -2.474975 0.129266 -1.581886 4 16 0 -3.270681 -0.980542 -0.043992 5 16 0 -2.490721 -0.019696 1.598400 6 16 0 -0.528468 -0.537763 1.669116 7 6 0 2.954810 -1.227649 1.523185 8 6 0 1.387420 -2.787247 -0.276717 9 6 0 3.239276 -0.930656 -1.357730 10 15 0 2.010097 -1.098114 -0.026531 11 6 0 -0.061840 2.426577 0.648849 12 6 0 1.200611 2.095285 1.254296 13 6 0 2.141899 1.900342 0.202937 14 6 0 1.474998 2.083436 -1.052115 15 6 0 0.113894 2.430699 -0.761532 16 1 0 3.699490 -2.037011 1.457631 17 1 0 3.463813 -0.279620 1.750393 18 1 0 2.252311 -1.450775 2.342458 19 1 0 2.208261 -3.497918 -0.087733 20 1 0 0.551338 -2.987477 0.407976 21 1 0 1.033830 -2.902809 -1.310623 22 1 0 3.922423 -1.795130 -1.364257 23 1 0 2.700223 -0.888620 -2.318765 24 1 0 3.823543 -0.006016 -1.245231 25 1 0 -1.003459 2.581125 1.172499 26 1 0 1.391428 1.968806 2.318211 27 1 0 3.186669 1.619703 0.333544 28 1 0 -0.675826 2.578826 -1.495861 29 1 0 1.914487 1.960048 -2.040633 --------------------------------------------------------------------- Rotational constants (GHZ): 0.4810762 0.2782850 0.2633625 Standard basis: def2QZVPP (5D, 7F) There are 1711 symmetry adapted cartesian basis functions of A symmetry. There are 1396 symmetry adapted basis functions of A symmetry. 1396 basis functions, 2202 primitive gaussians, 1711 cartesian basis functions 92 alpha electrons 92 beta electrons nuclear repulsion energy 2582.9910894260 Hartrees. NAtoms= 29 NActive= 29 NUniq= 29 SFac= 1.00D+00 NAtFMM= 60 NAOKFM=F Big=F Integral buffers will be 131072 words long. Raffenetti 2 integral format. Two-electron integral symmetry is turned on. One-electron integrals computed using PRISM. 1 Symmetry operations used in ECPInt. ECPInt: NShTT= 95266 NPrTT= 259101 LenC2= 83127 LenP2D= 163417. LDataN: DoStor=T MaxTD1= 8 Len= 415 NBasis= 1396 RedAO= T EigKep= 1.19D-05 NBF= 1396 NBsUse= 1396 1.00D-06 EigRej= -1.00D+00 NBFU= 1396 ExpMin= 3.00D-02 ExpMax= 4.66D+06 ExpMxC= 5.30D+03 IAcc=3 IRadAn= 5 AccDes= 0.00D+00 Harris functional with IExCor= 1009 and IRadAn= 5 diagonalized for initial guess. HarFok: IExCor= 1009 AccDes= 0.00D+00 IRadAn= 5 IDoV= 1 UseB2=F ITyADJ=14 ICtDFT= 3500011 ScaDFX= 1.000000 1.000000 1.000000 1.000000 FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0 NFxFlg= 0 DoJE=T BraDBF=F KetDBF=T FulRan=T wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 200000004 NGrid= 0 NMat0= 1 NMatS0= 1 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Petite list used in FoFCou. Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. EnCoef did 100 forward-backward iterations EnCoef did 8 forward-backward iterations EnCoef did 2 forward-backward iterations EnCoef did 2 forward-backward iterations EnCoef did 12 forward-backward iterations SCF Done: E(RMN15L) = -4028.48638363 A.U. after 19 cycles NFock= 19 Conv=0.55D-08 -V/T= 2.0013 ********************************************************************** Population analysis using the SCF Density. ********************************************************************** Orbital symmetries: Occupied (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) Virtual (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) The electronic state is 1-A. Alpha occ. eigenvalues -- -277.14288 -88.65138 -88.65077 -88.64849 -88.61154 Alpha occ. eigenvalues -- -88.61146 -76.89663 -32.66496 -28.45419 -28.44434 Alpha occ. eigenvalues -- -28.44169 -10.23320 -10.22164 -10.22037 -10.21975 Alpha occ. eigenvalues -- -10.21852 -10.21426 -10.21193 -10.19800 -7.95190 Alpha occ. eigenvalues -- -7.95131 -7.94981 -7.91447 -7.91437 -6.60768 Alpha occ. eigenvalues -- -5.89222 -5.89169 -5.89002 -5.88775 -5.88716 Alpha occ. eigenvalues -- -5.88600 -5.88018 -5.87953 -5.87779 -5.85501 Alpha occ. eigenvalues -- -5.85489 -5.84892 -5.84874 -5.84351 -5.84350 Alpha occ. eigenvalues -- -4.73049 -4.73022 -4.72699 -3.73176 -2.43138 Alpha occ. eigenvalues -- -2.41403 -2.40928 -0.91691 -0.80632 -0.79397 Alpha occ. eigenvalues -- -0.74747 -0.73973 -0.73368 -0.72365 -0.71190 Alpha occ. eigenvalues -- -0.67739 -0.58686 -0.56003 -0.55360 -0.55026 Alpha occ. eigenvalues -- -0.53626 -0.52395 -0.45432 -0.44212 -0.43970 Alpha occ. eigenvalues -- -0.41789 -0.41380 -0.40616 -0.40444 -0.40215 Alpha occ. eigenvalues -- -0.39494 -0.39170 -0.38298 -0.37898 -0.36531 Alpha occ. eigenvalues -- -0.35632 -0.35366 -0.34883 -0.32433 -0.30447 Alpha occ. eigenvalues -- -0.30077 -0.29015 -0.28792 -0.28319 -0.26054 Alpha occ. eigenvalues -- -0.24554 -0.22196 -0.21461 -0.20320 -0.19981 Alpha occ. eigenvalues -- -0.19387 -0.17383 Alpha virt. eigenvalues -- -0.09389 -0.09135 -0.04115 -0.03783 -0.02508 Alpha virt. eigenvalues -- -0.01306 -0.00995 0.00073 0.00632 0.00745 Alpha virt. eigenvalues -- 0.01603 0.01877 0.02292 0.02525 0.02893 Alpha virt. eigenvalues -- 0.03891 0.04649 0.05188 0.06004 0.06839 Alpha virt. eigenvalues -- 0.07115 0.07321 0.08053 0.08342 0.08791 Alpha virt. eigenvalues -- 0.09030 0.09777 0.10302 0.10652 0.11138 Alpha virt. eigenvalues -- 0.11348 0.11546 0.12116 0.12207 0.13022 Alpha virt. eigenvalues -- 0.13309 0.13783 0.13966 0.14562 0.15061 Alpha virt. eigenvalues -- 0.15349 0.15704 0.15961 0.16378 0.16714 Alpha virt. eigenvalues -- 0.17631 0.18374 0.18642 0.19056 0.19139 Alpha virt. eigenvalues -- 0.19607 0.20048 0.20234 0.20479 0.21348 Alpha virt. eigenvalues -- 0.21847 0.22082 0.23070 0.23259 0.23568 Alpha virt. eigenvalues -- 0.24024 0.24233 0.25293 0.25445 0.25607 Alpha virt. eigenvalues -- 0.25675 0.25963 0.26056 0.26385 0.27676 Alpha virt. eigenvalues -- 0.28046 0.28330 0.28654 0.29126 0.29425 Alpha virt. eigenvalues -- 0.30148 0.30348 0.30756 0.31142 0.31589 Alpha virt. eigenvalues -- 0.32010 0.32452 0.32971 0.33180 0.33646 Alpha virt. eigenvalues -- 0.33938 0.34486 0.35139 0.35497 0.36123 Alpha virt. eigenvalues -- 0.36410 0.36558 0.36883 0.38279 0.38511 Alpha virt. eigenvalues -- 0.39638 0.40057 0.40718 0.40882 0.41178 Alpha virt. eigenvalues -- 0.41664 0.41959 0.42324 0.43602 0.43766 Alpha virt. eigenvalues -- 0.43891 0.44493 0.44782 0.45159 0.45681 Alpha virt. eigenvalues -- 0.45798 0.46445 0.46939 0.47702 0.47879 Alpha virt. eigenvalues -- 0.48021 0.48482 0.49101 0.50184 0.50306 Alpha virt. eigenvalues -- 0.50787 0.51185 0.51369 0.52077 0.52388 Alpha virt. eigenvalues -- 0.53039 0.53997 0.54248 0.55163 0.55676 Alpha virt. eigenvalues -- 0.56071 0.56421 0.56853 0.57131 0.57846 Alpha virt. eigenvalues -- 0.58762 0.59298 0.60295 0.61333 0.61606 Alpha virt. eigenvalues -- 0.62079 0.62851 0.64533 0.64715 0.64859 Alpha virt. eigenvalues -- 0.65294 0.65871 0.66075 0.66799 0.67333 Alpha virt. eigenvalues -- 0.67673 0.68628 0.68869 0.68950 0.70378 Alpha virt. eigenvalues -- 0.70971 0.71516 0.72088 0.73142 0.74019 Alpha virt. eigenvalues -- 0.74699 0.75411 0.75806 0.76334 0.76968 Alpha virt. eigenvalues -- 0.77466 0.78676 0.78970 0.79286 0.79638 Alpha virt. eigenvalues -- 0.80614 0.82007 0.82093 0.82654 0.82952 Alpha virt. eigenvalues -- 0.83402 0.83982 0.84640 0.84732 0.85257 Alpha virt. eigenvalues -- 0.86160 0.86369 0.86643 0.87127 0.87583 Alpha virt. eigenvalues -- 0.88409 0.88862 0.89386 0.89650 0.90023 Alpha virt. eigenvalues -- 0.90186 0.91022 0.91729 0.92208 0.92824 Alpha virt. eigenvalues -- 0.93472 0.93645 0.94325 0.95079 0.95733 Alpha virt. eigenvalues -- 0.96209 0.96672 0.97622 0.97834 0.98111 Alpha virt. eigenvalues -- 0.98908 0.99589 0.99912 0.99994 1.00591 Alpha virt. eigenvalues -- 1.01549 1.02228 1.02485 1.03497 1.03625 Alpha virt. eigenvalues -- 1.04463 1.04976 1.05428 1.06176 1.06555 Alpha virt. eigenvalues -- 1.07276 1.07441 1.08122 1.08905 1.09121 Alpha virt. eigenvalues -- 1.09524 1.09812 1.10140 1.10884 1.11174 Alpha virt. eigenvalues -- 1.11520 1.11781 1.12063 1.12647 1.13153 Alpha virt. eigenvalues -- 1.13336 1.14388 1.14648 1.14911 1.15311 Alpha virt. eigenvalues -- 1.15641 1.15690 1.15970 1.17008 1.17831 Alpha virt. eigenvalues -- 1.18542 1.18713 1.19251 1.19416 1.19691 Alpha virt. eigenvalues -- 1.20079 1.20576 1.21261 1.21400 1.22024 Alpha virt. eigenvalues -- 1.22553 1.22821 1.23493 1.24184 1.24420 Alpha virt. eigenvalues -- 1.25045 1.25399 1.25696 1.26192 1.26303 Alpha virt. eigenvalues -- 1.26831 1.27942 1.28528 1.28692 1.29163 Alpha virt. eigenvalues -- 1.30296 1.30717 1.31453 1.31823 1.32628 Alpha virt. eigenvalues -- 1.33175 1.34170 1.34526 1.35249 1.35579 Alpha virt. eigenvalues -- 1.36211 1.36659 1.37463 1.37935 1.38615 Alpha virt. eigenvalues -- 1.39281 1.39740 1.40500 1.41221 1.41405 Alpha virt. eigenvalues -- 1.42763 1.43457 1.44020 1.44144 1.44691 Alpha virt. eigenvalues -- 1.45419 1.46870 1.47579 1.48078 1.49013 Alpha virt. eigenvalues -- 1.49232 1.49580 1.50046 1.50937 1.51462 Alpha virt. eigenvalues -- 1.51930 1.52876 1.53749 1.54419 1.55145 Alpha virt. eigenvalues -- 1.55405 1.56000 1.56613 1.57607 1.57682 Alpha virt. eigenvalues -- 1.57935 1.58560 1.59903 1.60488 1.60728 Alpha virt. eigenvalues -- 1.61441 1.62929 1.63527 1.63889 1.64632 Alpha virt. eigenvalues -- 1.65279 1.65674 1.66586 1.66919 1.67314 Alpha virt. eigenvalues -- 1.68859 1.69079 1.69931 1.71305 1.71833 Alpha virt. eigenvalues -- 1.72598 1.74006 1.74748 1.75587 1.76927 Alpha virt. eigenvalues -- 1.77451 1.78543 1.79416 1.80058 1.80868 Alpha virt. eigenvalues -- 1.81178 1.82367 1.83223 1.84598 1.85291 Alpha virt. eigenvalues -- 1.85823 1.86417 1.87879 1.87975 1.88430 Alpha virt. eigenvalues -- 1.89552 1.91113 1.91289 1.91657 1.92327 Alpha virt. eigenvalues -- 1.92918 1.93289 1.94921 1.95224 1.95439 Alpha virt. eigenvalues -- 1.96131 1.96543 1.96786 1.97509 1.98933 Alpha virt. eigenvalues -- 1.99355 2.00441 2.01313 2.01627 2.01838 Alpha virt. eigenvalues -- 2.02827 2.03345 2.03865 2.05118 2.05466 Alpha virt. eigenvalues -- 2.06258 2.06943 2.07681 2.08113 2.09090 Alpha virt. eigenvalues -- 2.10129 2.10839 2.11504 2.11651 2.12997 Alpha virt. eigenvalues -- 2.13436 2.14263 2.15198 2.15481 2.16456 Alpha virt. eigenvalues -- 2.16853 2.17980 2.18730 2.19769 2.19869 Alpha virt. eigenvalues -- 2.21003 2.21196 2.22302 2.22393 2.23332 Alpha virt. eigenvalues -- 2.24174 2.25070 2.25770 2.26989 2.27669 Alpha virt. eigenvalues -- 2.29096 2.30001 2.30697 2.30831 2.31548 Alpha virt. eigenvalues -- 2.32818 2.32907 2.33870 2.34619 2.35934 Alpha virt. eigenvalues -- 2.36462 2.37058 2.37507 2.38020 2.39151 Alpha virt. eigenvalues -- 2.40040 2.41884 2.42333 2.42724 2.43090 Alpha virt. eigenvalues -- 2.44260 2.45133 2.45748 2.46260 2.46774 Alpha virt. eigenvalues -- 2.46877 2.47456 2.49264 2.50004 2.50728 Alpha virt. eigenvalues -- 2.51218 2.51947 2.52152 2.53135 2.53517 Alpha virt. eigenvalues -- 2.54825 2.55487 2.56734 2.57085 2.57840 Alpha virt. eigenvalues -- 2.58057 2.59616 2.61067 2.61762 2.62296 Alpha virt. eigenvalues -- 2.62768 2.63439 2.63810 2.64952 2.66226 Alpha virt. eigenvalues -- 2.66412 2.67945 2.68705 2.69212 2.69515 Alpha virt. eigenvalues -- 2.70221 2.70694 2.71785 2.72146 2.74550 Alpha virt. eigenvalues -- 2.74772 2.75203 2.76467 2.77255 2.77964 Alpha virt. eigenvalues -- 2.78648 2.79129 2.79770 2.80451 2.80928 Alpha virt. eigenvalues -- 2.80980 2.81403 2.81890 2.82637 2.83268 Alpha virt. eigenvalues -- 2.83318 2.83808 2.84575 2.85219 2.85514 Alpha virt. eigenvalues -- 2.86486 2.87022 2.87627 2.88156 2.88285 Alpha virt. eigenvalues -- 2.89617 2.90178 2.90607 2.90824 2.91697 Alpha virt. eigenvalues -- 2.92288 2.93165 2.93427 2.93926 2.94527 Alpha virt. eigenvalues -- 2.94773 2.95275 2.96346 2.96467 2.96874 Alpha virt. eigenvalues -- 2.97141 2.98679 2.98915 2.99564 2.99807 Alpha virt. eigenvalues -- 3.00183 3.01285 3.01874 3.02383 3.02964 Alpha virt. eigenvalues -- 3.03250 3.04196 3.04412 3.04939 3.05280 Alpha virt. eigenvalues -- 3.05827 3.06387 3.06813 3.07377 3.07725 Alpha virt. eigenvalues -- 3.08521 3.08908 3.09271 3.09921 3.10073 Alpha virt. eigenvalues -- 3.10775 3.11528 3.12006 3.12722 3.13129 Alpha virt. eigenvalues -- 3.13509 3.14045 3.14219 3.14556 3.15366 Alpha virt. eigenvalues -- 3.15452 3.16055 3.16368 3.16881 3.17263 Alpha virt. eigenvalues -- 3.17881 3.18681 3.18683 3.18876 3.20205 Alpha virt. eigenvalues -- 3.20569 3.21150 3.21561 3.21627 3.22180 Alpha virt. eigenvalues -- 3.23362 3.23848 3.24729 3.24807 3.25548 Alpha virt. eigenvalues -- 3.25879 3.25974 3.26530 3.27793 3.28528 Alpha virt. eigenvalues -- 3.28854 3.29279 3.29782 3.30278 3.30842 Alpha virt. eigenvalues -- 3.31285 3.31946 3.32429 3.33587 3.34239 Alpha virt. eigenvalues -- 3.34760 3.35967 3.36348 3.37122 3.37446 Alpha virt. eigenvalues -- 3.38493 3.38554 3.39344 3.39858 3.40802 Alpha virt. eigenvalues -- 3.41529 3.43161 3.43353 3.43845 3.45196 Alpha virt. eigenvalues -- 3.45559 3.46972 3.47066 3.47784 3.48031 Alpha virt. eigenvalues -- 3.48439 3.49798 3.50445 3.50971 3.52136 Alpha virt. eigenvalues -- 3.52969 3.53247 3.53489 3.54229 3.54838 Alpha virt. eigenvalues -- 3.56005 3.56826 3.56967 3.57649 3.58095 Alpha virt. eigenvalues -- 3.58586 3.59316 3.60296 3.60861 3.61519 Alpha virt. eigenvalues -- 3.63198 3.63373 3.64456 3.64748 3.65190 Alpha virt. eigenvalues -- 3.66040 3.66950 3.68078 3.68852 3.69004 Alpha virt. eigenvalues -- 3.69664 3.70385 3.71682 3.72260 3.73020 Alpha virt. eigenvalues -- 3.73713 3.74099 3.74757 3.75833 3.76298 Alpha virt. eigenvalues -- 3.76498 3.77221 3.77762 3.78634 3.79354 Alpha virt. eigenvalues -- 3.79759 3.79994 3.80251 3.81231 3.81782 Alpha virt. eigenvalues -- 3.82201 3.82684 3.82922 3.83761 3.84381 Alpha virt. eigenvalues -- 3.84669 3.85195 3.86567 3.86975 3.87386 Alpha virt. eigenvalues -- 3.88372 3.89065 3.89548 3.90051 3.90510 Alpha virt. eigenvalues -- 3.90804 3.91216 3.91331 3.92571 3.93242 Alpha virt. eigenvalues -- 3.93309 3.94369 3.95367 3.96399 3.96822 Alpha virt. eigenvalues -- 3.97755 3.98733 3.99298 3.99524 4.00153 Alpha virt. eigenvalues -- 4.00516 4.01811 4.02504 4.03407 4.04639 Alpha virt. eigenvalues -- 4.05556 4.06131 4.07113 4.07665 4.07907 Alpha virt. eigenvalues -- 4.09702 4.10314 4.10471 4.11235 4.12495 Alpha virt. eigenvalues -- 4.12671 4.13524 4.14140 4.15209 4.15963 Alpha virt. eigenvalues -- 4.17122 4.17337 4.18087 4.19007 4.19506 Alpha virt. eigenvalues -- 4.20431 4.20704 4.21003 4.21658 4.22579 Alpha virt. eigenvalues -- 4.22801 4.23273 4.23848 4.24467 4.25371 Alpha virt. eigenvalues -- 4.27434 4.28632 4.28843 4.29731 4.31501 Alpha virt. eigenvalues -- 4.32856 4.33991 4.34303 4.35875 4.38173 Alpha virt. eigenvalues -- 4.41778 4.42627 4.43877 4.45213 4.46515 Alpha virt. eigenvalues -- 4.47460 4.48554 4.52253 4.54389 4.55685 Alpha virt. eigenvalues -- 4.58978 4.62048 4.65806 4.68795 4.70125 Alpha virt. eigenvalues -- 4.70948 4.72763 4.73464 4.74273 4.74598 Alpha virt. eigenvalues -- 4.75266 4.76292 4.76673 4.77521 4.78561 Alpha virt. eigenvalues -- 4.80379 4.80698 4.81484 4.83128 4.85441 Alpha virt. eigenvalues -- 4.86356 4.88170 4.89500 4.91912 4.94236 Alpha virt. eigenvalues -- 4.96700 4.99626 5.03104 5.04687 5.06931 Alpha virt. eigenvalues -- 5.08580 5.09893 5.10480 5.12289 5.13509 Alpha virt. eigenvalues -- 5.23547 5.27851 5.32522 5.35448 5.41623 Alpha virt. eigenvalues -- 5.43039 5.43658 5.45248 5.46239 5.48116 Alpha virt. eigenvalues -- 5.49225 5.52946 5.53843 5.57816 5.58706 Alpha virt. eigenvalues -- 5.60029 5.62106 5.62810 5.64710 5.65773 Alpha virt. eigenvalues -- 5.66530 5.67215 5.68753 5.71620 5.72373 Alpha virt. eigenvalues -- 5.73228 5.75262 5.76597 5.77800 5.81364 Alpha virt. eigenvalues -- 5.82622 5.83652 5.87464 5.88083 5.91585 Alpha virt. eigenvalues -- 5.92916 5.94565 5.96104 5.97132 5.99947 Alpha virt. eigenvalues -- 6.01799 6.02502 6.03821 6.04116 6.06279 Alpha virt. eigenvalues -- 6.06591 6.07643 6.09462 6.09777 6.12500 Alpha virt. eigenvalues -- 6.12666 6.15573 6.16165 6.17800 6.18238 Alpha virt. eigenvalues -- 6.18905 6.19374 6.21494 6.22172 6.23035 Alpha virt. eigenvalues -- 6.23972 6.25394 6.26390 6.27617 6.28660 Alpha virt. eigenvalues -- 6.29435 6.30392 6.31110 6.32495 6.33475 Alpha virt. eigenvalues -- 6.33696 6.34449 6.35695 6.36406 6.37455 Alpha virt. eigenvalues -- 6.38645 6.39073 6.39354 6.40446 6.41589 Alpha virt. eigenvalues -- 6.42284 6.42779 6.44675 6.46444 6.48687 Alpha virt. eigenvalues -- 6.49616 6.50062 6.51369 6.51981 6.52565 Alpha virt. eigenvalues -- 6.53521 6.53635 6.54715 6.55236 6.56797 Alpha virt. eigenvalues -- 6.58072 6.58574 6.58936 6.59811 6.60572 Alpha virt. eigenvalues -- 6.61102 6.62066 6.62376 6.62536 6.63494 Alpha virt. eigenvalues -- 6.63946 6.65344 6.66003 6.66553 6.67676 Alpha virt. eigenvalues -- 6.69451 6.69691 6.70172 6.71740 6.72746 Alpha virt. eigenvalues -- 6.73169 6.73962 6.75201 6.75599 6.76407 Alpha virt. eigenvalues -- 6.77278 6.77885 6.79114 6.80478 6.81149 Alpha virt. eigenvalues -- 6.81237 6.82008 6.82161 6.82383 6.83572 Alpha virt. eigenvalues -- 6.83876 6.84645 6.85393 6.86059 6.87857 Alpha virt. eigenvalues -- 6.88521 6.89095 6.89809 6.90833 6.92394 Alpha virt. eigenvalues -- 6.93253 6.94815 6.95805 6.96680 6.97479 Alpha virt. eigenvalues -- 6.98186 6.98895 7.00148 7.01227 7.04749 Alpha virt. eigenvalues -- 7.05325 7.06018 7.08180 7.10009 7.10668 Alpha virt. eigenvalues -- 7.11173 7.11842 7.12589 7.13302 7.13384 Alpha virt. eigenvalues -- 7.14362 7.15504 7.16399 7.17184 7.18762 Alpha virt. eigenvalues -- 7.19131 7.19957 7.21125 7.22366 7.23486 Alpha virt. eigenvalues -- 7.24471 7.25445 7.28048 7.29830 7.30212 Alpha virt. eigenvalues -- 7.31349 7.32244 7.32525 7.33176 7.34182 Alpha virt. eigenvalues -- 7.34775 7.35872 7.37378 7.37926 7.39214 Alpha virt. eigenvalues -- 7.41053 7.42268 7.43461 7.45433 7.46713 Alpha virt. eigenvalues -- 7.51918 7.52086 7.54945 7.55749 7.55960 Alpha virt. eigenvalues -- 7.56833 7.57711 7.60884 7.61995 7.62647 Alpha virt. eigenvalues -- 7.63587 7.65906 7.67620 7.68328 7.69038 Alpha virt. eigenvalues -- 7.69789 7.70440 7.71913 7.72798 7.73174 Alpha virt. eigenvalues -- 7.75053 7.78355 7.80113 7.90244 7.91910 Alpha virt. eigenvalues -- 7.93793 7.94567 7.95596 7.97356 7.97814 Alpha virt. eigenvalues -- 7.99281 7.99972 8.00783 8.01558 8.02547 Alpha virt. eigenvalues -- 8.03445 8.07572 8.09547 8.11431 8.11664 Alpha virt. eigenvalues -- 8.13041 8.14649 8.17586 8.18433 8.18745 Alpha virt. eigenvalues -- 8.20845 8.21112 8.22152 8.22671 8.22882 Alpha virt. eigenvalues -- 8.24902 8.26146 8.26575 8.28298 8.30109 Alpha virt. eigenvalues -- 8.30361 8.39309 8.39692 8.41078 8.42853 Alpha virt. eigenvalues -- 8.44089 8.44755 8.45786 8.46708 8.47632 Alpha virt. eigenvalues -- 8.48153 8.48527 8.49238 8.49629 8.50705 Alpha virt. eigenvalues -- 8.52283 8.52617 8.52776 8.53767 8.55579 Alpha virt. eigenvalues -- 8.56570 8.57429 8.57549 8.58460 8.60270 Alpha virt. eigenvalues -- 8.60850 8.61740 8.64578 8.65905 8.67708 Alpha virt. eigenvalues -- 8.68023 8.69350 8.69846 8.70875 8.73161 Alpha virt. eigenvalues -- 8.75004 8.75547 8.76808 8.78409 8.79801 Alpha virt. eigenvalues -- 8.80021 8.82345 8.84457 8.84890 8.86273 Alpha virt. eigenvalues -- 8.87831 8.88712 8.90115 8.90832 8.91116 Alpha virt. eigenvalues -- 8.91717 8.92775 8.94365 8.95507 8.95821 Alpha virt. eigenvalues -- 8.96720 8.97511 8.98625 8.99112 9.00207 Alpha virt. eigenvalues -- 9.00691 9.02672 9.07351 9.08732 9.10074 Alpha virt. eigenvalues -- 9.11151 9.11718 9.12411 9.12687 9.13670 Alpha virt. eigenvalues -- 9.14943 9.15617 9.16394 9.16541 9.17848 Alpha virt. eigenvalues -- 9.18436 9.20221 9.20826 9.21617 9.21827 Alpha virt. eigenvalues -- 9.22495 9.23652 9.24478 9.25175 9.25357 Alpha virt. eigenvalues -- 9.25551 9.26032 9.26702 9.27366 9.28642 Alpha virt. eigenvalues -- 9.29214 9.29719 9.30468 9.30910 9.31970 Alpha virt. eigenvalues -- 9.33101 9.34012 9.34635 9.35979 9.38065 Alpha virt. eigenvalues -- 9.38654 9.39788 9.39953 9.40214 9.44066 Alpha virt. eigenvalues -- 9.44558 9.46343 9.47363 9.48034 9.49467 Alpha virt. eigenvalues -- 9.50210 9.51616 9.51946 9.53886 9.56188 Alpha virt. eigenvalues -- 9.58000 9.58699 9.59252 9.60042 9.62445 Alpha virt. eigenvalues -- 9.63455 9.65352 9.65731 9.67100 9.69429 Alpha virt. eigenvalues -- 9.70896 9.71562 9.71817 9.73209 9.73639 Alpha virt. eigenvalues -- 9.74462 9.74966 9.76462 9.76627 9.78081 Alpha virt. eigenvalues -- 9.78624 9.80288 9.80758 9.82176 9.82402 Alpha virt. eigenvalues -- 9.83279 9.84696 9.85838 9.86957 9.87403 Alpha virt. eigenvalues -- 9.88851 9.90029 9.96208 9.97642 10.00191 Alpha virt. eigenvalues -- 10.08880 10.21706 10.22656 10.24152 10.26093 Alpha virt. eigenvalues -- 10.27559 10.33704 10.34024 10.37701 10.42873 Alpha virt. eigenvalues -- 10.45175 10.45535 10.48434 10.49485 10.51478 Alpha virt. eigenvalues -- 10.62683 10.63800 10.65240 10.65515 10.66573 Alpha virt. eigenvalues -- 10.69382 10.72036 10.72609 10.73035 10.73635 Alpha virt. eigenvalues -- 10.74453 10.74958 10.75178 10.75923 10.77711 Alpha virt. eigenvalues -- 10.78190 10.78845 10.79608 10.81852 10.83706 Alpha virt. eigenvalues -- 10.91820 10.93333 11.17982 11.18705 11.19809 Alpha virt. eigenvalues -- 11.20762 11.21987 11.24824 11.25067 11.28150 Alpha virt. eigenvalues -- 11.43599 11.44432 11.51466 11.52555 11.52870 Alpha virt. eigenvalues -- 11.73587 11.75188 12.79846 12.80678 12.82874 Alpha virt. eigenvalues -- 12.85867 12.88505 12.96936 12.97736 13.07522 Alpha virt. eigenvalues -- 13.59289 13.71448 13.72455 13.87770 13.90480 Alpha virt. eigenvalues -- 13.93604 14.05929 14.08802 18.54309 18.55794 Alpha virt. eigenvalues -- 18.72021 18.77007 18.78773 18.85399 18.86592 Alpha virt. eigenvalues -- 19.00228 19.17113 19.21927 20.18243 20.19010 Alpha virt. eigenvalues -- 20.21717 20.23289 20.29121 20.30209 20.31444 Alpha virt. eigenvalues -- 20.38648 20.39489 22.05170 25.14760 25.34894 Alpha virt. eigenvalues -- 25.48889 25.64582 25.65199 29.03670 29.09364 Alpha virt. eigenvalues -- 29.10249 29.14146 29.16558 29.25286 29.26905 Alpha virt. eigenvalues -- 29.27312 29.32632 29.39686 29.44849 29.46884 Alpha virt. eigenvalues -- 29.48643 29.59649 29.60811 29.74611 30.15557 Alpha virt. eigenvalues -- 30.18388 30.30906 30.38375 30.38734 30.41387 Alpha virt. eigenvalues -- 30.44253 39.92164 73.29594 85.79687 85.99295 Alpha virt. eigenvalues -- 86.12575 86.27980 86.28771 128.80237 141.99090 Alpha virt. eigenvalues -- 142.32980 142.35707 142.49030 142.50768 142.50914 Alpha virt. eigenvalues -- 142.60456 142.62963 375.26895 441.57103 441.88021 Alpha virt. eigenvalues -- 442.08353 442.33063 442.35254 795.03323 Condensed to atoms (all electrons): 1 2 3 4 5 6 1 Co 28.229852 0.203687 0.056761 0.014690 0.047704 0.210938 2 S 0.203687 15.975555 0.046108 -0.064687 -0.009349 -0.020325 3 S 0.056761 0.046108 15.897456 0.103493 -0.067379 -0.009338 4 S 0.014690 -0.064687 0.103493 15.927238 0.097109 -0.063705 5 S 0.047704 -0.009349 -0.067379 0.097109 15.910248 0.045431 6 S 0.210938 -0.020325 -0.009338 -0.063705 0.045431 15.997800 7 C -0.013649 0.002192 -0.000107 -0.000078 0.000192 -0.019669 8 C -0.049306 -0.008535 -0.000344 -0.000784 0.000653 -0.035368 9 C -0.024683 -0.004196 -0.000057 -0.000112 -0.000088 0.000893 10 P -0.109296 -0.021729 0.003561 0.002865 0.002459 -0.016312 11 C -0.189050 0.007706 -0.013684 0.002085 -0.021348 -0.020017 12 C -0.226694 -0.004670 -0.001526 0.000260 -0.001845 -0.045961 13 C -0.149609 -0.005956 0.002049 -0.000089 -0.000076 -0.003447 14 C -0.263846 -0.056095 0.000284 -0.000240 0.000779 -0.005286 15 C -0.196882 -0.009524 -0.019117 0.001527 -0.006826 0.006410 16 H 0.000769 -0.000134 0.000004 -0.000004 0.000031 -0.000111 17 H 0.003294 -0.000048 0.000001 -0.000006 -0.000006 -0.000451 18 H 0.011105 0.000175 -0.000025 0.000020 0.000059 -0.007353 19 H 0.001511 0.002941 -0.000053 -0.000069 -0.000018 0.000901 20 H 0.003276 -0.007415 0.000422 -0.000829 0.000186 0.000548 21 H 0.001803 -0.016363 0.000718 -0.000195 0.000157 -0.000309 22 H 0.000583 -0.000314 0.000017 -0.000006 0.000004 -0.000167 23 H 0.012167 -0.003544 0.000079 0.000011 -0.000009 0.000232 24 H 0.000163 0.000331 -0.000000 -0.000000 -0.000000 0.000058 25 H 0.011911 0.002362 0.001099 -0.000880 0.001245 -0.019533 26 H 0.035368 0.000076 -0.000319 0.000058 0.001628 -0.003838 27 H -0.002473 -0.000990 0.000153 -0.000032 0.000075 -0.000922 28 H 0.027974 -0.016222 -0.005150 0.000242 0.001348 0.000453 29 H 0.053190 0.006688 0.000444 0.000027 0.000004 0.000212 7 8 9 10 11 12 1 Co -0.013649 -0.049306 -0.024683 -0.109296 -0.189050 -0.226694 2 S 0.002192 -0.008535 -0.004196 -0.021729 0.007706 -0.004670 3 S -0.000107 -0.000344 -0.000057 0.003561 -0.013684 -0.001526 4 S -0.000078 -0.000784 -0.000112 0.002865 0.002085 0.000260 5 S 0.000192 0.000653 -0.000088 0.002459 -0.021348 -0.001845 6 S -0.019669 -0.035368 0.000893 -0.016312 -0.020017 -0.045961 7 C 4.777735 -0.035018 -0.040308 0.353438 -0.000176 -0.004102 8 C -0.035018 4.845312 -0.036109 0.416755 0.000319 -0.000289 9 C -0.040308 -0.036109 4.748002 0.381519 0.000801 0.002439 10 P 0.353438 0.416755 0.381519 14.768426 -0.005432 -0.012615 11 C -0.000176 0.000319 0.000801 -0.005432 5.535812 0.323004 12 C -0.004102 -0.000289 0.002439 -0.012615 0.323004 5.383347 13 C -0.009849 0.000848 -0.008934 0.021564 -0.073660 0.327949 14 C 0.002710 0.000446 -0.000489 -0.018678 -0.060812 -0.019993 15 C 0.000453 0.000444 -0.001284 -0.008937 0.297626 -0.042938 16 H 0.371525 -0.007270 -0.005598 -0.007849 -0.000083 0.000458 17 H 0.362928 0.005103 -0.004361 -0.020034 0.000517 0.000219 18 H 0.377075 -0.004901 0.004091 -0.036167 -0.000008 0.000137 19 H -0.009079 0.363494 -0.008434 0.003997 -0.000030 0.000058 20 H -0.002827 0.385176 0.005631 -0.028728 -0.000055 0.000202 21 H 0.005369 0.360287 -0.004389 -0.022710 0.000004 0.000024 22 H -0.004780 -0.003545 0.366825 -0.012710 -0.000064 -0.000038 23 H 0.005034 -0.007005 0.371532 -0.034762 0.000293 -0.000148 24 H -0.005585 0.005870 0.359641 -0.026572 0.000205 0.000446 25 H -0.000047 -0.000035 0.000060 0.000522 0.378995 -0.025250 26 H -0.000037 -0.000009 -0.000094 0.001759 -0.021516 0.368263 27 H -0.006525 0.000251 -0.008144 0.003208 0.006692 -0.024924 28 H 0.000043 -0.000007 -0.000138 0.000641 -0.035529 0.005079 29 H -0.000005 -0.000072 0.000288 -0.002842 0.007015 0.002546 13 14 15 16 17 18 1 Co -0.149609 -0.263846 -0.196882 0.000769 0.003294 0.011105 2 S -0.005956 -0.056095 -0.009524 -0.000134 -0.000048 0.000175 3 S 0.002049 0.000284 -0.019117 0.000004 0.000001 -0.000025 4 S -0.000089 -0.000240 0.001527 -0.000004 -0.000006 0.000020 5 S -0.000076 0.000779 -0.006826 0.000031 -0.000006 0.000059 6 S -0.003447 -0.005286 0.006410 -0.000111 -0.000451 -0.007353 7 C -0.009849 0.002710 0.000453 0.371525 0.362928 0.377075 8 C 0.000848 0.000446 0.000444 -0.007270 0.005103 -0.004901 9 C -0.008934 -0.000489 -0.001284 -0.005598 -0.004361 0.004091 10 P 0.021564 -0.018678 -0.008937 -0.007849 -0.020034 -0.036167 11 C -0.073660 -0.060812 0.297626 -0.000083 0.000517 -0.000008 12 C 0.327949 -0.019993 -0.042938 0.000458 0.000219 0.000137 13 C 5.455362 0.322902 -0.067617 0.000425 -0.002234 -0.001361 14 C 0.322902 5.420696 0.361483 -0.000064 0.000539 -0.000089 15 C -0.067617 0.361483 5.458486 -0.000056 -0.000068 0.000116 16 H 0.000425 -0.000064 -0.000056 0.572532 -0.022735 -0.011945 17 H -0.002234 0.000539 -0.000068 -0.022735 0.588787 -0.022793 18 H -0.001361 -0.000089 0.000116 -0.011945 -0.022793 0.518318 19 H -0.000220 0.000071 -0.000026 0.001082 0.000423 -0.001456 20 H -0.000035 -0.000009 0.000053 -0.000792 0.000060 -0.001680 21 H 0.000143 0.000022 -0.000110 0.000231 -0.000080 0.000064 22 H 0.000830 0.000697 -0.000077 0.001106 -0.000462 -0.000069 23 H -0.002793 -0.002729 -0.000014 -0.000034 -0.000140 0.000060 24 H -0.000625 0.001047 0.000563 -0.000939 0.000059 -0.000146 25 H 0.006879 0.004146 -0.039861 0.000001 -0.000010 -0.000040 26 H -0.041394 0.004258 0.006421 0.000003 -0.001544 -0.000000 27 H 0.359876 -0.033114 0.004694 0.000157 0.001493 0.000972 28 H 0.004655 -0.022482 0.367047 -0.000001 0.000004 0.000005 29 H -0.046842 0.364322 -0.027243 -0.000010 -0.000022 -0.000010 19 20 21 22 23 24 1 Co 0.001511 0.003276 0.001803 0.000583 0.012167 0.000163 2 S 0.002941 -0.007415 -0.016363 -0.000314 -0.003544 0.000331 3 S -0.000053 0.000422 0.000718 0.000017 0.000079 -0.000000 4 S -0.000069 -0.000829 -0.000195 -0.000006 0.000011 -0.000000 5 S -0.000018 0.000186 0.000157 0.000004 -0.000009 -0.000000 6 S 0.000901 0.000548 -0.000309 -0.000167 0.000232 0.000058 7 C -0.009079 -0.002827 0.005369 -0.004780 0.005034 -0.005585 8 C 0.363494 0.385176 0.360287 -0.003545 -0.007005 0.005870 9 C -0.008434 0.005631 -0.004389 0.366825 0.371532 0.359641 10 P 0.003997 -0.028728 -0.022710 -0.012710 -0.034762 -0.026572 11 C -0.000030 -0.000055 0.000004 -0.000064 0.000293 0.000205 12 C 0.000058 0.000202 0.000024 -0.000038 -0.000148 0.000446 13 C -0.000220 -0.000035 0.000143 0.000830 -0.002793 -0.000625 14 C 0.000071 -0.000009 0.000022 0.000697 -0.002729 0.001047 15 C -0.000026 0.000053 -0.000110 -0.000077 -0.000014 0.000563 16 H 0.001082 -0.000792 0.000231 0.001106 -0.000034 -0.000939 17 H 0.000423 0.000060 -0.000080 -0.000462 -0.000140 0.000059 18 H -0.001456 -0.001680 0.000064 -0.000069 0.000060 -0.000146 19 H 0.581900 -0.018600 -0.019909 0.000127 -0.000745 0.000199 20 H -0.018600 0.507467 -0.010740 0.000369 0.000010 -0.000017 21 H -0.019909 -0.010740 0.519650 -0.001148 -0.001822 0.000177 22 H 0.000127 0.000369 -0.001148 0.565049 -0.013809 -0.014572 23 H -0.000745 0.000010 -0.001822 -0.013809 0.568855 -0.032738 24 H 0.000199 -0.000017 0.000177 -0.014572 -0.032738 0.614117 25 H 0.000001 0.000008 0.000002 -0.000001 0.000011 0.000011 26 H -0.000011 -0.000020 0.000011 -0.000009 -0.000015 -0.000011 27 H 0.000068 -0.000031 -0.000071 0.000013 0.001112 0.002193 28 H 0.000001 -0.000006 0.000001 0.000001 -0.000075 -0.000035 29 H -0.000020 0.000013 0.000016 0.000247 -0.001498 -0.003230 25 26 27 28 29 1 Co 0.011911 0.035368 -0.002473 0.027974 0.053190 2 S 0.002362 0.000076 -0.000990 -0.016222 0.006688 3 S 0.001099 -0.000319 0.000153 -0.005150 0.000444 4 S -0.000880 0.000058 -0.000032 0.000242 0.000027 5 S 0.001245 0.001628 0.000075 0.001348 0.000004 6 S -0.019533 -0.003838 -0.000922 0.000453 0.000212 7 C -0.000047 -0.000037 -0.006525 0.000043 -0.000005 8 C -0.000035 -0.000009 0.000251 -0.000007 -0.000072 9 C 0.000060 -0.000094 -0.008144 -0.000138 0.000288 10 P 0.000522 0.001759 0.003208 0.000641 -0.002842 11 C 0.378995 -0.021516 0.006692 -0.035529 0.007015 12 C -0.025250 0.368263 -0.024924 0.005079 0.002546 13 C 0.006879 -0.041394 0.359876 0.004655 -0.046842 14 C 0.004146 0.004258 -0.033114 -0.022482 0.364322 15 C -0.039861 0.006421 0.004694 0.367047 -0.027243 16 H 0.000001 0.000003 0.000157 -0.000001 -0.000010 17 H -0.000010 -0.001544 0.001493 0.000004 -0.000022 18 H -0.000040 -0.000000 0.000972 0.000005 -0.000010 19 H 0.000001 -0.000011 0.000068 0.000001 -0.000020 20 H 0.000008 -0.000020 -0.000031 -0.000006 0.000013 21 H 0.000002 0.000011 -0.000071 0.000001 0.000016 22 H -0.000001 -0.000009 0.000013 0.000001 0.000247 23 H 0.000011 -0.000015 0.001112 -0.000075 -0.001498 24 H 0.000011 -0.000011 0.002193 -0.000035 -0.003230 25 H 0.508288 -0.005386 0.000068 -0.006019 0.000136 26 H -0.005386 0.506549 -0.005550 0.000227 0.000100 27 H 0.000068 -0.005550 0.570242 -0.000099 -0.003928 28 H -0.006019 0.000227 -0.000099 0.515818 -0.005221 29 H 0.000136 0.000100 -0.003928 -0.005221 0.532500 Mulliken charges: 1 1 Co -0.701258 2 S 0.002275 3 S 0.004451 4 S -0.017909 5 S -0.002367 6 S 0.008238 7 C -0.106853 8 C -0.196361 9 C -0.094303 10 P -0.575338 11 C -0.119610 12 C -0.003438 13 C -0.088743 14 C -0.000477 15 C -0.084744 16 H 0.109300 17 H 0.111570 18 H 0.175844 19 H 0.101897 20 H 0.168363 21 H 0.189168 22 H 0.115901 23 H 0.142486 24 H 0.099389 25 H 0.181315 26 H 0.155029 27 H 0.135535 28 H 0.167445 29 H 0.123193 Sum of Mulliken charges = -0.00000 Mulliken charges with hydrogens summed into heavy atoms: 1 1 Co -0.701258 2 S 0.002275 3 S 0.004451 4 S -0.017909 5 S -0.002367 6 S 0.008238 7 C 0.289861 8 C 0.263066 9 C 0.263474 10 P -0.575338 11 C 0.061706 12 C 0.151591 13 C 0.046793 14 C 0.122717 15 C 0.082702 Electronic spatial extent (au): = 4914.9985 Charge= 0.0000 electrons Dipole moment (field-independent basis, Debye): X= 7.8209 Y= 0.5254 Z= 0.0298 Tot= 7.8385 Quadrupole moment (field-independent basis, Debye-Ang): XX= -137.0173 YY= -139.6081 ZZ= -149.1762 XY= -6.9515 XZ= -0.0291 YZ= 0.3980 Traceless Quadrupole moment (field-independent basis, Debye-Ang): XX= 4.9166 YY= 2.3258 ZZ= -7.2423 XY= -6.9515 XZ= -0.0291 YZ= 0.3980 Octapole moment (field-independent basis, Debye-Ang**2): XXX= 74.5512 YYY= -8.5489 ZZZ= 0.9956 XYY= 13.2666 XXY= -6.0139 XXZ= 0.2169 XZZ= 21.6376 YZZ= 12.1215 YYZ= -1.1643 XYZ= 0.0014 Hexadecapole moment (field-independent basis, Debye-Ang**3): XXXX= -3655.2183 YYYY= -1809.3856 ZZZZ= -1492.3711 XXXY= -27.9713 XXXZ= -0.0878 YYYX= -62.7070 YYYZ= -1.9821 ZZZX= 0.5452 ZZZY= 3.9824 XXYY= -888.3451 XXZZ= -852.9613 YYZZ= -521.9714 XXYZ= 0.6917 YYXZ= -0.1718 ZZXY= -3.9594 N-N= 2.582991089426D+03 E-N=-1.473206130817D+04 KE= 4.023120979592D+03 Running external command "gaunbo7 R" input file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EIn" output file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EOu" message file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EMs" fchk file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EFC" mat. el file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EUF" Writing WrtUnf unformatted file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EUF" Gaussian matrix elements Version 2 NLab=11 Len12L=8 Len4L=8 Write SHELL TO ATOM MAP from file 0 offset 0 length 436 to matrix element file. Write SHELL TYPES from file 0 offset 0 length 436 to matrix element file. Write NUMBER OF PRIMITIVES PER SHELL from file 0 offset 0 length 436 to matrix element file. Write PRIMITIVE EXPONENTS from file 0 offset 0 length 718 to matrix element file. Write CONTRACTION COEFFICIENTS from file 0 offset 0 length 718 to matrix element file. Write P(S=P) CONTRACTION COEFFICIENTS from file 0 offset 0 length 718 to matrix element file. Write COORDINATES OF EACH SHELL from file 0 offset 0 length 1308 to matrix element file. Write BONDS PER ATOM from file 0 offset 0 length 29 to matrix element file. Write BONDED ATOMS from file 0 offset 0 length 68 to matrix element file. Write BOND TYPES from file 0 offset 0 length 68 to matrix element file. Write ONIOM CHARGE/MULT from file 0 offset 0 length 32 to matrix element file. Write ONIOM ATOM LAYERS from file 0 offset 0 length 29 to matrix element file. Write ONIOM ATOM MODIFIERS from file 0 offset 0 length 29 to matrix element file. Write ONIOM ATOM TYPES from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK ATOMS from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK CHARGES from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK DISTANCES from file 0 offset 0 length 116 to matrix element file. Write SYMINF INTS from file 0 offset 0 length 26 to matrix element file. Write ROTTR TO SO from file 0 offset 0 length 12 to matrix element file. Write GAUSSIAN SCALARS from file 501 offset 0 to matrix element file. Write OPTIMIZATION FLAGS from file 0 offset 0 length 29 to matrix element file. Write INTEGER ISO from file 0 offset 0 length 29 to matrix element file. Write INTEGER SPIN from file 0 offset 0 length 29 to matrix element file. Write REAL ZEFFECTIVE from file 0 offset 0 length 29 to matrix element file. Write REAL QUADRUPOLEMOMENT from file 0 offset 0 length 29 to matrix element file. Write REAL GFACTOR from file 0 offset 0 length 29 to matrix element file. Write REAL ZNUCLEAR from file 0 offset 0 length 29 to matrix element file. Write MULLIKEN CHARGES from file 0 offset 0 length 29 to matrix element file. Write NUCLEAR GRADIENT from file 10584 offset 0 length 87 to matrix element file. Array NUCLEAR FORCE CONSTANTS on file 10585 does not exist. Write ELECTRIC DIPOLE MOMENT from file 0 offset 0 length 3 to matrix element file. Write NON-ADIABATIC COUPLING from file 10810 offset 0 length 87 to matrix element file. Write FINITE EM FIELD from file 10521 offset 0 length 35 to matrix element file. Write OVERLAP from file 10514 offset 0 length 975106 to matrix element file. Write CORE HAMILTONIAN ALPHA from file 10515 offset 0 length 975106 to matrix element file. Write CORE HAMILTONIAN BETA from file 10515 offset 975106 length 975106 to matrix element file. Write KINETIC ENERGY from file 10516 offset 0 length 975106 to matrix element file. Write ORTHOGONAL BASIS from file 10685 offset 0 length 1948816 to matrix element file. Write DIPOLE INTEGRALS from file 10518 offset 0 length 2925318 to matrix element file. Array DIP VEL INTEGRALS on file 10572 does not exist. Array R X DEL INTEGRALS on file 10572 does not exist. Write ALPHA ORBITAL ENERGIES from file 0 offset 0 length 1396 to matrix element file. Write ALPHA MO COEFFICIENTS from file 10524 offset 0 length 1948816 to matrix element file. Write ALPHA DENSITY MATRIX from file 0 offset 0 length 975106 to matrix element file. Write ALPHA FOCK MATRIX from file 10536 offset 0 length 975106 to matrix element file. Write ENERGY-WEIGHTED DENSITY from file 10571 offset 0 length 975106 to matrix element file. Write ALPHA SCF DENSITY MATRIX from file 0 offset 0 length 975106 to matrix element file. Write INTEGER PARAMETERS from file 0 offset 0 length 2 to matrix element file. No 2e integrals to process. Perform NBO analysis...executing G16NBO... *********************************** NBO 7.0 *********************************** N A T U R A L A T O M I C O R B I T A L A N D N A T U R A L B O N D O R B I T A L A N A L Y S I S *********************** Santiago Lacalle Puig (S102540) *********************** (c) Copyright 1996-2021 Board of Regents of the University of Wisconsin System on behalf of the Theoretical Chemistry Institute. All rights reserved. Cite this program [NBO 7.0.10 (8-Feb-2021)] as: NBO 7.0. E. D. Glendening, J. K. Badenhoop, A. E. Reed, J. E. Carpenter, J. A. Bohmann, C. M. Morales, P. Karafiloglou, C. R. Landis, and F. Weinhold, Theoretical Chemistry Institute, University of Wisconsin, Madison, WI (2018) /MCB / : Search for 3-center NBOs /AONBO / : Checkpoint the AO to NBO transformation NBOs sorted by occupancy /BNDIDX / : Print bond indices based on the NAO density matrix Filename set to /rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau- Job title: CMPSCO NATURAL POPULATIONS: Natural atomic orbital occupancies NAO Atom No lang Type(AO) Occupancy Energy ------------------------------------------------------- 1 Co 1 s Cor( 1s) 2.00000 -198.30421 2 Co 1 s Cor( 2s) 2.00000 -111.50072 3 Co 1 s Cor( 3s) 1.99999 -3.73450 4 Co 1 s Val( 4s) 0.36280 0.57952 5 Co 1 s Ryd( 5s) 0.00494 1.91605 6 Co 1 s Ryd( 6s) 0.00112 3.71200 7 Co 1 s Ryd( 7s) 0.00004 8.40593 8 Co 1 s Ryd( 8s) 0.00000 13.18238 9 Co 1 s Ryd( 9s) 0.00000 43.45036 10 Co 1 s Ryd(11s) 0.00000 769.99642 11 Co 1 s Ryd(10s) 0.00000 129.92491 12 Co 1 px Cor( 2p) 2.00000 -27.97864 13 Co 1 px Cor( 3p) 1.99996 -2.87955 14 Co 1 px Ryd( 7p) 0.00973 2.31877 15 Co 1 px Ryd( 6p) 0.00177 2.65241 16 Co 1 px Ryd( 4p) 0.00065 1.09601 17 Co 1 px Ryd( 5p) 0.00036 2.61593 18 Co 1 py Cor( 2p) 2.00000 -27.98852 19 Co 1 py Cor( 3p) 1.99993 -2.89658 20 Co 1 py Ryd( 7p) 0.00281 4.94631 21 Co 1 py Ryd( 6p) 0.00168 3.76648 22 Co 1 py Ryd( 4p) 0.00028 1.23446 23 Co 1 py Ryd( 5p) 0.00030 3.21340 24 Co 1 pz Cor( 2p) 2.00000 -27.97601 25 Co 1 pz Cor( 3p) 1.99997 -2.87484 26 Co 1 pz Ryd( 7p) 0.00327 1.61080 27 Co 1 pz Ryd( 6p) 0.00188 2.24769 28 Co 1 pz Ryd( 4p) 0.00030 0.85323 29 Co 1 pz Ryd( 5p) 0.00035 2.55011 30 Co 1 dxy Val( 3d) 1.44365 -0.23230 31 Co 1 dxy Ryd( 4d) 0.00662 1.92391 32 Co 1 dxy Ryd( 5d) 0.00148 2.04885 33 Co 1 dxy Ryd( 6d) 0.00009 5.05539 34 Co 1 dxy Ryd( 7d) 0.00001 5.38913 35 Co 1 dxz Val( 3d) 1.72876 -0.21654 36 Co 1 dxz Ryd( 4d) 0.00472 1.10238 37 Co 1 dxz Ryd( 5d) 0.00326 1.22703 38 Co 1 dxz Ryd( 6d) 0.00002 4.04170 39 Co 1 dxz Ryd( 7d) 0.00001 4.69204 40 Co 1 dyz Val( 3d) 1.53508 -0.23206 41 Co 1 dyz Ryd( 4d) 0.00634 1.63442 42 Co 1 dyz Ryd( 5d) 0.00183 1.63642 43 Co 1 dyz Ryd( 6d) 0.00011 4.39441 44 Co 1 dyz Ryd( 7d) 0.00002 4.97700 45 Co 1 dx2y2 Val( 3d) 1.89880 -0.23418 46 Co 1 dx2y2 Ryd( 4d) 0.00470 1.52453 47 Co 1 dx2y2 Ryd( 5d) 0.00332 2.21827 48 Co 1 dx2y2 Ryd( 6d) 0.00010 5.73623 49 Co 1 dx2y2 Ryd( 7d) 0.00001 4.73859 50 Co 1 dz2 Val( 3d) 1.88298 -0.22061 51 Co 1 dz2 Ryd( 4d) 0.00668 1.16871 52 Co 1 dz2 Ryd( 5d) 0.00196 1.02788 53 Co 1 dz2 Ryd( 6d) 0.00006 4.79929 54 Co 1 dz2 Ryd( 7d) 0.00001 4.78993 55 Co 1 f(0) Ryd( 4f) 0.00054 2.50478 56 Co 1 f(0) Ryd( 5f) 0.00007 3.34562 57 Co 1 f(0) Ryd( 6f) 0.00001 6.95006 58 Co 1 f(0) Ryd( 7f) 0.00000 17.36333 59 Co 1 f(c1) Ryd( 4f) 0.00076 2.71213 60 Co 1 f(c1) Ryd( 5f) 0.00009 3.71736 61 Co 1 f(c1) Ryd( 6f) 0.00000 7.07048 62 Co 1 f(c1) Ryd( 7f) 0.00000 17.41490 63 Co 1 f(s1) Ryd( 4f) 0.00087 3.26293 64 Co 1 f(s1) Ryd( 5f) 0.00010 4.06807 65 Co 1 f(s1) Ryd( 6f) 0.00000 6.90891 66 Co 1 f(s1) Ryd( 7f) 0.00000 17.29454 67 Co 1 f(c2) Ryd( 4f) 0.00089 2.93063 68 Co 1 f(c2) Ryd( 5f) 0.00007 3.37430 69 Co 1 f(c2) Ryd( 6f) 0.00001 6.82812 70 Co 1 f(c2) Ryd( 7f) 0.00000 17.31351 71 Co 1 f(s2) Ryd( 4f) 0.00044 3.47222 72 Co 1 f(s2) Ryd( 5f) 0.00005 4.40936 73 Co 1 f(s2) Ryd( 6f) 0.00001 6.92450 74 Co 1 f(s2) Ryd( 7f) 0.00000 17.23230 75 Co 1 f(c3) Ryd( 4f) 0.00105 3.28220 76 Co 1 f(c3) Ryd( 5f) 0.00010 4.29115 77 Co 1 f(c3) Ryd( 6f) 0.00001 6.92598 78 Co 1 f(c3) Ryd( 7f) 0.00000 17.19477 79 Co 1 f(s3) Ryd( 4f) 0.00075 3.48804 80 Co 1 f(s3) Ryd( 5f) 0.00007 3.85834 81 Co 1 f(s3) Ryd( 6f) 0.00001 6.85458 82 Co 1 f(s3) Ryd( 7f) 0.00000 17.20369 83 Co 1 g(0) Ryd( 5g) 0.00000 6.42844 84 Co 1 g(0) Ryd( 6g) 0.00000 20.23173 85 Co 1 g(c1) Ryd( 5g) 0.00000 6.30481 86 Co 1 g(c1) Ryd( 6g) 0.00000 20.19224 87 Co 1 g(s1) Ryd( 5g) 0.00000 6.47996 88 Co 1 g(s1) Ryd( 6g) 0.00000 20.23352 89 Co 1 g(c2) Ryd( 5g) 0.00000 6.35102 90 Co 1 g(c2) Ryd( 6g) 0.00000 20.20411 91 Co 1 g(s2) Ryd( 5g) 0.00000 6.66720 92 Co 1 g(s2) Ryd( 6g) 0.00000 20.28782 93 Co 1 g(c3) Ryd( 5g) 0.00000 6.64423 94 Co 1 g(c3) Ryd( 6g) 0.00000 20.27578 95 Co 1 g(s3) Ryd( 5g) 0.00000 6.49286 96 Co 1 g(s3) Ryd( 6g) 0.00000 20.24080 97 Co 1 g(c4) Ryd( 5g) 0.00000 6.61599 98 Co 1 g(c4) Ryd( 6g) 0.00000 20.26474 99 Co 1 g(s4) Ryd( 5g) 0.00000 6.57918 100 Co 1 g(s4) Ryd( 6g) 0.00000 20.25609 101 S 2 s Cor( 1s) 2.00000 -87.34503 102 S 2 s Cor( 2s) 2.00000 -9.18083 103 S 2 s Val( 3s) 1.80915 -0.54436 104 S 2 s Ryd( 4s) 0.00442 3.08043 105 S 2 s Ryd( 5s) 0.00010 5.74025 106 S 2 s Ryd( 6s) 0.00000 7.94815 107 S 2 s Ryd( 7s) 0.00000 42.36671 108 S 2 s Ryd( 9s) 0.00000 312.37280 109 S 2 s Ryd( 8s) 0.00000 189.76235 110 S 2 px Cor( 2p) 1.99999 -5.85470 111 S 2 px Val( 3p) 1.05398 -0.18564 112 S 2 px Ryd( 4p) 0.00343 1.59827 113 S 2 px Ryd( 5p) 0.00022 1.62680 114 S 2 px Ryd( 6p) 0.00002 5.04923 115 S 2 px Ryd( 7p) 0.00000 28.23302 116 S 2 py Cor( 2p) 1.99999 -5.84531 117 S 2 py Val( 3p) 1.75176 -0.21157 118 S 2 py Ryd( 4p) 0.00176 1.11662 119 S 2 py Ryd( 5p) 0.00020 1.26823 120 S 2 py Ryd( 6p) 0.00001 4.76476 121 S 2 py Ryd( 7p) 0.00000 28.27972 122 S 2 pz Cor( 2p) 1.99999 -5.84745 123 S 2 pz Val( 3p) 1.59056 -0.21215 124 S 2 pz Ryd( 4p) 0.00161 1.21832 125 S 2 pz Ryd( 5p) 0.00025 1.35869 126 S 2 pz Ryd( 6p) 0.00001 5.24916 127 S 2 pz Ryd( 7p) 0.00000 28.27006 128 S 2 dxy Ryd( 3d) 0.00653 0.99449 129 S 2 dxy Ryd( 4d) 0.00082 1.55083 130 S 2 dxy Ryd( 5d) 0.00001 3.88466 131 S 2 dxy Ryd( 6d) 0.00000 8.59625 132 S 2 dxz Ryd( 3d) 0.00688 1.07623 133 S 2 dxz Ryd( 4d) 0.00153 1.54453 134 S 2 dxz Ryd( 5d) 0.00002 3.99566 135 S 2 dxz Ryd( 6d) 0.00000 8.49057 136 S 2 dyz Ryd( 3d) 0.00557 0.96884 137 S 2 dyz Ryd( 4d) 0.00117 1.39538 138 S 2 dyz Ryd( 5d) 0.00001 3.80290 139 S 2 dyz Ryd( 6d) 0.00000 8.54114 140 S 2 dx2y2 Ryd( 3d) 0.00696 1.00972 141 S 2 dx2y2 Ryd( 4d) 0.00125 1.64482 142 S 2 dx2y2 Ryd( 5d) 0.00001 4.07513 143 S 2 dx2y2 Ryd( 6d) 0.00000 8.54139 144 S 2 dz2 Ryd( 3d) 0.00433 1.18535 145 S 2 dz2 Ryd( 4d) 0.00152 1.52996 146 S 2 dz2 Ryd( 5d) 0.00000 3.91264 147 S 2 dz2 Ryd( 6d) 0.00000 8.57231 148 S 2 f(0) Ryd( 4f) 0.00030 2.02092 149 S 2 f(0) Ryd( 5f) 0.00007 3.58185 150 S 2 f(c1) Ryd( 4f) 0.00064 2.06668 151 S 2 f(c1) Ryd( 5f) 0.00004 3.98159 152 S 2 f(s1) Ryd( 4f) 0.00035 1.76929 153 S 2 f(s1) Ryd( 5f) 0.00003 3.59787 154 S 2 f(c2) Ryd( 4f) 0.00044 2.01159 155 S 2 f(c2) Ryd( 5f) 0.00006 3.60589 156 S 2 f(s2) Ryd( 4f) 0.00043 1.87150 157 S 2 f(s2) Ryd( 5f) 0.00003 3.63659 158 S 2 f(c3) Ryd( 4f) 0.00086 2.05617 159 S 2 f(c3) Ryd( 5f) 0.00005 3.87681 160 S 2 f(s3) Ryd( 4f) 0.00083 2.04518 161 S 2 f(s3) Ryd( 5f) 0.00005 3.96199 162 S 2 g(0) Ryd( 5g) 0.00002 3.71364 163 S 2 g(c1) Ryd( 5g) 0.00003 3.70817 164 S 2 g(s1) Ryd( 5g) 0.00001 3.56041 165 S 2 g(c2) Ryd( 5g) 0.00003 3.62523 166 S 2 g(s2) Ryd( 5g) 0.00003 3.81800 167 S 2 g(c3) Ryd( 5g) 0.00001 3.66153 168 S 2 g(s3) Ryd( 5g) 0.00001 3.66898 169 S 2 g(c4) Ryd( 5g) 0.00003 3.79756 170 S 2 g(s4) Ryd( 5g) 0.00004 3.75004 171 S 3 s Cor( 1s) 2.00000 -87.85771 172 S 3 s Cor( 2s) 2.00000 -8.74533 173 S 3 s Val( 3s) 1.77647 -0.56262 174 S 3 s Ryd( 4s) 0.00703 2.14504 175 S 3 s Ryd( 5s) 0.00004 7.56616 176 S 3 s Ryd( 6s) 0.00000 9.42752 177 S 3 s Ryd( 7s) 0.00000 40.05466 178 S 3 s Ryd( 8s) 0.00000 209.10645 179 S 3 s Ryd( 9s) 0.00000 290.16263 180 S 3 px Cor( 2p) 1.99999 -5.89019 181 S 3 px Val( 3p) 1.12449 -0.20805 182 S 3 px Ryd( 4p) 0.00396 0.90677 183 S 3 px Ryd( 5p) 0.00026 1.25439 184 S 3 px Ryd( 6p) 0.00001 6.85560 185 S 3 px Ryd( 7p) 0.00000 27.95981 186 S 3 py Cor( 2p) 1.99999 -5.88382 187 S 3 py Val( 3p) 1.59764 -0.22857 188 S 3 py Ryd( 4p) 0.00316 0.53833 189 S 3 py Ryd( 5p) 0.00020 1.31171 190 S 3 py Ryd( 6p) 0.00001 5.36218 191 S 3 py Ryd( 7p) 0.00000 28.37940 192 S 3 pz Cor( 2p) 1.99999 -5.88619 193 S 3 pz Val( 3p) 1.44243 -0.22334 194 S 3 pz Ryd( 4p) 0.00464 0.74345 195 S 3 pz Ryd( 5p) 0.00022 1.26388 196 S 3 pz Ryd( 6p) 0.00001 5.48106 197 S 3 pz Ryd( 7p) 0.00000 28.31836 198 S 3 dxy Ryd( 3d) 0.01233 0.66229 199 S 3 dxy Ryd( 4d) 0.00009 1.86923 200 S 3 dxy Ryd( 5d) 0.00002 3.98791 201 S 3 dxy Ryd( 6d) 0.00000 8.39410 202 S 3 dxz Ryd( 3d) 0.01124 0.64245 203 S 3 dxz Ryd( 4d) 0.00012 1.86028 204 S 3 dxz Ryd( 5d) 0.00002 4.01039 205 S 3 dxz Ryd( 6d) 0.00000 8.53720 206 S 3 dyz Ryd( 3d) 0.01021 0.63472 207 S 3 dyz Ryd( 4d) 0.00011 1.86928 208 S 3 dyz Ryd( 5d) 0.00001 3.91368 209 S 3 dyz Ryd( 6d) 0.00000 8.48419 210 S 3 dx2y2 Ryd( 3d) 0.01490 0.66988 211 S 3 dx2y2 Ryd( 4d) 0.00009 1.88607 212 S 3 dx2y2 Ryd( 5d) 0.00002 4.23924 213 S 3 dx2y2 Ryd( 6d) 0.00000 8.26689 214 S 3 dz2 Ryd( 3d) 0.00875 0.63037 215 S 3 dz2 Ryd( 4d) 0.00016 1.93047 216 S 3 dz2 Ryd( 5d) 0.00001 3.94743 217 S 3 dz2 Ryd( 6d) 0.00000 8.37609 218 S 3 f(0) Ryd( 4f) 0.00020 1.67292 219 S 3 f(0) Ryd( 5f) 0.00002 3.70495 220 S 3 f(c1) Ryd( 4f) 0.00075 1.77824 221 S 3 f(c1) Ryd( 5f) 0.00002 3.93729 222 S 3 f(s1) Ryd( 4f) 0.00069 1.60841 223 S 3 f(s1) Ryd( 5f) 0.00002 3.77998 224 S 3 f(c2) Ryd( 4f) 0.00044 1.72983 225 S 3 f(c2) Ryd( 5f) 0.00003 3.69536 226 S 3 f(s2) Ryd( 4f) 0.00067 1.69773 227 S 3 f(s2) Ryd( 5f) 0.00002 3.83379 228 S 3 f(c3) Ryd( 4f) 0.00074 1.78735 229 S 3 f(c3) Ryd( 5f) 0.00003 3.82460 230 S 3 f(s3) Ryd( 4f) 0.00078 1.81413 231 S 3 f(s3) Ryd( 5f) 0.00002 3.81016 232 S 3 g(0) Ryd( 5g) 0.00004 3.57778 233 S 3 g(c1) Ryd( 5g) 0.00005 3.61893 234 S 3 g(s1) Ryd( 5g) 0.00002 3.55061 235 S 3 g(c2) Ryd( 5g) 0.00005 3.60409 236 S 3 g(s2) Ryd( 5g) 0.00006 3.57211 237 S 3 g(c3) Ryd( 5g) 0.00004 3.57502 238 S 3 g(s3) Ryd( 5g) 0.00003 3.59675 239 S 3 g(c4) Ryd( 5g) 0.00007 3.63968 240 S 3 g(s4) Ryd( 5g) 0.00008 3.65630 241 S 4 s Cor( 1s) 2.00000 -87.97546 242 S 4 s Cor( 2s) 2.00000 -8.62260 243 S 4 s Val( 3s) 1.80021 -0.57062 244 S 4 s Ryd( 4s) 0.00502 1.82970 245 S 4 s Ryd( 5s) 0.00004 6.29073 246 S 4 s Ryd( 6s) 0.00000 9.82566 247 S 4 s Ryd( 7s) 0.00000 43.53274 248 S 4 s Ryd( 8s) 0.00000 198.86641 249 S 4 s Ryd( 9s) 0.00000 297.73335 250 S 4 px Cor( 2p) 1.99999 -5.88102 251 S 4 px Val( 3p) 1.67807 -0.23233 252 S 4 px Ryd( 4p) 0.00302 0.68021 253 S 4 px Ryd( 5p) 0.00033 1.27373 254 S 4 px Ryd( 6p) 0.00001 5.07276 255 S 4 px Ryd( 7p) 0.00000 28.40135 256 S 4 py Cor( 2p) 1.99999 -5.88288 257 S 4 py Val( 3p) 1.51071 -0.22618 258 S 4 py Ryd( 4p) 0.00158 0.56438 259 S 4 py Ryd( 5p) 0.00026 1.29808 260 S 4 py Ryd( 6p) 0.00001 5.79390 261 S 4 py Ryd( 7p) 0.00000 28.34243 262 S 4 pz Cor( 2p) 1.99999 -5.88998 263 S 4 pz Val( 3p) 0.98652 -0.20362 264 S 4 pz Ryd( 4p) 0.00487 0.64204 265 S 4 pz Ryd( 5p) 0.00019 1.37819 266 S 4 pz Ryd( 6p) 0.00000 6.15642 267 S 4 pz Ryd( 7p) 0.00000 28.10456 268 S 4 dxy Ryd( 3d) 0.00846 0.55717 269 S 4 dxy Ryd( 4d) 0.00012 1.84449 270 S 4 dxy Ryd( 5d) 0.00001 3.73815 271 S 4 dxy Ryd( 6d) 0.00000 8.46581 272 S 4 dxz Ryd( 3d) 0.00775 0.69099 273 S 4 dxz Ryd( 4d) 0.00013 2.10956 274 S 4 dxz Ryd( 5d) 0.00001 3.90213 275 S 4 dxz Ryd( 6d) 0.00000 8.12752 276 S 4 dyz Ryd( 3d) 0.01528 0.81441 277 S 4 dyz Ryd( 4d) 0.00008 2.34618 278 S 4 dyz Ryd( 5d) 0.00002 4.01612 279 S 4 dyz Ryd( 6d) 0.00000 7.96210 280 S 4 dx2y2 Ryd( 3d) 0.00459 0.54260 281 S 4 dx2y2 Ryd( 4d) 0.00005 1.76637 282 S 4 dx2y2 Ryd( 5d) 0.00002 3.65005 283 S 4 dx2y2 Ryd( 6d) 0.00000 8.48667 284 S 4 dz2 Ryd( 3d) 0.01386 0.62443 285 S 4 dz2 Ryd( 4d) 0.00008 1.80980 286 S 4 dz2 Ryd( 5d) 0.00002 3.84290 287 S 4 dz2 Ryd( 6d) 0.00000 8.40376 288 S 4 f(0) Ryd( 4f) 0.00027 1.73020 289 S 4 f(0) Ryd( 5f) 0.00002 3.64976 290 S 4 f(c1) Ryd( 4f) 0.00060 1.73892 291 S 4 f(c1) Ryd( 5f) 0.00002 3.84340 292 S 4 f(s1) Ryd( 4f) 0.00093 1.93460 293 S 4 f(s1) Ryd( 5f) 0.00003 4.02868 294 S 4 f(c2) Ryd( 4f) 0.00011 1.70294 295 S 4 f(c2) Ryd( 5f) 0.00003 3.69383 296 S 4 f(s2) Ryd( 4f) 0.00077 1.82546 297 S 4 f(s2) Ryd( 5f) 0.00002 3.93804 298 S 4 f(c3) Ryd( 4f) 0.00025 1.49314 299 S 4 f(c3) Ryd( 5f) 0.00000 3.62373 300 S 4 f(s3) Ryd( 4f) 0.00030 1.45239 301 S 4 f(s3) Ryd( 5f) 0.00001 3.55497 302 S 4 g(0) Ryd( 5g) 0.00004 3.56128 303 S 4 g(c1) Ryd( 5g) 0.00003 3.59540 304 S 4 g(s1) Ryd( 5g) 0.00006 3.70411 305 S 4 g(c2) Ryd( 5g) 0.00004 3.67561 306 S 4 g(s2) Ryd( 5g) 0.00009 3.68212 307 S 4 g(c3) Ryd( 5g) 0.00004 3.62860 308 S 4 g(s3) Ryd( 5g) 0.00002 3.61691 309 S 4 g(c4) Ryd( 5g) 0.00001 3.36989 310 S 4 g(s4) Ryd( 5g) 0.00001 3.37660 311 S 5 s Cor( 1s) 2.00000 -87.87396 312 S 5 s Cor( 2s) 2.00000 -8.72787 313 S 5 s Val( 3s) 1.77584 -0.56177 314 S 5 s Ryd( 4s) 0.00719 2.08416 315 S 5 s Ryd( 5s) 0.00003 7.72338 316 S 5 s Ryd( 6s) 0.00000 8.95389 317 S 5 s Ryd( 7s) 0.00000 40.48829 318 S 5 s Ryd( 8s) 0.00000 203.38555 319 S 5 s Ryd( 9s) 0.00000 295.79496 320 S 5 px Cor( 2p) 1.99999 -5.88969 321 S 5 px Val( 3p) 1.11953 -0.20736 322 S 5 px Ryd( 4p) 0.00400 0.87690 323 S 5 px Ryd( 5p) 0.00026 1.25161 324 S 5 px Ryd( 6p) 0.00001 6.90775 325 S 5 px Ryd( 7p) 0.00000 27.95251 326 S 5 py Cor( 2p) 1.99999 -5.88233 327 S 5 py Val( 3p) 1.65814 -0.22922 328 S 5 py Ryd( 4p) 0.00362 0.49921 329 S 5 py Ryd( 5p) 0.00019 1.31352 330 S 5 py Ryd( 6p) 0.00001 5.04545 331 S 5 py Ryd( 7p) 0.00000 28.41150 332 S 5 pz Cor( 2p) 1.99999 -5.88641 333 S 5 pz Val( 3p) 1.38459 -0.22128 334 S 5 pz Ryd( 4p) 0.00431 0.73616 335 S 5 pz Ryd( 5p) 0.00023 1.26622 336 S 5 pz Ryd( 6p) 0.00001 5.79797 337 S 5 pz Ryd( 7p) 0.00000 28.29459 338 S 5 dxy Ryd( 3d) 0.01121 0.64500 339 S 5 dxy Ryd( 4d) 0.00008 1.83625 340 S 5 dxy Ryd( 5d) 0.00002 3.93363 341 S 5 dxy Ryd( 6d) 0.00000 8.43073 342 S 5 dxz Ryd( 3d) 0.01211 0.64930 343 S 5 dxz Ryd( 4d) 0.00012 1.87358 344 S 5 dxz Ryd( 5d) 0.00001 4.03108 345 S 5 dxz Ryd( 6d) 0.00000 8.51668 346 S 5 dyz Ryd( 3d) 0.00931 0.62003 347 S 5 dyz Ryd( 4d) 0.00008 1.81370 348 S 5 dyz Ryd( 5d) 0.00001 3.86030 349 S 5 dyz Ryd( 6d) 0.00000 8.50655 350 S 5 dx2y2 Ryd( 3d) 0.01472 0.66363 351 S 5 dx2y2 Ryd( 4d) 0.00009 1.85707 352 S 5 dx2y2 Ryd( 5d) 0.00002 4.27361 353 S 5 dx2y2 Ryd( 6d) 0.00000 8.25637 354 S 5 dz2 Ryd( 3d) 0.01005 0.66094 355 S 5 dz2 Ryd( 4d) 0.00017 2.05856 356 S 5 dz2 Ryd( 5d) 0.00001 4.01085 357 S 5 dz2 Ryd( 6d) 0.00000 8.29969 358 S 5 f(0) Ryd( 4f) 0.00020 1.68242 359 S 5 f(0) Ryd( 5f) 0.00003 3.71223 360 S 5 f(c1) Ryd( 4f) 0.00080 1.81644 361 S 5 f(c1) Ryd( 5f) 0.00002 3.98874 362 S 5 f(s1) Ryd( 4f) 0.00068 1.61663 363 S 5 f(s1) Ryd( 5f) 0.00002 3.78933 364 S 5 f(c2) Ryd( 4f) 0.00043 1.71632 365 S 5 f(c2) Ryd( 5f) 0.00003 3.66704 366 S 5 f(s2) Ryd( 4f) 0.00060 1.66409 367 S 5 f(s2) Ryd( 5f) 0.00002 3.78591 368 S 5 f(c3) Ryd( 4f) 0.00080 1.77744 369 S 5 f(c3) Ryd( 5f) 0.00003 3.81882 370 S 5 f(s3) Ryd( 4f) 0.00081 1.80085 371 S 5 f(s3) Ryd( 5f) 0.00002 3.78638 372 S 5 g(0) Ryd( 5g) 0.00003 3.61487 373 S 5 g(c1) Ryd( 5g) 0.00006 3.64043 374 S 5 g(s1) Ryd( 5g) 0.00003 3.53961 375 S 5 g(c2) Ryd( 5g) 0.00005 3.62703 376 S 5 g(s2) Ryd( 5g) 0.00006 3.56654 377 S 5 g(c3) Ryd( 5g) 0.00003 3.55814 378 S 5 g(s3) Ryd( 5g) 0.00002 3.56338 379 S 5 g(c4) Ryd( 5g) 0.00007 3.63266 380 S 5 g(s4) Ryd( 5g) 0.00008 3.66571 381 S 6 s Cor( 1s) 2.00000 -87.36062 382 S 6 s Cor( 2s) 2.00000 -9.16505 383 S 6 s Val( 3s) 1.80911 -0.54448 384 S 6 s Ryd( 4s) 0.00457 3.04197 385 S 6 s Ryd( 5s) 0.00010 5.84590 386 S 6 s Ryd( 6s) 0.00000 8.57729 387 S 6 s Ryd( 7s) 0.00000 41.62188 388 S 6 s Ryd( 9s) 0.00000 336.06196 389 S 6 s Ryd( 8s) 0.00000 165.99158 390 S 6 px Cor( 2p) 1.99999 -5.85467 391 S 6 px Val( 3p) 1.04760 -0.18454 392 S 6 px Ryd( 4p) 0.00332 1.63634 393 S 6 px Ryd( 5p) 0.00020 1.65888 394 S 6 px Ryd( 6p) 0.00002 5.00288 395 S 6 px Ryd( 7p) 0.00000 28.22008 396 S 6 py Cor( 2p) 1.99999 -5.84545 397 S 6 py Val( 3p) 1.74193 -0.21223 398 S 6 py Ryd( 4p) 0.00174 1.12335 399 S 6 py Ryd( 5p) 0.00021 1.28727 400 S 6 py Ryd( 6p) 0.00001 4.70568 401 S 6 py Ryd( 7p) 0.00000 28.26118 402 S 6 pz Cor( 2p) 1.99999 -5.84703 403 S 6 pz Val( 3p) 1.61759 -0.21188 404 S 6 pz Ryd( 4p) 0.00168 1.17443 405 S 6 pz Ryd( 5p) 0.00025 1.37089 406 S 6 pz Ryd( 6p) 0.00001 5.17584 407 S 6 pz Ryd( 7p) 0.00000 28.26159 408 S 6 dxy Ryd( 3d) 0.00672 1.00696 409 S 6 dxy Ryd( 4d) 0.00075 1.54731 410 S 6 dxy Ryd( 5d) 0.00001 3.86682 411 S 6 dxy Ryd( 6d) 0.00000 8.59135 412 S 6 dxz Ryd( 3d) 0.00615 1.06756 413 S 6 dxz Ryd( 4d) 0.00147 1.56451 414 S 6 dxz Ryd( 5d) 0.00002 3.96787 415 S 6 dxz Ryd( 6d) 0.00000 8.54369 416 S 6 dyz Ryd( 3d) 0.00580 0.97872 417 S 6 dyz Ryd( 4d) 0.00115 1.40503 418 S 6 dyz Ryd( 5d) 0.00001 3.80393 419 S 6 dyz Ryd( 6d) 0.00000 8.50851 420 S 6 dx2y2 Ryd( 3d) 0.00717 1.07051 421 S 6 dx2y2 Ryd( 4d) 0.00123 1.70246 422 S 6 dx2y2 Ryd( 5d) 0.00001 4.10665 423 S 6 dx2y2 Ryd( 6d) 0.00000 8.55532 424 S 6 dz2 Ryd( 3d) 0.00378 1.17330 425 S 6 dz2 Ryd( 4d) 0.00143 1.54066 426 S 6 dz2 Ryd( 5d) 0.00000 3.90054 427 S 6 dz2 Ryd( 6d) 0.00000 8.60566 428 S 6 f(0) Ryd( 4f) 0.00036 2.00414 429 S 6 f(0) Ryd( 5f) 0.00007 3.55969 430 S 6 f(c1) Ryd( 4f) 0.00065 2.03715 431 S 6 f(c1) Ryd( 5f) 0.00004 3.98278 432 S 6 f(s1) Ryd( 4f) 0.00034 1.78018 433 S 6 f(s1) Ryd( 5f) 0.00003 3.58141 434 S 6 f(c2) Ryd( 4f) 0.00049 2.01992 435 S 6 f(c2) Ryd( 5f) 0.00006 3.57294 436 S 6 f(s2) Ryd( 4f) 0.00045 1.87855 437 S 6 f(s2) Ryd( 5f) 0.00003 3.62608 438 S 6 f(c3) Ryd( 4f) 0.00089 2.08850 439 S 6 f(c3) Ryd( 5f) 0.00005 3.93107 440 S 6 f(s3) Ryd( 4f) 0.00081 2.05170 441 S 6 f(s3) Ryd( 5f) 0.00006 3.88494 442 S 6 g(0) Ryd( 5g) 0.00002 3.71531 443 S 6 g(c1) Ryd( 5g) 0.00002 3.69132 444 S 6 g(s1) Ryd( 5g) 0.00001 3.55510 445 S 6 g(c2) Ryd( 5g) 0.00003 3.62078 446 S 6 g(s2) Ryd( 5g) 0.00002 3.81479 447 S 6 g(c3) Ryd( 5g) 0.00001 3.68873 448 S 6 g(s3) Ryd( 5g) 0.00001 3.66501 449 S 6 g(c4) Ryd( 5g) 0.00003 3.80167 450 S 6 g(s4) Ryd( 5g) 0.00004 3.76030 451 C 7 s Cor( 1s) 1.99997 -10.21158 452 C 7 s Val( 2s) 1.20265 -0.31343 453 C 7 s Ryd( 3s) 0.00142 3.31846 454 C 7 s Ryd( 4s) 0.00003 5.13911 455 C 7 s Ryd( 5s) 0.00000 10.67849 456 C 7 s Ryd( 6s) 0.00000 19.31944 457 C 7 s Ryd( 7s) 0.00000 125.41076 458 C 7 px Val( 2p) 1.23946 -0.13999 459 C 7 px Ryd( 3p) 0.00092 0.92146 460 C 7 px Ryd( 4p) 0.00010 1.31748 461 C 7 px Ryd( 5p) 0.00000 5.35665 462 C 7 py Val( 2p) 1.23847 -0.13237 463 C 7 py Ryd( 3p) 0.00128 0.89697 464 C 7 py Ryd( 4p) 0.00007 1.10706 465 C 7 py Ryd( 5p) 0.00000 4.88885 466 C 7 pz Val( 2p) 1.24956 -0.15209 467 C 7 pz Ryd( 3p) 0.00144 1.00504 468 C 7 pz Ryd( 4p) 0.00011 1.69006 469 C 7 pz Ryd( 5p) 0.00000 6.54751 470 C 7 dxy Ryd( 3d) 0.00189 1.78712 471 C 7 dxy Ryd( 4d) 0.00005 4.34529 472 C 7 dxy Ryd( 5d) 0.00000 8.25903 473 C 7 dxz Ryd( 3d) 0.00392 2.24174 474 C 7 dxz Ryd( 4d) 0.00007 4.18595 475 C 7 dxz Ryd( 5d) 0.00001 8.67146 476 C 7 dyz Ryd( 3d) 0.00083 1.47921 477 C 7 dyz Ryd( 4d) 0.00020 3.44408 478 C 7 dyz Ryd( 5d) 0.00000 7.29126 479 C 7 dx2y2 Ryd( 3d) 0.00196 1.67493 480 C 7 dx2y2 Ryd( 4d) 0.00006 3.78296 481 C 7 dx2y2 Ryd( 5d) 0.00000 7.42310 482 C 7 dz2 Ryd( 3d) 0.00234 2.05771 483 C 7 dz2 Ryd( 4d) 0.00012 3.97374 484 C 7 dz2 Ryd( 5d) 0.00000 8.29901 485 C 7 f(0) Ryd( 4f) 0.00010 2.90526 486 C 7 f(0) Ryd( 5f) 0.00001 8.05807 487 C 7 f(c1) Ryd( 4f) 0.00091 3.22425 488 C 7 f(c1) Ryd( 5f) 0.00001 7.84638 489 C 7 f(s1) Ryd( 4f) 0.00009 2.91290 490 C 7 f(s1) Ryd( 5f) 0.00001 7.60209 491 C 7 f(c2) Ryd( 4f) 0.00008 2.99878 492 C 7 f(c2) Ryd( 5f) 0.00001 7.67924 493 C 7 f(s2) Ryd( 4f) 0.00017 2.99689 494 C 7 f(s2) Ryd( 5f) 0.00001 8.44350 495 C 7 f(c3) Ryd( 4f) 0.00046 3.32610 496 C 7 f(c3) Ryd( 5f) 0.00001 8.11052 497 C 7 f(s3) Ryd( 4f) 0.00008 3.04801 498 C 7 f(s3) Ryd( 5f) 0.00001 8.55989 499 C 7 g(0) Ryd( 5g) 0.00008 5.91186 500 C 7 g(c1) Ryd( 5g) 0.00021 5.99287 501 C 7 g(s1) Ryd( 5g) 0.00002 5.90578 502 C 7 g(c2) Ryd( 5g) 0.00010 6.05410 503 C 7 g(s2) Ryd( 5g) 0.00016 5.93785 504 C 7 g(c3) Ryd( 5g) 0.00009 5.92153 505 C 7 g(s3) Ryd( 5g) 0.00004 5.96484 506 C 7 g(c4) Ryd( 5g) 0.00016 6.00589 507 C 7 g(s4) Ryd( 5g) 0.00013 5.94372 508 C 8 s Cor( 1s) 1.99997 -10.19765 509 C 8 s Val( 2s) 1.20295 -0.30064 510 C 8 s Ryd( 3s) 0.00176 3.22434 511 C 8 s Ryd( 4s) 0.00003 4.75067 512 C 8 s Ryd( 5s) 0.00000 8.85358 513 C 8 s Ryd( 6s) 0.00000 15.62005 514 C 8 s Ryd( 7s) 0.00000 132.69323 515 C 8 px Val( 2p) 1.25033 -0.12171 516 C 8 px Ryd( 3p) 0.00252 0.88977 517 C 8 px Ryd( 4p) 0.00012 1.22816 518 C 8 px Ryd( 5p) 0.00000 5.31370 519 C 8 py Val( 2p) 1.20604 -0.13971 520 C 8 py Ryd( 3p) 0.00111 0.98791 521 C 8 py Ryd( 4p) 0.00017 1.77689 522 C 8 py Ryd( 5p) 0.00000 6.56411 523 C 8 pz Val( 2p) 1.26779 -0.12398 524 C 8 pz Ryd( 3p) 0.00084 0.81868 525 C 8 pz Ryd( 4p) 0.00005 1.12704 526 C 8 pz Ryd( 5p) 0.00000 5.05833 527 C 8 dxy Ryd( 3d) 0.00225 2.01538 528 C 8 dxy Ryd( 4d) 0.00016 4.07940 529 C 8 dxy Ryd( 5d) 0.00000 8.37145 530 C 8 dxz Ryd( 3d) 0.00210 1.82378 531 C 8 dxz Ryd( 4d) 0.00004 4.31319 532 C 8 dxz Ryd( 5d) 0.00000 8.04277 533 C 8 dyz Ryd( 3d) 0.00053 1.51209 534 C 8 dyz Ryd( 4d) 0.00011 3.36295 535 C 8 dyz Ryd( 5d) 0.00000 7.31551 536 C 8 dx2y2 Ryd( 3d) 0.00288 1.98048 537 C 8 dx2y2 Ryd( 4d) 0.00013 3.75198 538 C 8 dx2y2 Ryd( 5d) 0.00000 8.12556 539 C 8 dz2 Ryd( 3d) 0.00328 2.00294 540 C 8 dz2 Ryd( 4d) 0.00003 4.26939 541 C 8 dz2 Ryd( 5d) 0.00000 8.30207 542 C 8 f(0) Ryd( 4f) 0.00038 3.09436 543 C 8 f(0) Ryd( 5f) 0.00001 8.20607 544 C 8 f(c1) Ryd( 4f) 0.00049 3.26736 545 C 8 f(c1) Ryd( 5f) 0.00001 8.43838 546 C 8 f(s1) Ryd( 4f) 0.00009 3.03727 547 C 8 f(s1) Ryd( 5f) 0.00001 7.96350 548 C 8 f(c2) Ryd( 4f) 0.00009 2.97649 549 C 8 f(c2) Ryd( 5f) 0.00001 7.60246 550 C 8 f(s2) Ryd( 4f) 0.00005 3.04532 551 C 8 f(s2) Ryd( 5f) 0.00001 8.19013 552 C 8 f(c3) Ryd( 4f) 0.00041 3.07818 553 C 8 f(c3) Ryd( 5f) 0.00002 7.97892 554 C 8 f(s3) Ryd( 4f) 0.00045 2.93150 555 C 8 f(s3) Ryd( 5f) 0.00001 7.72057 556 C 8 g(0) Ryd( 5g) 0.00016 5.98732 557 C 8 g(c1) Ryd( 5g) 0.00021 6.00784 558 C 8 g(s1) Ryd( 5g) 0.00006 5.90695 559 C 8 g(c2) Ryd( 5g) 0.00008 5.99928 560 C 8 g(s2) Ryd( 5g) 0.00011 5.97842 561 C 8 g(c3) Ryd( 5g) 0.00005 5.96085 562 C 8 g(s3) Ryd( 5g) 0.00005 5.93799 563 C 8 g(c4) Ryd( 5g) 0.00012 5.92615 564 C 8 g(s4) Ryd( 5g) 0.00015 5.99402 565 C 9 s Cor( 1s) 1.99997 -10.21390 566 C 9 s Val( 2s) 1.20245 -0.31543 567 C 9 s Ryd( 3s) 0.00138 3.35789 568 C 9 s Ryd( 4s) 0.00003 5.26732 569 C 9 s Ryd( 5s) 0.00000 9.95728 570 C 9 s Ryd( 6s) 0.00000 18.64986 571 C 9 s Ryd( 7s) 0.00000 126.50322 572 C 9 px Val( 2p) 1.23664 -0.14551 573 C 9 px Ryd( 3p) 0.00099 0.95022 574 C 9 px Ryd( 4p) 0.00011 1.45975 575 C 9 px Ryd( 5p) 0.00000 5.74171 576 C 9 py Val( 2p) 1.23985 -0.13449 577 C 9 py Ryd( 3p) 0.00144 0.89356 578 C 9 py Ryd( 4p) 0.00006 1.12644 579 C 9 py Ryd( 5p) 0.00000 4.94411 580 C 9 pz Val( 2p) 1.24880 -0.15041 581 C 9 pz Ryd( 3p) 0.00115 0.94082 582 C 9 pz Ryd( 4p) 0.00008 1.63156 583 C 9 pz Ryd( 5p) 0.00000 6.06759 584 C 9 dxy Ryd( 3d) 0.00157 1.78982 585 C 9 dxy Ryd( 4d) 0.00008 4.36436 586 C 9 dxy Ryd( 5d) 0.00000 8.31631 587 C 9 dxz Ryd( 3d) 0.00490 2.41280 588 C 9 dxz Ryd( 4d) 0.00005 4.14313 589 C 9 dxz Ryd( 5d) 0.00001 8.74701 590 C 9 dyz Ryd( 3d) 0.00094 1.49113 591 C 9 dyz Ryd( 4d) 0.00016 3.40361 592 C 9 dyz Ryd( 5d) 0.00000 7.09800 593 C 9 dx2y2 Ryd( 3d) 0.00210 1.73234 594 C 9 dx2y2 Ryd( 4d) 0.00008 3.72390 595 C 9 dx2y2 Ryd( 5d) 0.00000 7.48984 596 C 9 dz2 Ryd( 3d) 0.00129 1.78331 597 C 9 dz2 Ryd( 4d) 0.00011 4.03867 598 C 9 dz2 Ryd( 5d) 0.00000 8.13555 599 C 9 f(0) Ryd( 4f) 0.00009 2.99426 600 C 9 f(0) Ryd( 5f) 0.00001 8.38742 601 C 9 f(c1) Ryd( 4f) 0.00094 3.20070 602 C 9 f(c1) Ryd( 5f) 0.00001 7.70656 603 C 9 f(s1) Ryd( 4f) 0.00008 2.95964 604 C 9 f(s1) Ryd( 5f) 0.00000 7.71555 605 C 9 f(c2) Ryd( 4f) 0.00006 3.08445 606 C 9 f(c2) Ryd( 5f) 0.00002 7.63086 607 C 9 f(s2) Ryd( 4f) 0.00007 2.84412 608 C 9 f(s2) Ryd( 5f) 0.00001 8.33274 609 C 9 f(c3) Ryd( 4f) 0.00060 3.37036 610 C 9 f(c3) Ryd( 5f) 0.00001 7.92227 611 C 9 f(s3) Ryd( 4f) 0.00003 2.98230 612 C 9 f(s3) Ryd( 5f) 0.00001 8.59153 613 C 9 g(0) Ryd( 5g) 0.00010 5.97093 614 C 9 g(c1) Ryd( 5g) 0.00021 5.95162 615 C 9 g(s1) Ryd( 5g) 0.00001 5.86344 616 C 9 g(c2) Ryd( 5g) 0.00011 6.11342 617 C 9 g(s2) Ryd( 5g) 0.00014 5.91879 618 C 9 g(c3) Ryd( 5g) 0.00008 5.92340 619 C 9 g(s3) Ryd( 5g) 0.00001 5.97684 620 C 9 g(c4) Ryd( 5g) 0.00016 6.01659 621 C 9 g(s4) Ryd( 5g) 0.00013 5.92371 622 P 10 s Cor( 1s) 2.00000 -69.44407 623 P 10 s Cor( 2s) 2.00000 -14.06014 624 P 10 s Val( 3s) 1.18004 -0.31348 625 P 10 s Ryd( 4s) 0.00766 2.43586 626 P 10 s Ryd( 5s) 0.00010 5.78648 627 P 10 s Ryd( 6s) 0.00001 6.20872 628 P 10 s Ryd( 7s) 0.00000 24.91895 629 P 10 s Ryd( 9s) 0.00000 307.92409 630 P 10 s Ryd( 8s) 0.00000 117.95540 631 P 10 px Cor( 2p) 2.00000 -4.72894 632 P 10 px Val( 3p) 0.87627 -0.10481 633 P 10 px Ryd( 4p) 0.00418 1.24547 634 P 10 px Ryd( 5p) 0.00020 2.11886 635 P 10 px Ryd( 6p) 0.00003 5.98536 636 P 10 px Ryd( 7p) 0.00000 15.27012 637 P 10 py Cor( 2p) 2.00000 -4.72828 638 P 10 py Val( 3p) 0.92743 -0.10418 639 P 10 py Ryd( 4p) 0.00599 1.27902 640 P 10 py Ryd( 5p) 0.00018 2.45660 641 P 10 py Ryd( 6p) 0.00001 6.12066 642 P 10 py Ryd( 7p) 0.00000 15.14771 643 P 10 pz Cor( 2p) 2.00000 -4.73043 644 P 10 pz Val( 3p) 0.71521 -0.07805 645 P 10 pz Ryd( 4p) 0.00409 1.21374 646 P 10 pz Ryd( 5p) 0.00017 2.11216 647 P 10 pz Ryd( 6p) 0.00002 5.85586 648 P 10 pz Ryd( 7p) 0.00000 15.13641 649 P 10 dxy Ryd( 3d) 0.00526 1.30421 650 P 10 dxy Ryd( 4d) 0.00522 1.99415 651 P 10 dxy Ryd( 5d) 0.00005 4.79150 652 P 10 dxy Ryd( 6d) 0.00000 6.14287 653 P 10 dxz Ryd( 3d) 0.01020 1.54370 654 P 10 dxz Ryd( 4d) 0.00046 3.71396 655 P 10 dxz Ryd( 5d) 0.00006 5.19654 656 P 10 dxz Ryd( 6d) 0.00000 6.65755 657 P 10 dyz Ryd( 3d) 0.00562 1.17079 658 P 10 dyz Ryd( 4d) 0.00172 2.10477 659 P 10 dyz Ryd( 5d) 0.00003 4.30076 660 P 10 dyz Ryd( 6d) 0.00000 6.66089 661 P 10 dx2y2 Ryd( 3d) 0.00802 1.39560 662 P 10 dx2y2 Ryd( 4d) 0.00124 2.99266 663 P 10 dx2y2 Ryd( 5d) 0.00006 4.99900 664 P 10 dx2y2 Ryd( 6d) 0.00000 6.63456 665 P 10 dz2 Ryd( 3d) 0.00656 1.35704 666 P 10 dz2 Ryd( 4d) 0.00233 2.57343 667 P 10 dz2 Ryd( 5d) 0.00005 4.85005 668 P 10 dz2 Ryd( 6d) 0.00000 6.43474 669 P 10 f(0) Ryd( 4f) 0.00027 2.81302 670 P 10 f(0) Ryd( 5f) 0.00005 4.06919 671 P 10 f(c1) Ryd( 4f) 0.00072 3.30850 672 P 10 f(c1) Ryd( 5f) 0.00009 5.35794 673 P 10 f(s1) Ryd( 4f) 0.00040 2.75450 674 P 10 f(s1) Ryd( 5f) 0.00006 4.04940 675 P 10 f(c2) Ryd( 4f) 0.00059 3.05246 676 P 10 f(c2) Ryd( 5f) 0.00005 4.54895 677 P 10 f(s2) Ryd( 4f) 0.00036 2.76567 678 P 10 f(s2) Ryd( 5f) 0.00005 4.02937 679 P 10 f(c3) Ryd( 4f) 0.00080 2.83999 680 P 10 f(c3) Ryd( 5f) 0.00012 4.38565 681 P 10 f(s3) Ryd( 4f) 0.00040 2.85529 682 P 10 f(s3) Ryd( 5f) 0.00007 3.91442 683 P 10 g(0) Ryd( 5g) 0.00003 3.81282 684 P 10 g(c1) Ryd( 5g) 0.00004 3.75299 685 P 10 g(s1) Ryd( 5g) 0.00002 3.57734 686 P 10 g(c2) Ryd( 5g) 0.00003 3.67724 687 P 10 g(s2) Ryd( 5g) 0.00007 3.77865 688 P 10 g(c3) Ryd( 5g) 0.00003 3.63803 689 P 10 g(s3) Ryd( 5g) 0.00001 3.62288 690 P 10 g(c4) Ryd( 5g) 0.00010 3.74205 691 P 10 g(s4) Ryd( 5g) 0.00004 3.54326 692 C 11 s Cor( 1s) 1.99997 -10.21823 693 C 11 s Val( 2s) 1.01943 -0.18648 694 C 11 s Ryd( 3s) 0.00299 4.65742 695 C 11 s Ryd( 4s) 0.00010 5.39860 696 C 11 s Ryd( 5s) 0.00001 11.17894 697 C 11 s Ryd( 6s) 0.00001 13.04227 698 C 11 s Ryd( 7s) 0.00000 128.87406 699 C 11 px Val( 2p) 1.15065 -0.04428 700 C 11 px Ryd( 3p) 0.00491 1.59107 701 C 11 px Ryd( 4p) 0.00068 1.86921 702 C 11 px Ryd( 5p) 0.00004 4.83560 703 C 11 py Val( 2p) 0.99051 -0.13137 704 C 11 py Ryd( 3p) 0.00438 0.91094 705 C 11 py Ryd( 4p) 0.00068 1.05893 706 C 11 py Ryd( 5p) 0.00003 4.33916 707 C 11 pz Val( 2p) 1.05075 -0.03788 708 C 11 pz Ryd( 3p) 0.00520 1.56139 709 C 11 pz Ryd( 4p) 0.00028 1.28589 710 C 11 pz Ryd( 5p) 0.00005 5.07560 711 C 11 dxy Ryd( 3d) 0.00246 1.91242 712 C 11 dxy Ryd( 4d) 0.00024 3.21007 713 C 11 dxy Ryd( 5d) 0.00001 7.25851 714 C 11 dxz Ryd( 3d) 0.00068 3.44721 715 C 11 dxz Ryd( 4d) 0.00064 4.82591 716 C 11 dxz Ryd( 5d) 0.00001 7.95160 717 C 11 dyz Ryd( 3d) 0.00151 1.60087 718 C 11 dyz Ryd( 4d) 0.00052 2.94706 719 C 11 dyz Ryd( 5d) 0.00001 6.91828 720 C 11 dx2y2 Ryd( 3d) 0.00302 3.23697 721 C 11 dx2y2 Ryd( 4d) 0.00044 3.73930 722 C 11 dx2y2 Ryd( 5d) 0.00001 8.42733 723 C 11 dz2 Ryd( 3d) 0.00148 4.60416 724 C 11 dz2 Ryd( 4d) 0.00050 4.16113 725 C 11 dz2 Ryd( 5d) 0.00001 7.23836 726 C 11 f(0) Ryd( 4f) 0.00054 4.17030 727 C 11 f(0) Ryd( 5f) 0.00002 8.11140 728 C 11 f(c1) Ryd( 4f) 0.00041 4.01966 729 C 11 f(c1) Ryd( 5f) 0.00003 8.21005 730 C 11 f(s1) Ryd( 4f) 0.00019 2.79459 731 C 11 f(s1) Ryd( 5f) 0.00001 7.34647 732 C 11 f(c2) Ryd( 4f) 0.00057 3.60782 733 C 11 f(c2) Ryd( 5f) 0.00001 7.68879 734 C 11 f(s2) Ryd( 4f) 0.00032 3.10460 735 C 11 f(s2) Ryd( 5f) 0.00001 7.56563 736 C 11 f(c3) Ryd( 4f) 0.00071 3.08708 737 C 11 f(c3) Ryd( 5f) 0.00001 7.60751 738 C 11 f(s3) Ryd( 4f) 0.00048 2.91195 739 C 11 f(s3) Ryd( 5f) 0.00001 7.71899 740 C 11 g(0) Ryd( 5g) 0.00013 6.23132 741 C 11 g(c1) Ryd( 5g) 0.00017 6.48359 742 C 11 g(s1) Ryd( 5g) 0.00006 5.93537 743 C 11 g(c2) Ryd( 5g) 0.00006 6.24202 744 C 11 g(s2) Ryd( 5g) 0.00001 6.33494 745 C 11 g(c3) Ryd( 5g) 0.00006 5.98524 746 C 11 g(s3) Ryd( 5g) 0.00010 5.96087 747 C 11 g(c4) Ryd( 5g) 0.00002 5.96465 748 C 11 g(s4) Ryd( 5g) 0.00001 6.01322 749 C 12 s Cor( 1s) 1.99997 -10.22004 750 C 12 s Val( 2s) 1.01464 -0.18753 751 C 12 s Ryd( 3s) 0.00297 4.65441 752 C 12 s Ryd( 4s) 0.00007 6.50260 753 C 12 s Ryd( 6s) 0.00001 11.99003 754 C 12 s Ryd( 5s) 0.00000 11.86767 755 C 12 s Ryd( 7s) 0.00000 128.62585 756 C 12 px Val( 2p) 1.01212 -0.04698 757 C 12 px Ryd( 3p) 0.00523 1.52701 758 C 12 px Ryd( 4p) 0.00020 1.11542 759 C 12 px Ryd( 5p) 0.00005 4.95599 760 C 12 py Val( 2p) 1.02241 -0.13156 761 C 12 py Ryd( 3p) 0.00417 0.93455 762 C 12 py Ryd( 4p) 0.00051 1.09554 763 C 12 py Ryd( 5p) 0.00003 4.04099 764 C 12 pz Val( 2p) 1.18305 -0.05080 765 C 12 pz Ryd( 3p) 0.00457 1.62485 766 C 12 pz Ryd( 4p) 0.00027 2.26830 767 C 12 pz Ryd( 5p) 0.00004 4.78569 768 C 12 dxy Ryd( 3d) 0.00063 1.87857 769 C 12 dxy Ryd( 4d) 0.00052 2.83806 770 C 12 dxy Ryd( 5d) 0.00001 6.96371 771 C 12 dxz Ryd( 3d) 0.00148 5.11080 772 C 12 dxz Ryd( 4d) 0.00037 4.84037 773 C 12 dxz Ryd( 5d) 0.00001 7.31905 774 C 12 dyz Ryd( 3d) 0.00364 1.80518 775 C 12 dyz Ryd( 4d) 0.00015 3.30839 776 C 12 dyz Ryd( 5d) 0.00001 7.13718 777 C 12 dx2y2 Ryd( 3d) 0.00158 2.95956 778 C 12 dx2y2 Ryd( 4d) 0.00050 3.08378 779 C 12 dx2y2 Ryd( 5d) 0.00001 7.23220 780 C 12 dz2 Ryd( 3d) 0.00126 3.24493 781 C 12 dz2 Ryd( 4d) 0.00055 5.07033 782 C 12 dz2 Ryd( 5d) 0.00001 8.99953 783 C 12 f(0) Ryd( 4f) 0.00078 4.05673 784 C 12 f(0) Ryd( 5f) 0.00002 7.92865 785 C 12 f(c1) Ryd( 4f) 0.00051 4.21567 786 C 12 f(c1) Ryd( 5f) 0.00002 8.37953 787 C 12 f(s1) Ryd( 4f) 0.00071 3.04317 788 C 12 f(s1) Ryd( 5f) 0.00001 7.90079 789 C 12 f(c2) Ryd( 4f) 0.00039 3.53869 790 C 12 f(c2) Ryd( 5f) 0.00001 7.81818 791 C 12 f(s2) Ryd( 4f) 0.00022 3.09408 792 C 12 f(s2) Ryd( 5f) 0.00001 7.52169 793 C 12 f(c3) Ryd( 4f) 0.00029 2.98404 794 C 12 f(c3) Ryd( 5f) 0.00001 7.35350 795 C 12 f(s3) Ryd( 4f) 0.00029 2.92252 796 C 12 f(s3) Ryd( 5f) 0.00001 7.29199 797 C 12 g(0) Ryd( 5g) 0.00012 6.27482 798 C 12 g(c1) Ryd( 5g) 0.00016 6.40890 799 C 12 g(s1) Ryd( 5g) 0.00007 6.00365 800 C 12 g(c2) Ryd( 5g) 0.00009 6.24390 801 C 12 g(s2) Ryd( 5g) 0.00006 6.24061 802 C 12 g(c3) Ryd( 5g) 0.00004 6.11676 803 C 12 g(s3) Ryd( 5g) 0.00005 6.05442 804 C 12 g(c4) Ryd( 5g) 0.00001 5.87631 805 C 12 g(s4) Ryd( 5g) 0.00001 5.96308 806 C 13 s Cor( 1s) 1.99997 -10.23287 807 C 13 s Val( 2s) 1.01095 -0.19638 808 C 13 s Ryd( 3s) 0.00338 3.93215 809 C 13 s Ryd( 4s) 0.00011 4.84433 810 C 13 s Ryd( 5s) 0.00001 12.24992 811 C 13 s Ryd( 6s) 0.00000 12.31490 812 C 13 s Ryd( 7s) 0.00000 128.46507 813 C 13 px Val( 2p) 1.15274 -0.06362 814 C 13 px Ryd( 3p) 0.00447 1.51940 815 C 13 px Ryd( 4p) 0.00020 2.06301 816 C 13 px Ryd( 5p) 0.00003 5.28175 817 C 13 py Val( 2p) 1.02615 -0.13981 818 C 13 py Ryd( 3p) 0.00403 0.91525 819 C 13 py Ryd( 4p) 0.00029 1.23759 820 C 13 py Ryd( 5p) 0.00002 4.53939 821 C 13 pz Val( 2p) 1.01977 -0.04918 822 C 13 pz Ryd( 3p) 0.00490 1.42873 823 C 13 pz Ryd( 4p) 0.00019 1.15948 824 C 13 pz Ryd( 5p) 0.00006 5.34678 825 C 13 dxy Ryd( 3d) 0.00359 2.02028 826 C 13 dxy Ryd( 4d) 0.00017 3.39271 827 C 13 dxy Ryd( 5d) 0.00001 7.48565 828 C 13 dxz Ryd( 3d) 0.00162 5.36021 829 C 13 dxz Ryd( 4d) 0.00025 4.77646 830 C 13 dxz Ryd( 5d) 0.00001 7.19972 831 C 13 dyz Ryd( 3d) 0.00018 1.77660 832 C 13 dyz Ryd( 4d) 0.00057 2.75405 833 C 13 dyz Ryd( 5d) 0.00001 6.83757 834 C 13 dx2y2 Ryd( 3d) 0.00186 2.82910 835 C 13 dx2y2 Ryd( 4d) 0.00033 4.02130 836 C 13 dx2y2 Ryd( 5d) 0.00002 8.60174 837 C 13 dz2 Ryd( 3d) 0.00082 3.35155 838 C 13 dz2 Ryd( 4d) 0.00072 3.97918 839 C 13 dz2 Ryd( 5d) 0.00001 7.33955 840 C 13 f(0) Ryd( 4f) 0.00039 3.80495 841 C 13 f(0) Ryd( 5f) 0.00003 7.77625 842 C 13 f(c1) Ryd( 4f) 0.00059 4.50198 843 C 13 f(c1) Ryd( 5f) 0.00002 8.29170 844 C 13 f(s1) Ryd( 4f) 0.00021 2.93068 845 C 13 f(s1) Ryd( 5f) 0.00001 7.23488 846 C 13 f(c2) Ryd( 4f) 0.00037 3.38253 847 C 13 f(c2) Ryd( 5f) 0.00001 7.96786 848 C 13 f(s2) Ryd( 4f) 0.00008 3.02456 849 C 13 f(s2) Ryd( 5f) 0.00001 7.55071 850 C 13 f(c3) Ryd( 4f) 0.00054 3.01772 851 C 13 f(c3) Ryd( 5f) 0.00001 7.72253 852 C 13 f(s3) Ryd( 4f) 0.00094 3.15758 853 C 13 f(s3) Ryd( 5f) 0.00001 7.75014 854 C 13 g(0) Ryd( 5g) 0.00010 6.33414 855 C 13 g(c1) Ryd( 5g) 0.00016 6.33228 856 C 13 g(s1) Ryd( 5g) 0.00002 6.02785 857 C 13 g(c2) Ryd( 5g) 0.00012 6.18216 858 C 13 g(s2) Ryd( 5g) 0.00010 6.08769 859 C 13 g(c3) Ryd( 5g) 0.00001 6.12220 860 C 13 g(s3) Ryd( 5g) 0.00002 6.11718 861 C 13 g(c4) Ryd( 5g) 0.00003 5.93282 862 C 13 g(s4) Ryd( 5g) 0.00003 5.94285 863 C 14 s Cor( 1s) 1.99997 -10.21945 864 C 14 s Val( 2s) 1.01279 -0.18926 865 C 14 s Ryd( 3s) 0.00322 4.56405 866 C 14 s Ryd( 4s) 0.00008 5.80681 867 C 14 s Ryd( 6s) 0.00000 12.59739 868 C 14 s Ryd( 5s) 0.00000 11.75986 869 C 14 s Ryd( 7s) 0.00000 128.74330 870 C 14 px Val( 2p) 1.03990 -0.05190 871 C 14 px Ryd( 3p) 0.00505 1.52841 872 C 14 px Ryd( 4p) 0.00022 1.20841 873 C 14 px Ryd( 5p) 0.00005 4.91310 874 C 14 py Val( 2p) 1.04459 -0.13299 875 C 14 py Ryd( 3p) 0.00423 0.94293 876 C 14 py Ryd( 4p) 0.00051 1.09757 877 C 14 py Ryd( 5p) 0.00003 4.08897 878 C 14 pz Val( 2p) 1.15621 -0.04993 879 C 14 pz Ryd( 3p) 0.00443 1.65333 880 C 14 pz Ryd( 4p) 0.00024 2.11753 881 C 14 pz Ryd( 5p) 0.00004 4.86049 882 C 14 dxy Ryd( 3d) 0.00127 1.97449 883 C 14 dxy Ryd( 4d) 0.00045 2.89638 884 C 14 dxy Ryd( 5d) 0.00001 7.04542 885 C 14 dxz Ryd( 3d) 0.00109 3.85308 886 C 14 dxz Ryd( 4d) 0.00055 4.83828 887 C 14 dxz Ryd( 5d) 0.00001 7.78996 888 C 14 dyz Ryd( 3d) 0.00290 1.76034 889 C 14 dyz Ryd( 4d) 0.00019 3.24315 890 C 14 dyz Ryd( 5d) 0.00001 7.05569 891 C 14 dx2y2 Ryd( 3d) 0.00167 3.21176 892 C 14 dx2y2 Ryd( 4d) 0.00041 3.24390 893 C 14 dx2y2 Ryd( 5d) 0.00001 7.32001 894 C 14 dz2 Ryd( 3d) 0.00155 4.23892 895 C 14 dz2 Ryd( 4d) 0.00044 4.91471 896 C 14 dz2 Ryd( 5d) 0.00001 8.42649 897 C 14 f(0) Ryd( 4f) 0.00054 3.89071 898 C 14 f(0) Ryd( 5f) 0.00002 8.15232 899 C 14 f(c1) Ryd( 4f) 0.00074 4.51048 900 C 14 f(c1) Ryd( 5f) 0.00002 8.15751 901 C 14 f(s1) Ryd( 4f) 0.00058 2.97901 902 C 14 f(s1) Ryd( 5f) 0.00001 7.78293 903 C 14 f(c2) Ryd( 4f) 0.00039 3.42042 904 C 14 f(c2) Ryd( 5f) 0.00001 7.68527 905 C 14 f(s2) Ryd( 4f) 0.00033 3.15116 906 C 14 f(s2) Ryd( 5f) 0.00001 7.54942 907 C 14 f(c3) Ryd( 4f) 0.00030 2.99012 908 C 14 f(c3) Ryd( 5f) 0.00001 7.44383 909 C 14 f(s3) Ryd( 4f) 0.00034 2.95545 910 C 14 f(s3) Ryd( 5f) 0.00001 7.38774 911 C 14 g(0) Ryd( 5g) 0.00009 6.23319 912 C 14 g(c1) Ryd( 5g) 0.00018 6.52189 913 C 14 g(s1) Ryd( 5g) 0.00003 6.13871 914 C 14 g(c2) Ryd( 5g) 0.00011 6.12903 915 C 14 g(s2) Ryd( 5g) 0.00014 6.03847 916 C 14 g(c3) Ryd( 5g) 0.00001 6.16647 917 C 14 g(s3) Ryd( 5g) 0.00001 6.11280 918 C 14 g(c4) Ryd( 5g) 0.00002 5.87517 919 C 14 g(s4) Ryd( 5g) 0.00002 5.98121 920 C 15 s Cor( 1s) 1.99997 -10.22130 921 C 15 s Val( 2s) 1.01876 -0.18599 922 C 15 s Ryd( 3s) 0.00287 4.69388 923 C 15 s Ryd( 4s) 0.00011 5.61249 924 C 15 s Ryd( 5s) 0.00001 11.54024 925 C 15 s Ryd( 6s) 0.00000 12.79513 926 C 15 s Ryd( 7s) 0.00000 128.45165 927 C 15 px Val( 2p) 1.10325 -0.04259 928 C 15 px Ryd( 3p) 0.00514 1.51660 929 C 15 px Ryd( 4p) 0.00055 1.60952 930 C 15 px Ryd( 5p) 0.00004 5.02963 931 C 15 py Val( 2p) 0.96964 -0.13133 932 C 15 py Ryd( 3p) 0.00454 0.89410 933 C 15 py Ryd( 4p) 0.00052 1.08056 934 C 15 py Ryd( 5p) 0.00003 4.40252 935 C 15 pz Val( 2p) 1.09372 -0.03912 936 C 15 pz Ryd( 3p) 0.00516 1.55827 937 C 15 pz Ryd( 4p) 0.00024 1.52973 938 C 15 pz Ryd( 5p) 0.00005 5.08067 939 C 15 dxy Ryd( 3d) 0.00187 1.95605 940 C 15 dxy Ryd( 4d) 0.00036 3.08963 941 C 15 dxy Ryd( 5d) 0.00001 7.14767 942 C 15 dxz Ryd( 3d) 0.00051 2.76296 943 C 15 dxz Ryd( 4d) 0.00074 4.87778 944 C 15 dxz Ryd( 5d) 0.00001 8.15502 945 C 15 dyz Ryd( 3d) 0.00212 1.55202 946 C 15 dyz Ryd( 4d) 0.00043 3.05016 947 C 15 dyz Ryd( 5d) 0.00001 7.01098 948 C 15 dx2y2 Ryd( 3d) 0.00287 3.33592 949 C 15 dx2y2 Ryd( 4d) 0.00043 3.50411 950 C 15 dx2y2 Ryd( 5d) 0.00001 7.95459 951 C 15 dz2 Ryd( 3d) 0.00173 5.19226 952 C 15 dz2 Ryd( 4d) 0.00040 4.33261 953 C 15 dz2 Ryd( 5d) 0.00001 7.45680 954 C 15 f(0) Ryd( 4f) 0.00047 4.07964 955 C 15 f(0) Ryd( 5f) 0.00002 8.26130 956 C 15 f(c1) Ryd( 4f) 0.00058 4.21809 957 C 15 f(c1) Ryd( 5f) 0.00003 8.20426 958 C 15 f(s1) Ryd( 4f) 0.00028 2.80648 959 C 15 f(s1) Ryd( 5f) 0.00001 7.47631 960 C 15 f(c2) Ryd( 4f) 0.00061 3.57961 961 C 15 f(c2) Ryd( 5f) 0.00002 7.60028 962 C 15 f(s2) Ryd( 4f) 0.00030 3.11336 963 C 15 f(s2) Ryd( 5f) 0.00000 7.60269 964 C 15 f(c3) Ryd( 4f) 0.00053 3.03388 965 C 15 f(c3) Ryd( 5f) 0.00001 7.56724 966 C 15 f(s3) Ryd( 4f) 0.00037 2.91035 967 C 15 f(s3) Ryd( 5f) 0.00001 7.58846 968 C 15 g(0) Ryd( 5g) 0.00014 6.37024 969 C 15 g(c1) Ryd( 5g) 0.00015 6.28445 970 C 15 g(s1) Ryd( 5g) 0.00004 6.00174 971 C 15 g(c2) Ryd( 5g) 0.00010 6.29147 972 C 15 g(s2) Ryd( 5g) 0.00006 6.23531 973 C 15 g(c3) Ryd( 5g) 0.00004 5.99129 974 C 15 g(s3) Ryd( 5g) 0.00007 6.00102 975 C 15 g(c4) Ryd( 5g) 0.00001 5.94142 976 C 15 g(s4) Ryd( 5g) 0.00002 6.00786 977 H 16 s Val( 1s) 0.76851 0.01077 978 H 16 s Ryd( 3s) 0.00103 1.34589 979 H 16 s Ryd( 2s) 0.00018 0.89029 980 H 16 s Ryd( 4s) 0.00000 6.34597 981 H 16 px Ryd( 2p) 0.00069 2.56186 982 H 16 px Ryd( 3p) 0.00002 4.54509 983 H 16 px Ryd( 4p) 0.00001 8.31689 984 H 16 py Ryd( 2p) 0.00084 2.70347 985 H 16 py Ryd( 3p) 0.00001 4.63129 986 H 16 py Ryd( 4p) 0.00001 8.40932 987 H 16 pz Ryd( 2p) 0.00045 1.76967 988 H 16 pz Ryd( 3p) 0.00003 3.49197 989 H 16 pz Ryd( 4p) 0.00001 7.73938 990 H 16 dxy Ryd( 3d) 0.00006 4.45615 991 H 16 dxy Ryd( 4d) 0.00001 10.62184 992 H 16 dxz Ryd( 3d) 0.00005 3.87103 993 H 16 dxz Ryd( 4d) 0.00000 9.34653 994 H 16 dyz Ryd( 3d) 0.00009 3.72700 995 H 16 dyz Ryd( 4d) 0.00000 9.29786 996 H 16 dx2y2 Ryd( 3d) 0.00016 4.41598 997 H 16 dx2y2 Ryd( 4d) 0.00000 9.71839 998 H 16 dz2 Ryd( 3d) 0.00003 3.64845 999 H 16 dz2 Ryd( 4d) 0.00000 9.52400 1000 H 16 f(0) Ryd( 4f) 0.00000 7.09179 1001 H 16 f(c1) Ryd( 4f) 0.00002 7.30873 1002 H 16 f(s1) Ryd( 4f) 0.00001 7.36635 1003 H 16 f(c2) Ryd( 4f) 0.00000 7.88400 1004 H 16 f(s2) Ryd( 4f) 0.00001 7.26309 1005 H 16 f(c3) Ryd( 4f) 0.00003 7.64701 1006 H 16 f(s3) Ryd( 4f) 0.00002 7.53495 1007 H 17 s Val( 1s) 0.76479 0.01098 1008 H 17 s Ryd( 3s) 0.00031 1.62520 1009 H 17 s Ryd( 2s) 0.00010 1.40074 1010 H 17 s Ryd( 4s) 0.00001 5.43810 1011 H 17 px Ryd( 2p) 0.00063 2.19991 1012 H 17 px Ryd( 3p) 0.00002 4.05963 1013 H 17 px Ryd( 4p) 0.00001 8.08511 1014 H 17 py Ryd( 2p) 0.00082 3.27508 1015 H 17 py Ryd( 3p) 0.00002 5.09336 1016 H 17 py Ryd( 4p) 0.00001 8.75947 1017 H 17 pz Ryd( 2p) 0.00034 1.90207 1018 H 17 pz Ryd( 3p) 0.00003 3.56823 1019 H 17 pz Ryd( 4p) 0.00001 7.88416 1020 H 17 dxy Ryd( 3d) 0.00009 4.42324 1021 H 17 dxy Ryd( 4d) 0.00001 10.26706 1022 H 17 dxz Ryd( 3d) 0.00003 3.63061 1023 H 17 dxz Ryd( 4d) 0.00000 9.18202 1024 H 17 dyz Ryd( 3d) 0.00011 4.08806 1025 H 17 dyz Ryd( 4d) 0.00000 9.58937 1026 H 17 dx2y2 Ryd( 3d) 0.00013 4.32283 1027 H 17 dx2y2 Ryd( 4d) 0.00000 9.96994 1028 H 17 dz2 Ryd( 3d) 0.00003 3.67671 1029 H 17 dz2 Ryd( 4d) 0.00000 9.53764 1030 H 17 f(0) Ryd( 4f) 0.00001 7.19205 1031 H 17 f(c1) Ryd( 4f) 0.00001 7.13226 1032 H 17 f(s1) Ryd( 4f) 0.00001 7.53853 1033 H 17 f(c2) Ryd( 4f) 0.00001 7.59588 1034 H 17 f(s2) Ryd( 4f) 0.00001 7.40063 1035 H 17 f(c3) Ryd( 4f) 0.00004 7.75726 1036 H 17 f(s3) Ryd( 4f) 0.00001 7.47217 1037 H 18 s Val( 1s) 0.73931 0.02719 1038 H 18 s Ryd( 3s) 0.00049 1.64725 1039 H 18 s Ryd( 2s) 0.00008 1.29503 1040 H 18 s Ryd( 4s) 0.00001 5.78097 1041 H 18 px Ryd( 2p) 0.00066 2.65476 1042 H 18 px Ryd( 3p) 0.00003 4.33448 1043 H 18 px Ryd( 4p) 0.00001 8.32350 1044 H 18 py Ryd( 2p) 0.00058 1.83973 1045 H 18 py Ryd( 3p) 0.00001 3.72799 1046 H 18 py Ryd( 4p) 0.00001 7.74246 1047 H 18 pz Ryd( 2p) 0.00057 2.77714 1048 H 18 pz Ryd( 3p) 0.00003 4.85218 1049 H 18 pz Ryd( 4p) 0.00001 8.52389 1050 H 18 dxy Ryd( 3d) 0.00006 3.77484 1051 H 18 dxy Ryd( 4d) 0.00000 9.35575 1052 H 18 dxz Ryd( 3d) 0.00005 4.56304 1053 H 18 dxz Ryd( 4d) 0.00001 10.59039 1054 H 18 dyz Ryd( 3d) 0.00009 3.98137 1055 H 18 dyz Ryd( 4d) 0.00000 9.38647 1056 H 18 dx2y2 Ryd( 3d) 0.00006 3.65461 1057 H 18 dx2y2 Ryd( 4d) 0.00000 9.34456 1058 H 18 dz2 Ryd( 3d) 0.00009 4.49766 1059 H 18 dz2 Ryd( 4d) 0.00000 9.64483 1060 H 18 f(0) Ryd( 4f) 0.00001 7.62029 1061 H 18 f(c1) Ryd( 4f) 0.00004 7.55968 1062 H 18 f(s1) Ryd( 4f) 0.00001 7.58332 1063 H 18 f(c2) Ryd( 4f) 0.00002 7.28192 1064 H 18 f(s2) Ryd( 4f) 0.00001 7.31697 1065 H 18 f(c3) Ryd( 4f) 0.00000 7.39124 1066 H 18 f(s3) Ryd( 4f) 0.00000 7.41044 1067 H 19 s Val( 1s) 0.77654 0.01481 1068 H 19 s Ryd( 3s) 0.00096 1.30148 1069 H 19 s Ryd( 2s) 0.00018 0.92192 1070 H 19 s Ryd( 4s) 0.00000 6.29519 1071 H 19 px Ryd( 2p) 0.00097 2.84632 1072 H 19 px Ryd( 3p) 0.00001 4.53240 1073 H 19 px Ryd( 4p) 0.00001 8.42509 1074 H 19 py Ryd( 2p) 0.00036 2.54585 1075 H 19 py Ryd( 3p) 0.00005 4.32208 1076 H 19 py Ryd( 4p) 0.00002 8.29921 1077 H 19 pz Ryd( 2p) 0.00051 1.78612 1078 H 19 pz Ryd( 3p) 0.00001 3.48724 1079 H 19 pz Ryd( 4p) 0.00001 7.73423 1080 H 19 dxy Ryd( 3d) 0.00008 4.46148 1081 H 19 dxy Ryd( 4d) 0.00001 10.40995 1082 H 19 dxz Ryd( 3d) 0.00009 3.86250 1083 H 19 dxz Ryd( 4d) 0.00000 9.46127 1084 H 19 dyz Ryd( 3d) 0.00009 3.68415 1085 H 19 dyz Ryd( 4d) 0.00000 9.27700 1086 H 19 dx2y2 Ryd( 3d) 0.00012 4.45226 1087 H 19 dx2y2 Ryd( 4d) 0.00000 9.74506 1088 H 19 dz2 Ryd( 3d) 0.00003 3.66728 1089 H 19 dz2 Ryd( 4d) 0.00000 9.40273 1090 H 19 f(0) Ryd( 4f) 0.00001 7.18411 1091 H 19 f(c1) Ryd( 4f) 0.00001 7.43537 1092 H 19 f(s1) Ryd( 4f) 0.00001 7.22488 1093 H 19 f(c2) Ryd( 4f) 0.00000 7.82861 1094 H 19 f(s2) Ryd( 4f) 0.00001 7.25772 1095 H 19 f(c3) Ryd( 4f) 0.00003 7.48313 1096 H 19 f(s3) Ryd( 4f) 0.00003 7.71765 1097 H 20 s Val( 1s) 0.72730 0.05168 1098 H 20 s Ryd( 3s) 0.00057 2.00063 1099 H 20 s Ryd( 2s) 0.00018 1.43610 1100 H 20 s Ryd( 4s) 0.00001 5.23463 1101 H 20 px Ryd( 2p) 0.00066 2.80466 1102 H 20 px Ryd( 3p) 0.00003 4.89018 1103 H 20 px Ryd( 4p) 0.00001 8.43567 1104 H 20 py Ryd( 2p) 0.00049 1.93692 1105 H 20 py Ryd( 3p) 0.00003 3.80971 1106 H 20 py Ryd( 4p) 0.00001 7.87026 1107 H 20 pz Ryd( 2p) 0.00079 2.46511 1108 H 20 pz Ryd( 3p) 0.00002 4.40415 1109 H 20 pz Ryd( 4p) 0.00001 8.17133 1110 H 20 dxy Ryd( 3d) 0.00007 4.03631 1111 H 20 dxy Ryd( 4d) 0.00000 9.48532 1112 H 20 dxz Ryd( 3d) 0.00006 4.35561 1113 H 20 dxz Ryd( 4d) 0.00001 10.56361 1114 H 20 dyz Ryd( 3d) 0.00007 3.64753 1115 H 20 dyz Ryd( 4d) 0.00000 9.27954 1116 H 20 dx2y2 Ryd( 3d) 0.00007 4.03075 1117 H 20 dx2y2 Ryd( 4d) 0.00000 9.74286 1118 H 20 dz2 Ryd( 3d) 0.00009 4.13560 1119 H 20 dz2 Ryd( 4d) 0.00000 9.61247 1120 H 20 f(0) Ryd( 4f) 0.00001 7.68517 1121 H 20 f(c1) Ryd( 4f) 0.00002 7.48831 1122 H 20 f(s1) Ryd( 4f) 0.00000 7.50122 1123 H 20 f(c2) Ryd( 4f) 0.00003 7.28475 1124 H 20 f(s2) Ryd( 4f) 0.00002 7.23526 1125 H 20 f(c3) Ryd( 4f) 0.00001 7.49172 1126 H 20 f(s3) Ryd( 4f) 0.00001 7.47742 1127 H 21 s Val( 1s) 0.74116 0.03964 1128 H 21 s Ryd( 3s) 0.00043 1.67471 1129 H 21 s Ryd( 2s) 0.00012 1.15009 1130 H 21 s Ryd( 4s) 0.00001 5.84655 1131 H 21 px Ryd( 2p) 0.00055 1.93025 1132 H 21 px Ryd( 3p) 0.00004 3.85460 1133 H 21 px Ryd( 4p) 0.00001 7.87166 1134 H 21 py Ryd( 2p) 0.00036 1.80773 1135 H 21 py Ryd( 3p) 0.00003 3.62471 1136 H 21 py Ryd( 4p) 0.00001 7.88606 1137 H 21 pz Ryd( 2p) 0.00106 3.42698 1138 H 21 pz Ryd( 3p) 0.00002 5.35371 1139 H 21 pz Ryd( 4p) 0.00001 8.81697 1140 H 21 dxy Ryd( 3d) 0.00001 3.38845 1141 H 21 dxy Ryd( 4d) 0.00000 9.05547 1142 H 21 dxz Ryd( 3d) 0.00011 4.46157 1143 H 21 dxz Ryd( 4d) 0.00000 10.03846 1144 H 21 dyz Ryd( 3d) 0.00014 4.25740 1145 H 21 dyz Ryd( 4d) 0.00000 9.60170 1146 H 21 dx2y2 Ryd( 3d) 0.00003 3.32799 1147 H 21 dx2y2 Ryd( 4d) 0.00000 9.03555 1148 H 21 dz2 Ryd( 3d) 0.00009 4.70234 1149 H 21 dz2 Ryd( 4d) 0.00001 10.75433 1150 H 21 f(0) Ryd( 4f) 0.00003 7.63948 1151 H 21 f(c1) Ryd( 4f) 0.00004 7.67440 1152 H 21 f(s1) Ryd( 4f) 0.00001 7.54581 1153 H 21 f(c2) Ryd( 4f) 0.00000 7.62746 1154 H 21 f(s2) Ryd( 4f) 0.00000 7.63241 1155 H 21 f(c3) Ryd( 4f) 0.00000 7.00313 1156 H 21 f(s3) Ryd( 4f) 0.00000 7.02672 1157 H 22 s Val( 1s) 0.76667 0.01059 1158 H 22 s Ryd( 3s) 0.00102 1.36624 1159 H 22 s Ryd( 2s) 0.00017 0.88484 1160 H 22 s Ryd( 4s) 0.00000 6.35807 1161 H 22 px Ryd( 2p) 0.00059 2.42891 1162 H 22 px Ryd( 3p) 0.00002 4.43732 1163 H 22 px Ryd( 4p) 0.00001 8.24489 1164 H 22 py Ryd( 2p) 0.00089 2.86464 1165 H 22 py Ryd( 3p) 0.00001 4.82034 1166 H 22 py Ryd( 4p) 0.00001 8.53744 1167 H 22 pz Ryd( 2p) 0.00046 1.73421 1168 H 22 pz Ryd( 3p) 0.00002 3.46568 1169 H 22 pz Ryd( 4p) 0.00001 7.74163 1170 H 22 dxy Ryd( 3d) 0.00006 4.49220 1171 H 22 dxy Ryd( 4d) 0.00001 10.58972 1172 H 22 dxz Ryd( 3d) 0.00004 3.82339 1173 H 22 dxz Ryd( 4d) 0.00000 9.26261 1174 H 22 dyz Ryd( 3d) 0.00011 3.81956 1175 H 22 dyz Ryd( 4d) 0.00000 9.33399 1176 H 22 dx2y2 Ryd( 3d) 0.00015 4.39893 1177 H 22 dx2y2 Ryd( 4d) 0.00000 9.75978 1178 H 22 dz2 Ryd( 3d) 0.00002 3.58901 1179 H 22 dz2 Ryd( 4d) 0.00000 9.50606 1180 H 22 f(0) Ryd( 4f) 0.00001 7.08055 1181 H 22 f(c1) Ryd( 4f) 0.00002 7.25080 1182 H 22 f(s1) Ryd( 4f) 0.00001 7.45100 1183 H 22 f(c2) Ryd( 4f) 0.00000 7.81875 1184 H 22 f(s2) Ryd( 4f) 0.00001 7.26943 1185 H 22 f(c3) Ryd( 4f) 0.00004 7.75194 1186 H 22 f(s3) Ryd( 4f) 0.00002 7.48634 1187 H 23 s Val( 1s) 0.74656 0.01889 1188 H 23 s Ryd( 3s) 0.00046 1.70587 1189 H 23 s Ryd( 2s) 0.00009 1.65904 1190 H 23 s Ryd( 4s) 0.00000 5.53629 1191 H 23 px Ryd( 2p) 0.00061 2.34593 1192 H 23 px Ryd( 3p) 0.00004 3.93810 1193 H 23 px Ryd( 4p) 0.00001 8.13117 1194 H 23 py Ryd( 2p) 0.00052 1.77718 1195 H 23 py Ryd( 3p) 0.00001 3.52152 1196 H 23 py Ryd( 4p) 0.00001 7.74566 1197 H 23 pz Ryd( 2p) 0.00067 3.09043 1198 H 23 pz Ryd( 3p) 0.00003 5.27849 1199 H 23 pz Ryd( 4p) 0.00001 8.81671 1200 H 23 dxy Ryd( 3d) 0.00003 3.51499 1201 H 23 dxy Ryd( 4d) 0.00000 9.14733 1202 H 23 dxz Ryd( 3d) 0.00006 4.63661 1203 H 23 dxz Ryd( 4d) 0.00001 10.56541 1204 H 23 dyz Ryd( 3d) 0.00012 4.19903 1205 H 23 dyz Ryd( 4d) 0.00000 9.46426 1206 H 23 dx2y2 Ryd( 3d) 0.00004 3.41577 1207 H 23 dx2y2 Ryd( 4d) 0.00000 9.11572 1208 H 23 dz2 Ryd( 3d) 0.00010 4.76182 1209 H 23 dz2 Ryd( 4d) 0.00001 10.15807 1210 H 23 f(0) Ryd( 4f) 0.00002 7.52213 1211 H 23 f(c1) Ryd( 4f) 0.00005 7.76536 1212 H 23 f(s1) Ryd( 4f) 0.00000 7.60090 1213 H 23 f(c2) Ryd( 4f) 0.00001 7.44071 1214 H 23 f(s2) Ryd( 4f) 0.00000 7.46950 1215 H 23 f(c3) Ryd( 4f) 0.00000 7.18888 1216 H 23 f(s3) Ryd( 4f) 0.00000 7.18931 1217 H 24 s Val( 1s) 0.76605 0.00892 1218 H 24 s Ryd( 3s) 0.00031 1.58162 1219 H 24 s Ryd( 2s) 0.00011 1.19585 1220 H 24 s Ryd( 4s) 0.00000 5.74718 1221 H 24 px Ryd( 2p) 0.00059 2.41025 1222 H 24 px Ryd( 3p) 0.00003 4.26106 1223 H 24 px Ryd( 4p) 0.00001 8.19838 1224 H 24 py Ryd( 2p) 0.00078 3.18071 1225 H 24 py Ryd( 3p) 0.00002 5.07180 1226 H 24 py Ryd( 4p) 0.00001 8.68320 1227 H 24 pz Ryd( 2p) 0.00039 1.85981 1228 H 24 pz Ryd( 3p) 0.00003 3.43503 1229 H 24 pz Ryd( 4p) 0.00001 7.81903 1230 H 24 dxy Ryd( 3d) 0.00008 4.49819 1231 H 24 dxy Ryd( 4d) 0.00001 10.34113 1232 H 24 dxz Ryd( 3d) 0.00003 3.67563 1233 H 24 dxz Ryd( 4d) 0.00000 9.25075 1234 H 24 dyz Ryd( 3d) 0.00011 3.90874 1235 H 24 dyz Ryd( 4d) 0.00000 9.48928 1236 H 24 dx2y2 Ryd( 3d) 0.00014 4.38035 1237 H 24 dx2y2 Ryd( 4d) 0.00000 9.89123 1238 H 24 dz2 Ryd( 3d) 0.00003 3.61767 1239 H 24 dz2 Ryd( 4d) 0.00000 9.49509 1240 H 24 f(0) Ryd( 4f) 0.00001 7.12639 1241 H 24 f(c1) Ryd( 4f) 0.00001 7.16226 1242 H 24 f(s1) Ryd( 4f) 0.00002 7.51188 1243 H 24 f(c2) Ryd( 4f) 0.00000 7.72486 1244 H 24 f(s2) Ryd( 4f) 0.00001 7.36545 1245 H 24 f(c3) Ryd( 4f) 0.00004 7.75233 1246 H 24 f(s3) Ryd( 4f) 0.00001 7.43269 1247 H 25 s Val( 1s) 0.73576 0.06694 1248 H 25 s Ryd( 2s) 0.00121 1.42420 1249 H 25 s Ryd( 3s) 0.00043 1.52306 1250 H 25 s Ryd( 4s) 0.00001 6.23897 1251 H 25 px Ryd( 2p) 0.00065 3.97356 1252 H 25 px Ryd( 3p) 0.00011 6.10680 1253 H 25 px Ryd( 4p) 0.00001 9.18525 1254 H 25 py Ryd( 2p) 0.00029 2.22396 1255 H 25 py Ryd( 3p) 0.00008 3.66124 1256 H 25 py Ryd( 4p) 0.00001 8.22275 1257 H 25 pz Ryd( 2p) 0.00048 2.80056 1258 H 25 pz Ryd( 3p) 0.00004 4.48876 1259 H 25 pz Ryd( 4p) 0.00001 8.36820 1260 H 25 dxy Ryd( 3d) 0.00010 3.80701 1261 H 25 dxy Ryd( 4d) 0.00000 9.77234 1262 H 25 dxz Ryd( 3d) 0.00011 4.13917 1263 H 25 dxz Ryd( 4d) 0.00001 11.12674 1264 H 25 dyz Ryd( 3d) 0.00004 3.25618 1265 H 25 dyz Ryd( 4d) 0.00000 9.25854 1266 H 25 dx2y2 Ryd( 3d) 0.00009 4.05944 1267 H 25 dx2y2 Ryd( 4d) 0.00001 10.64754 1268 H 25 dz2 Ryd( 3d) 0.00008 3.68721 1269 H 25 dz2 Ryd( 4d) 0.00000 9.96808 1270 H 25 f(0) Ryd( 4f) 0.00001 7.52952 1271 H 25 f(c1) Ryd( 4f) 0.00001 7.62163 1272 H 25 f(s1) Ryd( 4f) 0.00000 7.24259 1273 H 25 f(c2) Ryd( 4f) 0.00003 7.34912 1274 H 25 f(s2) Ryd( 4f) 0.00000 7.33944 1275 H 25 f(c3) Ryd( 4f) 0.00002 7.62262 1276 H 25 f(s3) Ryd( 4f) 0.00001 7.49473 1277 H 26 s Val( 1s) 0.74572 0.05493 1278 H 26 s Ryd( 3s) 0.00048 1.75901 1279 H 26 s Ryd( 2s) 0.00031 1.39351 1280 H 26 s Ryd( 4s) 0.00001 6.26732 1281 H 26 px Ryd( 2p) 0.00028 2.49224 1282 H 26 px Ryd( 3p) 0.00003 3.58876 1283 H 26 px Ryd( 4p) 0.00001 8.04736 1284 H 26 py Ryd( 2p) 0.00018 2.26854 1285 H 26 py Ryd( 3p) 0.00013 3.19385 1286 H 26 py Ryd( 4p) 0.00001 8.19279 1287 H 26 pz Ryd( 2p) 0.00071 4.47668 1288 H 26 pz Ryd( 3p) 0.00010 6.79046 1289 H 26 pz Ryd( 4p) 0.00001 9.55937 1290 H 26 dxy Ryd( 3d) 0.00002 3.04912 1291 H 26 dxy Ryd( 4d) 0.00000 9.10992 1292 H 26 dxz Ryd( 3d) 0.00013 4.14171 1293 H 26 dxz Ryd( 4d) 0.00000 10.68816 1294 H 26 dyz Ryd( 3d) 0.00011 3.90424 1295 H 26 dyz Ryd( 4d) 0.00000 10.02086 1296 H 26 dx2y2 Ryd( 3d) 0.00002 3.14656 1297 H 26 dx2y2 Ryd( 4d) 0.00000 9.15441 1298 H 26 dz2 Ryd( 3d) 0.00015 4.66338 1299 H 26 dz2 Ryd( 4d) 0.00001 12.23772 1300 H 26 f(0) Ryd( 4f) 0.00005 7.77052 1301 H 26 f(c1) Ryd( 4f) 0.00002 7.75870 1302 H 26 f(s1) Ryd( 4f) 0.00001 7.47913 1303 H 26 f(c2) Ryd( 4f) 0.00000 7.75104 1304 H 26 f(s2) Ryd( 4f) 0.00000 7.72480 1305 H 26 f(c3) Ryd( 4f) 0.00000 6.83782 1306 H 26 f(s3) Ryd( 4f) 0.00000 6.83974 1307 H 27 s Val( 1s) 0.76622 0.02939 1308 H 27 s Ryd( 3s) 0.00061 1.99955 1309 H 27 s Ryd( 2s) 0.00040 0.80551 1310 H 27 s Ryd( 4s) 0.00001 6.34139 1311 H 27 px Ryd( 2p) 0.00073 4.40844 1312 H 27 px Ryd( 3p) 0.00009 7.64011 1313 H 27 px Ryd( 4p) 0.00001 9.62155 1314 H 27 py Ryd( 2p) 0.00032 2.51942 1315 H 27 py Ryd( 3p) 0.00012 3.28892 1316 H 27 py Ryd( 4p) 0.00001 8.28301 1317 H 27 pz Ryd( 2p) 0.00033 2.56218 1318 H 27 pz Ryd( 3p) 0.00003 3.55574 1319 H 27 pz Ryd( 4p) 0.00001 7.94978 1320 H 27 dxy Ryd( 3d) 0.00009 4.05264 1321 H 27 dxy Ryd( 4d) 0.00000 10.24963 1322 H 27 dxz Ryd( 3d) 0.00011 4.15875 1323 H 27 dxz Ryd( 4d) 0.00000 10.45148 1324 H 27 dyz Ryd( 3d) 0.00002 3.10128 1325 H 27 dyz Ryd( 4d) 0.00000 9.14169 1326 H 27 dx2y2 Ryd( 3d) 0.00012 4.44037 1327 H 27 dx2y2 Ryd( 4d) 0.00001 10.96577 1328 H 27 dz2 Ryd( 3d) 0.00006 3.51138 1329 H 27 dz2 Ryd( 4d) 0.00000 9.87945 1330 H 27 f(0) Ryd( 4f) 0.00001 7.14206 1331 H 27 f(c1) Ryd( 4f) 0.00002 7.72454 1332 H 27 f(s1) Ryd( 4f) 0.00000 6.89335 1333 H 27 f(c2) Ryd( 4f) 0.00001 7.53646 1334 H 27 f(s2) Ryd( 4f) 0.00000 7.67211 1335 H 27 f(c3) Ryd( 4f) 0.00002 7.60678 1336 H 27 f(s3) Ryd( 4f) 0.00002 7.62418 1337 H 28 s Val( 1s) 0.73880 0.06469 1338 H 28 s Ryd( 3s) 0.00096 1.50108 1339 H 28 s Ryd( 2s) 0.00039 1.44133 1340 H 28 s Ryd( 4s) 0.00001 6.27274 1341 H 28 px Ryd( 2p) 0.00062 3.45033 1342 H 28 px Ryd( 3p) 0.00010 5.31467 1343 H 28 px Ryd( 4p) 0.00001 8.82566 1344 H 28 py Ryd( 2p) 0.00031 2.20011 1345 H 28 py Ryd( 3p) 0.00008 3.60985 1346 H 28 py Ryd( 4p) 0.00001 8.18762 1347 H 28 pz Ryd( 2p) 0.00056 3.32234 1348 H 28 pz Ryd( 3p) 0.00006 5.27646 1349 H 28 pz Ryd( 4p) 0.00001 8.71336 1350 H 28 dxy Ryd( 3d) 0.00007 3.54484 1351 H 28 dxy Ryd( 4d) 0.00000 9.56846 1352 H 28 dxz Ryd( 3d) 0.00010 4.12416 1353 H 28 dxz Ryd( 4d) 0.00001 11.38968 1354 H 28 dyz Ryd( 3d) 0.00006 3.47918 1355 H 28 dyz Ryd( 4d) 0.00000 9.47676 1356 H 28 dx2y2 Ryd( 3d) 0.00007 3.74838 1357 H 28 dx2y2 Ryd( 4d) 0.00000 10.11689 1358 H 28 dz2 Ryd( 3d) 0.00010 3.92892 1359 H 28 dz2 Ryd( 4d) 0.00000 10.33107 1360 H 28 f(0) Ryd( 4f) 0.00001 7.73774 1361 H 28 f(c1) Ryd( 4f) 0.00003 7.62489 1362 H 28 f(s1) Ryd( 4f) 0.00000 7.49207 1363 H 28 f(c2) Ryd( 4f) 0.00003 7.30658 1364 H 28 f(s2) Ryd( 4f) 0.00000 7.17556 1365 H 28 f(c3) Ryd( 4f) 0.00001 7.45791 1366 H 28 f(s3) Ryd( 4f) 0.00000 7.39844 1367 H 29 s Val( 1s) 0.74993 0.04943 1368 H 29 s Ryd( 3s) 0.00049 1.57716 1369 H 29 s Ryd( 2s) 0.00034 1.40211 1370 H 29 s Ryd( 4s) 0.00001 6.41843 1371 H 29 px Ryd( 2p) 0.00036 2.80270 1372 H 29 px Ryd( 3p) 0.00004 4.06602 1373 H 29 px Ryd( 4p) 0.00001 8.25883 1374 H 29 py Ryd( 2p) 0.00016 2.32814 1375 H 29 py Ryd( 3p) 0.00015 3.16425 1376 H 29 py Ryd( 4p) 0.00001 8.21007 1377 H 29 pz Ryd( 2p) 0.00060 4.20401 1378 H 29 pz Ryd( 3p) 0.00009 6.25703 1379 H 29 pz Ryd( 4p) 0.00001 9.29491 1380 H 29 dxy Ryd( 3d) 0.00003 3.20247 1381 H 29 dxy Ryd( 4d) 0.00000 9.23530 1382 H 29 dxz Ryd( 3d) 0.00013 4.21046 1383 H 29 dxz Ryd( 4d) 0.00001 11.05571 1384 H 29 dyz Ryd( 3d) 0.00010 3.79526 1385 H 29 dyz Ryd( 4d) 0.00000 9.84948 1386 H 29 dx2y2 Ryd( 3d) 0.00004 3.32455 1387 H 29 dx2y2 Ryd( 4d) 0.00000 9.35114 1388 H 29 dz2 Ryd( 3d) 0.00013 4.49649 1389 H 29 dz2 Ryd( 4d) 0.00001 11.54499 1390 H 29 f(0) Ryd( 4f) 0.00003 7.80439 1391 H 29 f(c1) Ryd( 4f) 0.00004 7.74392 1392 H 29 f(s1) Ryd( 4f) 0.00000 7.55688 1393 H 29 f(c2) Ryd( 4f) 0.00001 7.54514 1394 H 29 f(s2) Ryd( 4f) 0.00000 7.45609 1395 H 29 f(c3) Ryd( 4f) 0.00000 7.03380 1396 H 29 f(s3) Ryd( 4f) 0.00000 7.03580 Summary of Natural Population Analysis: Natural Population Natural --------------------------------------------- Atom No Charge Core Valence Rydberg Total -------------------------------------------------------------------- Co 1 0.07130 17.99985 8.85207 0.07679 26.92870 S 2 -0.25847 9.99998 6.20546 0.05303 16.25847 S 3 -0.02350 9.99998 5.94103 0.08250 16.02350 S 4 -0.04497 9.99998 5.97551 0.06948 16.04497 S 5 -0.02085 9.99998 5.93811 0.08277 16.02085 S 6 -0.26855 9.99998 6.21623 0.05234 16.26855 C 7 -0.94987 1.99997 4.93014 0.01976 6.94987 C 8 -0.94823 1.99997 4.92711 0.02115 6.94823 C 9 -0.94719 1.99997 4.92774 0.01947 6.94719 P 10 1.22713 9.99999 3.69895 0.07393 13.77287 C 11 -0.24614 1.99997 4.21134 0.03483 6.24614 C 12 -0.26493 1.99997 4.23221 0.03275 6.26493 C 13 -0.24124 1.99997 4.20961 0.03166 6.24124 C 14 -0.28605 1.99997 4.25348 0.03259 6.28605 C 15 -0.21999 1.99997 4.18537 0.03465 6.21999 H 16 0.22771 0.00000 0.76851 0.00378 0.77229 H 17 0.23241 0.00000 0.76479 0.00279 0.76759 H 18 0.25774 0.00000 0.73931 0.00295 0.74226 H 19 0.21985 0.00000 0.77654 0.00360 0.78015 H 20 0.26945 0.00000 0.72730 0.00326 0.73055 H 21 0.25570 0.00000 0.74116 0.00314 0.74430 H 22 0.22961 0.00000 0.76667 0.00372 0.77039 H 23 0.25052 0.00000 0.74656 0.00292 0.74948 H 24 0.23117 0.00000 0.76605 0.00278 0.76883 H 25 0.26040 0.00000 0.73576 0.00384 0.73960 H 26 0.25150 0.00000 0.74572 0.00278 0.74850 H 27 0.23062 0.00000 0.76622 0.00316 0.76938 H 28 0.25759 0.00000 0.73880 0.00361 0.74241 H 29 0.24726 0.00000 0.74993 0.00281 0.75274 ==================================================================== * Total * 0.00000 93.99952 89.23767 0.76281 184.00000 Natural Population --------------------------------------------------------- Core 93.99952 ( 99.9995% of 94) Valence 89.23767 ( 99.1530% of 90) Natural Minimal Basis 183.23719 ( 99.5854% of 184) Natural Rydberg Basis 0.76281 ( 0.4146% of 184) --------------------------------------------------------- Atom No Natural Electron Configuration ---------------------------------------------------------------------------- Co 1 [core]4s( 0.36)3d( 8.49)4d( 0.03)4f( 0.01)5d( 0.01)6p( 0.01) 7p( 0.02) S 2 [core]3s( 1.81)3p( 4.40)3d( 0.03)4p( 0.01)4d( 0.01) S 3 [core]3s( 1.78)3p( 4.16)4s( 0.01)3d( 0.06)4p( 0.01) S 4 [core]3s( 1.80)3p( 4.18)4s( 0.01)3d( 0.05)4p( 0.01) S 5 [core]3s( 1.78)3p( 4.16)4s( 0.01)3d( 0.06)4p( 0.01) S 6 [core]3s( 1.81)3p( 4.41)3d( 0.03)4p( 0.01)4d( 0.01) C 7 [core]2s( 1.20)2p( 3.73)3d( 0.01) C 8 [core]2s( 1.20)2p( 3.72)3d( 0.01) C 9 [core]2s( 1.20)2p( 3.73)3d( 0.01) P 10 [core]3s( 1.18)3p( 2.52)4s( 0.01)3d( 0.04)4p( 0.01)4d( 0.01) C 11 [core]2s( 1.02)2p( 3.19)3p( 0.01)3d( 0.01) C 12 [core]2s( 1.01)2p( 3.22)3p( 0.01)3d( 0.01) C 13 [core]2s( 1.01)2p( 3.20)3p( 0.01)3d( 0.01) C 14 [core]2s( 1.01)2p( 3.24)3p( 0.01)3d( 0.01) C 15 [core]2s( 1.02)2p( 3.17)3p( 0.01)3d( 0.01) H 16 1s( 0.77) H 17 1s( 0.76) H 18 1s( 0.74) H 19 1s( 0.78) H 20 1s( 0.73) H 21 1s( 0.74) H 22 1s( 0.77) H 23 1s( 0.75) H 24 1s( 0.77) H 25 1s( 0.74) H 26 1s( 0.75) H 27 1s( 0.77) H 28 1s( 0.74) H 29 1s( 0.75) Wiberg bond index matrix in the NAO basis: Atom 1 2 3 4 5 6 7 8 9 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.0000 0.5234 0.0749 0.0132 0.0732 0.5145 0.0151 0.0128 0.0142 2. S 0.5234 0.0000 1.0706 0.1139 0.0187 0.0390 0.0057 0.0072 0.0030 3. S 0.0749 1.0706 0.0000 1.0027 0.0861 0.0187 0.0010 0.0018 0.0011 4. S 0.0132 0.1139 1.0027 0.0000 1.0023 0.1143 0.0004 0.0008 0.0003 5. S 0.0732 0.0187 0.0861 1.0023 0.0000 1.0717 0.0021 0.0014 0.0011 6. S 0.5145 0.0390 0.0187 0.1143 1.0717 0.0000 0.0048 0.0054 0.0066 7. C 0.0151 0.0057 0.0010 0.0004 0.0021 0.0048 0.0000 0.0135 0.0146 8. C 0.0128 0.0072 0.0018 0.0008 0.0014 0.0054 0.0135 0.0000 0.0134 9. C 0.0142 0.0030 0.0011 0.0003 0.0011 0.0066 0.0146 0.0134 0.0000 10. P 0.4988 0.0674 0.0109 0.0019 0.0106 0.0678 0.9246 0.9455 0.9228 11. C 0.2057 0.0073 0.0045 0.0018 0.0097 0.0633 0.0012 0.0012 0.0024 12. C 0.2058 0.0941 0.0124 0.0007 0.0150 0.0486 0.0033 0.0013 0.0015 13. C 0.1776 0.0501 0.0072 0.0013 0.0053 0.0285 0.0039 0.0025 0.0035 14. C 0.2217 0.0289 0.0109 0.0008 0.0138 0.1066 0.0015 0.0007 0.0046 15. C 0.1841 0.0830 0.0123 0.0015 0.0034 0.0147 0.0024 0.0009 0.0008 16. H 0.0073 0.0003 0.0002 0.0000 0.0002 0.0011 0.9262 0.0013 0.0013 17. H 0.0006 0.0001 0.0000 0.0000 0.0001 0.0003 0.9285 0.0095 0.0009 18. H 0.0010 0.0001 0.0001 0.0001 0.0008 0.0021 0.9132 0.0012 0.0093 19. H 0.0075 0.0035 0.0004 0.0002 0.0001 0.0010 0.0021 0.9295 0.0008 20. H 0.0011 0.0005 0.0001 0.0003 0.0006 0.0026 0.0005 0.9080 0.0085 21. H 0.0006 0.0014 0.0007 0.0001 0.0001 0.0002 0.0084 0.9161 0.0017 22. H 0.0066 0.0009 0.0001 0.0000 0.0002 0.0002 0.0010 0.0016 0.9254 23. H 0.0011 0.0010 0.0003 0.0001 0.0001 0.0001 0.0095 0.0011 0.9183 24. H 0.0006 0.0001 0.0001 0.0000 0.0000 0.0001 0.0010 0.0095 0.9294 25. H 0.0050 0.0004 0.0004 0.0007 0.0037 0.0025 0.0000 0.0001 0.0000 26. H 0.0056 0.0003 0.0001 0.0001 0.0002 0.0012 0.0001 0.0000 0.0000 27. H 0.0059 0.0001 0.0001 0.0001 0.0001 0.0001 0.0003 0.0010 0.0003 28. H 0.0051 0.0024 0.0026 0.0007 0.0001 0.0002 0.0000 0.0000 0.0000 29. H 0.0058 0.0008 0.0001 0.0001 0.0001 0.0004 0.0000 0.0000 0.0002 Atom 10 11 12 13 14 15 16 17 18 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.4988 0.2057 0.2058 0.1776 0.2217 0.1841 0.0073 0.0006 0.0010 2. S 0.0674 0.0073 0.0941 0.0501 0.0289 0.0830 0.0003 0.0001 0.0001 3. S 0.0109 0.0045 0.0124 0.0072 0.0109 0.0123 0.0002 0.0000 0.0001 4. S 0.0019 0.0018 0.0007 0.0013 0.0008 0.0015 0.0000 0.0000 0.0001 5. S 0.0106 0.0097 0.0150 0.0053 0.0138 0.0034 0.0002 0.0001 0.0008 6. S 0.0678 0.0633 0.0486 0.0285 0.1066 0.0147 0.0011 0.0003 0.0021 7. C 0.9246 0.0012 0.0033 0.0039 0.0015 0.0024 0.9262 0.9285 0.9132 8. C 0.9455 0.0012 0.0013 0.0025 0.0007 0.0009 0.0013 0.0095 0.0012 9. C 0.9228 0.0024 0.0015 0.0035 0.0046 0.0008 0.0013 0.0009 0.0093 10. P 0.0000 0.0899 0.0109 0.0984 0.0203 0.0663 0.0039 0.0034 0.0042 11. C 0.0899 0.0000 1.2696 0.0160 0.0168 1.3418 0.0017 0.0001 0.0000 12. C 0.0109 1.2696 0.0000 1.3254 0.0255 0.0162 0.0008 0.0002 0.0001 13. C 0.0984 0.0160 1.3254 0.0000 1.2884 0.0167 0.0027 0.0004 0.0002 14. C 0.0203 0.0168 0.0255 1.2884 0.0000 1.2870 0.0000 0.0001 0.0001 15. C 0.0663 1.3418 0.0162 0.0167 1.2870 0.0000 0.0023 0.0002 0.0002 16. H 0.0039 0.0017 0.0008 0.0027 0.0000 0.0023 0.0000 0.0009 0.0011 17. H 0.0034 0.0001 0.0002 0.0004 0.0001 0.0002 0.0009 0.0000 0.0012 18. H 0.0042 0.0000 0.0001 0.0002 0.0001 0.0002 0.0011 0.0012 0.0000 19. H 0.0031 0.0016 0.0001 0.0011 0.0001 0.0013 0.0003 0.0002 0.0001 20. H 0.0038 0.0002 0.0000 0.0001 0.0000 0.0001 0.0000 0.0000 0.0000 21. H 0.0036 0.0001 0.0001 0.0001 0.0000 0.0000 0.0001 0.0012 0.0002 22. H 0.0039 0.0029 0.0001 0.0027 0.0018 0.0009 0.0002 0.0000 0.0001 23. H 0.0043 0.0002 0.0001 0.0003 0.0001 0.0000 0.0001 0.0001 0.0010 24. H 0.0032 0.0002 0.0001 0.0004 0.0003 0.0001 0.0001 0.0000 0.0001 25. H 0.0001 0.8987 0.0024 0.0077 0.0085 0.0028 0.0000 0.0000 0.0000 26. H 0.0005 0.0027 0.9067 0.0025 0.0085 0.0077 0.0000 0.0000 0.0000 27. H 0.0024 0.0089 0.0028 0.9128 0.0026 0.0087 0.0001 0.0004 0.0000 28. H 0.0001 0.0027 0.0088 0.0082 0.0024 0.9010 0.0000 0.0000 0.0000 29. H 0.0008 0.0078 0.0081 0.0024 0.9088 0.0028 0.0000 0.0000 0.0000 Atom 19 20 21 22 23 24 25 26 27 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.0075 0.0011 0.0006 0.0066 0.0011 0.0006 0.0050 0.0056 0.0059 2. S 0.0035 0.0005 0.0014 0.0009 0.0010 0.0001 0.0004 0.0003 0.0001 3. S 0.0004 0.0001 0.0007 0.0001 0.0003 0.0001 0.0004 0.0001 0.0001 4. S 0.0002 0.0003 0.0001 0.0000 0.0001 0.0000 0.0007 0.0001 0.0001 5. S 0.0001 0.0006 0.0001 0.0002 0.0001 0.0000 0.0037 0.0002 0.0001 6. S 0.0010 0.0026 0.0002 0.0002 0.0001 0.0001 0.0025 0.0012 0.0001 7. C 0.0021 0.0005 0.0084 0.0010 0.0095 0.0010 0.0000 0.0001 0.0003 8. C 0.9295 0.9080 0.9161 0.0016 0.0011 0.0095 0.0001 0.0000 0.0010 9. C 0.0008 0.0085 0.0017 0.9254 0.9183 0.9294 0.0000 0.0000 0.0003 10. P 0.0031 0.0038 0.0036 0.0039 0.0043 0.0032 0.0001 0.0005 0.0024 11. C 0.0016 0.0002 0.0001 0.0029 0.0002 0.0002 0.8987 0.0027 0.0089 12. C 0.0001 0.0000 0.0001 0.0001 0.0001 0.0001 0.0024 0.9067 0.0028 13. C 0.0011 0.0001 0.0001 0.0027 0.0003 0.0004 0.0077 0.0025 0.9128 14. C 0.0001 0.0000 0.0000 0.0018 0.0001 0.0003 0.0085 0.0085 0.0026 15. C 0.0013 0.0001 0.0000 0.0009 0.0000 0.0001 0.0028 0.0077 0.0087 16. H 0.0003 0.0000 0.0001 0.0002 0.0001 0.0001 0.0000 0.0000 0.0001 17. H 0.0002 0.0000 0.0012 0.0000 0.0001 0.0000 0.0000 0.0000 0.0004 18. H 0.0001 0.0000 0.0002 0.0001 0.0010 0.0001 0.0000 0.0000 0.0000 19. H 0.0000 0.0011 0.0010 0.0002 0.0000 0.0000 0.0000 0.0000 0.0000 20. H 0.0011 0.0000 0.0015 0.0002 0.0001 0.0012 0.0000 0.0000 0.0000 21. H 0.0010 0.0015 0.0000 0.0001 0.0001 0.0003 0.0000 0.0000 0.0000 22. H 0.0002 0.0002 0.0001 0.0000 0.0010 0.0009 0.0000 0.0000 0.0000 23. H 0.0000 0.0001 0.0001 0.0010 0.0000 0.0011 0.0000 0.0000 0.0000 24. H 0.0000 0.0012 0.0003 0.0009 0.0011 0.0000 0.0000 0.0000 0.0004 25. H 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0011 0.0004 26. H 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0011 0.0000 0.0012 27. H 0.0000 0.0000 0.0000 0.0000 0.0000 0.0004 0.0004 0.0012 0.0000 28. H 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0013 0.0004 0.0004 29. H 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0005 0.0005 0.0011 Atom 28 29 ---- ------ ------ 1. Co 0.0051 0.0058 2. S 0.0024 0.0008 3. S 0.0026 0.0001 4. S 0.0007 0.0001 5. S 0.0001 0.0001 6. S 0.0002 0.0004 7. C 0.0000 0.0000 8. C 0.0000 0.0000 9. C 0.0000 0.0002 10. P 0.0001 0.0008 11. C 0.0027 0.0078 12. C 0.0088 0.0081 13. C 0.0082 0.0024 14. C 0.0024 0.9088 15. C 0.9010 0.0028 16. H 0.0000 0.0000 17. H 0.0000 0.0000 18. H 0.0000 0.0000 19. H 0.0000 0.0000 20. H 0.0000 0.0000 21. H 0.0000 0.0000 22. H 0.0000 0.0000 23. H 0.0000 0.0000 24. H 0.0000 0.0000 25. H 0.0013 0.0005 26. H 0.0004 0.0005 27. H 0.0004 0.0011 28. H 0.0000 0.0012 29. H 0.0012 0.0000 Wiberg bond index, Totals by atom: Atom 1 ---- ------ 1. Co 2.7890 2. S 2.1242 3. S 2.3203 4. S 2.2585 5. S 2.3207 6. S 2.1167 7. C 3.7849 8. C 3.7873 9. C 3.7860 10. P 3.7733 11. C 3.9592 12. C 3.9606 13. C 3.9662 14. C 3.9610 15. C 3.9596 16. H 0.9521 17. H 0.9486 18. H 0.9365 19. H 0.9554 20. H 0.9307 21. H 0.9376 22. H 0.9512 23. H 0.9401 24. H 0.9492 25. H 0.9365 26. H 0.9395 27. H 0.9502 28. H 0.9376 29. H 0.9417 NBI: Natural Binding Index (NCU strength parameters) Atom 1 2 3 4 5 6 7 8 9 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.0000 0.7235 0.2736 0.1149 0.2705 0.7173 0.1228 0.1131 0.1192 2. S 0.7235 0.0000 1.0347 0.3375 0.1366 0.1974 0.0752 0.0846 0.0552 3. S 0.2736 1.0347 0.0000 1.0014 0.2934 0.1366 0.0310 0.0428 0.0329 4. S 0.1149 0.3375 1.0014 0.0000 1.0011 0.3381 0.0202 0.0276 0.0185 5. S 0.2705 0.1366 0.2934 1.0011 0.0000 1.0352 0.0456 0.0378 0.0333 6. S 0.7173 0.1974 0.1366 0.3381 1.0352 0.0000 0.0692 0.0734 0.0811 7. C 0.1228 0.0752 0.0310 0.0202 0.0456 0.0692 0.0000 0.1160 0.1206 8. C 0.1131 0.0846 0.0428 0.0276 0.0378 0.0734 0.1160 0.0000 0.1159 9. C 0.1192 0.0552 0.0329 0.0185 0.0333 0.0811 0.1206 0.1159 0.0000 10. P 0.7062 0.2596 0.1042 0.0437 0.1029 0.2604 0.9616 0.9724 0.9606 11. C 0.4536 0.0857 0.0671 0.0430 0.0987 0.2516 0.0342 0.0352 0.0491 12. C 0.4537 0.3067 0.1115 0.0261 0.1225 0.2205 0.0577 0.0357 0.0381 13. C 0.4215 0.2238 0.0848 0.0364 0.0726 0.1689 0.0623 0.0500 0.0589 14. C 0.4709 0.1699 0.1045 0.0290 0.1176 0.3265 0.0390 0.0263 0.0677 15. C 0.4290 0.2881 0.1108 0.0386 0.0587 0.1214 0.0491 0.0307 0.0287 16. H 0.0855 0.0165 0.0140 0.0060 0.0129 0.0336 0.9624 0.0359 0.0358 17. H 0.0250 0.0082 0.0054 0.0049 0.0101 0.0177 0.9636 0.0977 0.0302 18. H 0.0317 0.0107 0.0072 0.0081 0.0281 0.0461 0.9556 0.0347 0.0963 19. H 0.0865 0.0592 0.0199 0.0152 0.0076 0.0311 0.0453 0.9641 0.0284 20. H 0.0329 0.0222 0.0122 0.0171 0.0238 0.0506 0.0234 0.9529 0.0922 21. H 0.0247 0.0373 0.0259 0.0079 0.0100 0.0156 0.0917 0.9571 0.0407 22. H 0.0813 0.0299 0.0119 0.0037 0.0138 0.0156 0.0321 0.0404 0.9620 23. H 0.0336 0.0322 0.0165 0.0094 0.0071 0.0109 0.0975 0.0336 0.9583 24. H 0.0241 0.0109 0.0088 0.0055 0.0052 0.0105 0.0324 0.0973 0.9640 25. H 0.0709 0.0208 0.0190 0.0265 0.0609 0.0499 0.0032 0.0071 0.0064 26. H 0.0749 0.0178 0.0106 0.0091 0.0138 0.0341 0.0101 0.0039 0.0043 27. H 0.0769 0.0108 0.0099 0.0076 0.0110 0.0101 0.0179 0.0311 0.0177 28. H 0.0712 0.0490 0.0505 0.0258 0.0122 0.0150 0.0059 0.0052 0.0025 29. H 0.0765 0.0289 0.0112 0.0074 0.0104 0.0195 0.0063 0.0058 0.0144 Atom 10 11 12 13 14 15 16 17 18 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.7062 0.4536 0.4537 0.4215 0.4709 0.4290 0.0855 0.0250 0.0317 2. S 0.2596 0.0857 0.3067 0.2238 0.1699 0.2881 0.0165 0.0082 0.0107 3. S 0.1042 0.0671 0.1115 0.0848 0.1045 0.1108 0.0140 0.0054 0.0072 4. S 0.0437 0.0430 0.0261 0.0364 0.0290 0.0386 0.0060 0.0049 0.0081 5. S 0.1029 0.0987 0.1225 0.0726 0.1176 0.0587 0.0129 0.0101 0.0281 6. S 0.2604 0.2516 0.2205 0.1689 0.3265 0.1214 0.0336 0.0177 0.0461 7. C 0.9616 0.0342 0.0577 0.0623 0.0390 0.0491 0.9624 0.9636 0.9556 8. C 0.9724 0.0352 0.0357 0.0500 0.0263 0.0307 0.0359 0.0977 0.0347 9. C 0.9606 0.0491 0.0381 0.0589 0.0677 0.0287 0.0358 0.0302 0.0963 10. P 0.0000 0.2998 0.1044 0.3136 0.1426 0.2575 0.0621 0.0583 0.0649 11. C 0.2998 0.0000 1.1268 0.1266 0.1295 1.1583 0.0410 0.0073 0.0068 12. C 0.1044 1.1268 0.0000 1.1512 0.1597 0.1274 0.0286 0.0141 0.0093 13. C 0.3136 0.1266 1.1512 0.0000 1.1351 0.1294 0.0517 0.0207 0.0147 14. C 0.1426 0.1295 0.1597 1.1351 0.0000 1.1345 0.0062 0.0097 0.0117 15. C 0.2575 1.1583 0.1274 0.1294 1.1345 0.0000 0.0484 0.0132 0.0152 16. H 0.0621 0.0410 0.0286 0.0517 0.0062 0.0484 0.0000 0.0307 0.0326 17. H 0.0583 0.0073 0.0141 0.0207 0.0097 0.0132 0.0307 0.0000 0.0340 18. H 0.0649 0.0068 0.0093 0.0147 0.0117 0.0152 0.0326 0.0340 0.0000 19. H 0.0561 0.0401 0.0102 0.0328 0.0116 0.0366 0.0171 0.0149 0.0087 20. H 0.0620 0.0150 0.0055 0.0082 0.0062 0.0119 0.0052 0.0065 0.0069 21. H 0.0602 0.0080 0.0093 0.0083 0.0048 0.0065 0.0093 0.0341 0.0125 22. H 0.0624 0.0540 0.0088 0.0516 0.0419 0.0306 0.0157 0.0056 0.0078 23. H 0.0654 0.0144 0.0089 0.0167 0.0100 0.0062 0.0100 0.0091 0.0312 24. H 0.0565 0.0130 0.0089 0.0206 0.0158 0.0077 0.0071 0.0065 0.0108 25. H 0.0101 0.9480 0.0491 0.0879 0.0925 0.0533 0.0015 0.0010 0.0012 26. H 0.0231 0.0519 0.9522 0.0502 0.0923 0.0875 0.0031 0.0051 0.0030 27. H 0.0488 0.0945 0.0525 0.9554 0.0505 0.0934 0.0072 0.0199 0.0029 28. H 0.0096 0.0524 0.0936 0.0905 0.0488 0.9492 0.0030 0.0026 0.0018 29. H 0.0279 0.0882 0.0900 0.0494 0.9533 0.0532 0.0030 0.0024 0.0027 Atom 19 20 21 22 23 24 25 26 27 ---- ------ ------ ------ ------ ------ ------ ------ ------ ------ 1. Co 0.0865 0.0329 0.0247 0.0813 0.0336 0.0241 0.0709 0.0749 0.0769 2. S 0.0592 0.0222 0.0373 0.0299 0.0322 0.0109 0.0208 0.0178 0.0108 3. S 0.0199 0.0122 0.0259 0.0119 0.0165 0.0088 0.0190 0.0106 0.0099 4. S 0.0152 0.0171 0.0079 0.0037 0.0094 0.0055 0.0265 0.0091 0.0076 5. S 0.0076 0.0238 0.0100 0.0138 0.0071 0.0052 0.0609 0.0138 0.0110 6. S 0.0311 0.0506 0.0156 0.0156 0.0109 0.0105 0.0499 0.0341 0.0101 7. C 0.0453 0.0234 0.0917 0.0321 0.0975 0.0324 0.0032 0.0101 0.0179 8. C 0.9641 0.9529 0.9571 0.0404 0.0336 0.0973 0.0071 0.0039 0.0311 9. C 0.0284 0.0922 0.0407 0.9620 0.9583 0.9640 0.0064 0.0043 0.0177 10. P 0.0561 0.0620 0.0602 0.0624 0.0654 0.0565 0.0101 0.0231 0.0488 11. C 0.0401 0.0150 0.0080 0.0540 0.0144 0.0130 0.9480 0.0519 0.0945 12. C 0.0102 0.0055 0.0093 0.0088 0.0089 0.0089 0.0491 0.9522 0.0525 13. C 0.0328 0.0082 0.0083 0.0516 0.0167 0.0206 0.0879 0.0502 0.9554 14. C 0.0116 0.0062 0.0048 0.0419 0.0100 0.0158 0.0925 0.0923 0.0505 15. C 0.0366 0.0119 0.0065 0.0306 0.0062 0.0077 0.0533 0.0875 0.0934 16. H 0.0171 0.0052 0.0093 0.0157 0.0100 0.0071 0.0015 0.0031 0.0072 17. H 0.0149 0.0065 0.0341 0.0056 0.0091 0.0065 0.0010 0.0051 0.0199 18. H 0.0087 0.0069 0.0125 0.0078 0.0312 0.0108 0.0012 0.0030 0.0029 19. H 0.0000 0.0327 0.0324 0.0147 0.0043 0.0054 0.0043 0.0018 0.0058 20. H 0.0327 0.0000 0.0385 0.0136 0.0084 0.0344 0.0020 0.0024 0.0030 21. H 0.0324 0.0385 0.0000 0.0097 0.0083 0.0170 0.0011 0.0018 0.0023 22. H 0.0147 0.0136 0.0097 0.0000 0.0321 0.0304 0.0040 0.0029 0.0063 23. H 0.0043 0.0084 0.0083 0.0321 0.0000 0.0333 0.0016 0.0020 0.0027 24. H 0.0054 0.0344 0.0170 0.0304 0.0333 0.0000 0.0027 0.0022 0.0197 25. H 0.0043 0.0020 0.0011 0.0040 0.0016 0.0027 0.0000 0.0337 0.0200 26. H 0.0018 0.0024 0.0018 0.0029 0.0020 0.0022 0.0337 0.0000 0.0345 27. H 0.0058 0.0030 0.0023 0.0063 0.0027 0.0197 0.0200 0.0345 0.0000 28. H 0.0042 0.0012 0.0020 0.0012 0.0013 0.0009 0.0358 0.0211 0.0199 29. H 0.0029 0.0017 0.0013 0.0025 0.0057 0.0052 0.0216 0.0220 0.0336 Atom 28 29 ---- ------ ------ 1. Co 0.0712 0.0765 2. S 0.0490 0.0289 3. S 0.0505 0.0112 4. S 0.0258 0.0074 5. S 0.0122 0.0104 6. S 0.0150 0.0195 7. C 0.0059 0.0063 8. C 0.0052 0.0058 9. C 0.0025 0.0144 10. P 0.0096 0.0279 11. C 0.0524 0.0882 12. C 0.0936 0.0900 13. C 0.0905 0.0494 14. C 0.0488 0.9533 15. C 0.9492 0.0532 16. H 0.0030 0.0030 17. H 0.0026 0.0024 18. H 0.0018 0.0027 19. H 0.0042 0.0029 20. H 0.0012 0.0017 21. H 0.0020 0.0013 22. H 0.0012 0.0025 23. H 0.0013 0.0057 24. H 0.0009 0.0052 25. H 0.0358 0.0216 26. H 0.0211 0.0220 27. H 0.0199 0.0336 28. H 0.0000 0.0343 29. H 0.0343 0.0000 NATURAL BOND ORBITAL ANALYSIS: Occupancies Lewis Structure Low High Max Occ ------------------- ----------------- occ occ Cycle Ctr Thresh Lewis non-Lewis CR BD nC LP (L) (NL) ============================================================================ 1 3 1.90 178.69732 5.30268 47 30 0 15 6 9 2 3 1.89 178.88030 5.11970 47 28 0 17 6 7 3 3 1.87 178.92204 5.07796 47 28 0 17 4 7 4 3 1.86 179.42597 4.57403 47 29 0 16 3 7 5 3 1.74 180.22817 3.77183 47 29 2 14 2 7 6 3 1.73 180.22817 3.77183 47 29 2 14 2 7 7 3 1.59 180.22573 3.77427 47 29 2 14 2 7 8 3 1.58 180.80141 3.19859 47 30 2 13 1 7 9 3 1.57 179.99133 4.00867 47 30 0 15 2 7 10 3 1.56 180.57763 3.42237 47 31 0 14 1 7 11 3 1.55 180.57763 3.42237 47 31 0 14 1 7 12 3 1.53 180.57763 3.42237 47 31 0 14 1 7 13 3 1.58 180.80141 3.19859 47 30 2 13 1 7 ---------------------------------------------------------------------------- Strongly delocalized structure accepted ------------------------------------------------------- Core 93.99952 ( 99.999% of 94) Valence Lewis 86.80189 ( 96.447% of 90) ================== ============================= Total Lewis 180.80141 ( 98.262% of 184) ----------------------------------------------------- Valence non-Lewis 2.80919 ( 1.527% of 184) Rydberg non-Lewis 0.38941 ( 0.212% of 184) ================== ============================= Total non-Lewis 3.19859 ( 1.738% of 184) ------------------------------------------------------- (Occupancy) Bond orbital / Coefficients / Hybrids ------------------ Lewis ------------------------------------------------------ 1. (2.00000) CR ( 1)Co 1 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 2. (2.00000) CR ( 2)Co 1 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 3. (1.99999) CR ( 3)Co 1 s(100.00%) 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 4. (2.00000) CR ( 4)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 5. (1.99996) CR ( 5)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 6. (2.00000) CR ( 6)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 7. (1.99993) CR ( 7)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 8. (2.00000) CR ( 8)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 9. (1.99997) CR ( 9)Co 1 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 10. (2.00000) CR ( 1) S 2 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 11. (2.00000) CR ( 2) S 2 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 12. (1.99999) CR ( 3) S 2 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 13. (1.99999) CR ( 4) S 2 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 14. (1.99999) CR ( 5) S 2 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 15. (2.00000) CR ( 1) S 3 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 16. (2.00000) CR ( 2) S 3 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 17. (1.99999) CR ( 3) S 3 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 18. (1.99999) CR ( 4) S 3 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 19. (1.99999) CR ( 5) S 3 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 20. (2.00000) CR ( 1) S 4 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 21. (2.00000) CR ( 2) S 4 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 22. (1.99999) CR ( 3) S 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 23. (1.99999) CR ( 4) S 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 24. (1.99999) CR ( 5) S 4 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 25. (2.00000) CR ( 1) S 5 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 26. (2.00000) CR ( 2) S 5 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 27. (1.99999) CR ( 3) S 5 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 28. (1.99999) CR ( 4) S 5 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 29. (1.99999) CR ( 5) S 5 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 30. (2.00000) CR ( 1) S 6 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 31. (2.00000) CR ( 2) S 6 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 32. (1.99999) CR ( 3) S 6 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 33. (1.99999) CR ( 4) S 6 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 34. (1.99999) CR ( 5) S 6 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 35. (1.99997) CR ( 1) C 7 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 36. (1.99997) CR ( 1) C 8 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 37. (1.99997) CR ( 1) C 9 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 38. (2.00000) CR ( 1) P 10 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 39. (2.00000) CR ( 2) P 10 s(100.00%) 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 40. (2.00000) CR ( 3) P 10 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 41. (2.00000) CR ( 4) P 10 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 42. (2.00000) CR ( 5) P 10 s( 0.00%)p 1.00(100.00%) 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 43. (1.99997) CR ( 1) C 11 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 44. (1.99997) CR ( 1) C 12 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 45. (1.99997) CR ( 1) C 13 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 46. (1.99997) CR ( 1) C 14 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 47. (1.99997) CR ( 1) C 15 s(100.00%) 1.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 48. (1.97428) LP ( 1)Co 1 s( 0.02%)p 5.06( 0.09%)d99.99( 99.85%) f 2.42( 0.04%)g 0.02( 0.00%) 0.0000 0.0000 0.0000 0.0120 -0.0053 -0.0021 0.0013 0.0001 -0.0002 0.0000 0.0000 0.0000 0.0000 0.0090 0.0010 -0.0020 -0.0029 0.0000 0.0000 0.0266 0.0064 -0.0006 -0.0075 0.0000 0.0000 0.0003 0.0003 -0.0001 -0.0003 0.4299 -0.0210 -0.0039 0.0003 0.0004 0.0093 -0.0012 0.0009 0.0000 0.0000 0.0536 -0.0005 -0.0001 0.0000 0.0000 -0.6420 -0.0042 0.0032 -0.0010 -0.0004 -0.6306 0.0194 0.0038 0.0001 -0.0002 -0.0010 -0.0002 0.0000 0.0000 0.0063 -0.0005 -0.0003 0.0001 -0.0107 -0.0024 0.0000 0.0002 -0.0005 -0.0001 -0.0001 0.0000 0.0005 0.0001 0.0000 0.0000 -0.0159 -0.0039 0.0004 0.0002 0.0006 -0.0003 -0.0004 0.0002 0.0008 0.0001 0.0000 0.0000 -0.0002 0.0000 0.0011 0.0000 -0.0003 -0.0001 -0.0001 0.0000 -0.0001 0.0000 0.0009 0.0000 -0.0008 0.0001 49. (1.93900) LP ( 2)Co 1 s( 0.00%)p 1.00( 0.03%)d99.99( 99.95%) f 0.56( 0.02%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.0029 0.0012 0.0023 0.0010 0.0003 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0126 -0.0068 -0.0021 0.0060 0.0000 0.0000 0.0065 0.0007 0.0005 -0.0014 0.0000 0.0000 0.0009 -0.0003 0.0002 0.0008 -0.0287 -0.0026 0.0037 -0.0003 0.0002 0.1256 -0.0029 -0.0010 0.0001 0.0000 -0.1060 0.0005 0.0012 -0.0001 0.0000 -0.7037 0.0151 -0.0023 -0.0001 0.0004 0.6890 -0.0382 -0.0034 -0.0014 -0.0001 -0.0005 0.0002 0.0000 0.0000 0.0078 0.0023 -0.0003 0.0000 -0.0066 -0.0004 0.0005 -0.0001 -0.0008 -0.0001 0.0000 0.0000 -0.0012 -0.0002 0.0001 0.0000 -0.0068 -0.0015 0.0001 0.0001 0.0014 -0.0004 -0.0003 0.0001 -0.0004 -0.0002 0.0000 0.0000 0.0002 0.0001 0.0001 -0.0002 0.0000 0.0002 -0.0001 0.0000 -0.0001 0.0000 0.0006 0.0004 0.0002 0.0000 50. (1.92494) LP ( 3)Co 1 s( 0.00%)p 0.00( 0.00%)d 1.00( 99.98%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.0014 -0.0005 0.0005 0.0001 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0019 -0.0010 -0.0005 0.0007 0.0000 0.0000 0.0010 0.0001 0.0002 -0.0002 0.0000 0.0000 -0.0027 0.0021 -0.0014 -0.0049 0.0200 -0.0015 0.0019 0.0000 0.0000 -0.8058 0.0237 0.0067 -0.0002 -0.0002 0.5667 0.0003 -0.0057 0.0008 -0.0004 -0.0905 0.0033 -0.0003 0.0001 0.0001 0.1420 -0.0061 -0.0020 -0.0003 0.0000 0.0033 0.0006 -0.0004 0.0000 0.0032 0.0008 -0.0002 0.0000 -0.0021 -0.0001 0.0001 0.0000 0.0003 -0.0007 -0.0003 0.0001 0.0091 0.0015 -0.0006 0.0001 -0.0009 -0.0002 0.0000 0.0000 0.0004 0.0001 -0.0001 0.0000 -0.0001 -0.0001 0.0004 0.0002 -0.0006 -0.0003 0.0000 -0.0001 0.0000 0.0000 0.0005 0.0001 -0.0001 -0.0003 0.0001 0.0000 0.0000 0.0000 51. (1.97456) LP ( 1) S 2 s( 75.98%)p 0.32( 23.98%)d 0.00( 0.03%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.8717 -0.0019 0.0002 -0.0003 0.0000 0.0000 0.0000 0.0000 0.1749 -0.0022 0.0015 0.0000 0.0000 0.0000 -0.4017 0.0033 -0.0031 -0.0008 0.0000 0.0000 -0.2188 -0.0023 -0.0034 -0.0015 0.0000 0.0080 -0.0001 -0.0004 -0.0001 0.0049 -0.0038 -0.0016 -0.0001 -0.0114 0.0048 -0.0010 -0.0003 0.0015 -0.0084 -0.0011 -0.0001 0.0021 0.0028 -0.0001 0.0000 0.0019 0.0000 0.0023 -0.0005 0.0004 0.0004 0.0024 -0.0004 0.0031 0.0007 -0.0034 0.0003 -0.0038 -0.0005 0.0000 0.0000 0.0001 0.0003 0.0001 0.0001 -0.0001 0.0003 0.0002 52. (1.90415) LP ( 2) S 2 s( 2.38%)p40.99( 97.39%)d 0.08( 0.18%) f 0.02( 0.05%)g 0.00( 0.00%) 0.0000 0.0000 0.1541 0.0030 -0.0007 0.0001 -0.0001 0.0000 0.0000 0.0000 0.2230 -0.0067 0.0028 0.0003 0.0000 0.0000 0.7551 -0.0109 0.0022 -0.0017 0.0000 0.0000 -0.5948 0.0083 -0.0036 0.0002 0.0000 -0.0122 0.0003 0.0004 0.0001 0.0229 -0.0046 -0.0007 -0.0001 -0.0021 -0.0021 -0.0001 0.0000 -0.0259 0.0079 0.0001 0.0000 -0.0162 0.0102 0.0002 -0.0002 0.0003 0.0009 -0.0034 0.0003 -0.0054 0.0002 -0.0112 0.0002 0.0101 0.0000 0.0085 0.0005 0.0120 0.0000 -0.0004 -0.0021 -0.0004 -0.0004 0.0006 -0.0003 -0.0003 -0.0016 -0.0009 53. (1.99413) LP ( 1) S 3 s( 73.91%)p 0.35( 26.05%)d 0.00( 0.04%) f 0.00( 0.00%)g 0.00( 0.00%) 0.0000 0.0000 0.8595 -0.0188 0.0001 -0.0001 0.0000 0.0000 0.0000 0.0000 -0.2219 0.0010 -0.0022 -0.0015 0.0000 0.0000 0.4278 -0.0076 0.0010 0.0012 0.0000 0.0000 -0.1676 0.0024 -0.0021 -0.0013 0.0000 0.0104 -0.0009 -0.0009 0.0001 0.0019 0.0032 0.0014 0.0000 0.0146 0.0008 0.0004 0.0002 -0.0052 -0.0021 -0.0018 -0.0002 0.0060 0.0002 0.0001 0.0000 0.0028 -0.0003 -0.0024 0.0016 -0.0004 0.0008 0.0023 0.0001 0.0034 -0.0012 0.0031 -0.0015 0.0013 0.0006 0.0001 -0.0001 -0.0002 0.0005 -0.0002 0.0001 0.0000 0.0004 0.0007 54. (1.87030) LP ( 2) S 3 s( 1.59%)p61.76( 98.20%)d 0.11( 0.17%) f 0.03( 0.04%)g 0.00( 0.00%) 0.0000 0.0000 0.1260 0.0047 -0.0002 0.0001 -0.0001 0.0000 0.0000 0.0000 -0.2796 0.0072 0.0012 -0.0001 0.0000 0.0000 -0.6639 0.0213 -0.0017 0.0010 0.0000 0.0000 -0.6797 0.0222 -0.0018 0.0002 0.0000 0.0017 -0.0024 0.0012 -0.0001 -0.0163 0.0009 0.0016 -0.0001 0.0072 -0.0020 0.0003 -0.0001 -0.0229 0.0021 0.0012 -0.0001 -0.0283 0.0034 0.0010 0.0000 -0.0032 0.0002 0.0063 -0.0001 0.0076 -0.0008 -0.0104 0.0017 0.0101 -0.0013 -0.0040 0.0009 -0.0078 0.0012 -0.0013 0.0031 0.0009 0.0006 0.0000 0.0002 0.0015 -0.0030 -0.0016 55. (1.99553) LP ( 1) S 4 s( 75.48%)p 0.32( 24.49%)d 0.00( 0.03%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.8687 -0.0145 0.0000 -0.0001 0.0000 0.0000 0.0000 0.0000 -0.1175 0.0029 -0.0007 -0.0009 0.0000 0.0000 -0.4800 -0.0067 -0.0023 -0.0010 -0.0001 0.0000 -0.0239 -0.0003 -0.0001 -0.0001 0.0000 -0.0126 -0.0008 0.0001 -0.0002 -0.0006 0.0000 0.0000 0.0000 -0.0004 0.0003 0.0002 0.0000 0.0105 -0.0002 -0.0009 0.0000 -0.0014 0.0034 -0.0018 -0.0002 0.0003 -0.0002 0.0048 -0.0019 0.0024 -0.0019 0.0002 -0.0002 -0.0006 0.0002 0.0039 0.0001 0.0007 -0.0004 -0.0001 0.0000 0.0000 0.0006 0.0001 0.0000 -0.0001 0.0003 0.0004 56. (1.89533) LP ( 2) S 4 s( 2.74%)p35.47( 97.04%)d 0.07( 0.19%) f 0.01( 0.03%)g 0.00( 0.00%) 0.0000 0.0000 0.1654 -0.0002 -0.0001 0.0001 0.0000 0.0000 0.0000 0.0000 -0.8453 -0.0245 -0.0012 0.0005 0.0000 0.0000 0.5045 0.0177 0.0034 -0.0009 0.0000 0.0000 0.0220 0.0007 0.0001 0.0000 0.0000 -0.0267 0.0044 0.0001 0.0000 -0.0016 0.0003 0.0000 0.0000 0.0017 -0.0001 -0.0001 0.0000 -0.0338 0.0023 0.0027 0.0000 -0.0013 -0.0001 -0.0003 -0.0001 0.0010 -0.0001 -0.0095 0.0004 0.0092 -0.0011 0.0002 0.0000 0.0008 -0.0001 -0.0022 0.0007 -0.0104 0.0013 -0.0002 -0.0002 0.0004 -0.0035 -0.0015 -0.0001 0.0003 0.0007 -0.0007 57. (1.99381) LP ( 1) S 5 s( 73.79%)p 0.35( 26.16%)d 0.00( 0.04%) f 0.00( 0.00%)g 0.00( 0.00%) 0.0000 0.0000 0.8588 -0.0190 0.0002 -0.0001 0.0000 0.0000 0.0000 0.0000 -0.2316 0.0016 -0.0020 -0.0015 0.0000 0.0000 0.4060 -0.0074 0.0007 0.0010 0.0000 0.0000 0.2076 -0.0034 0.0023 0.0015 0.0000 0.0100 -0.0004 -0.0009 0.0001 -0.0006 -0.0033 -0.0014 0.0000 -0.0150 -0.0008 -0.0001 -0.0002 -0.0071 -0.0022 -0.0017 -0.0002 0.0037 0.0000 0.0000 0.0000 -0.0028 0.0005 -0.0029 0.0018 0.0005 0.0008 -0.0019 0.0000 -0.0034 0.0011 0.0027 -0.0014 0.0018 0.0005 0.0001 0.0001 0.0000 0.0005 -0.0002 0.0000 -0.0001 0.0003 0.0007 58. (1.87039) LP ( 2) S 5 s( 1.67%)p58.88( 98.12%)d 0.10( 0.17%) f 0.02( 0.04%)g 0.00( 0.00%) 0.0000 0.0000 0.1290 0.0039 0.0000 0.0001 -0.0001 0.0000 0.0000 0.0000 -0.2617 0.0068 0.0011 -0.0002 0.0000 0.0000 -0.7341 0.0237 -0.0020 0.0011 0.0000 0.0000 0.6106 -0.0200 0.0014 -0.0001 0.0000 -0.0003 -0.0024 0.0015 -0.0001 0.0163 -0.0010 -0.0015 0.0001 0.0001 0.0013 -0.0008 0.0001 -0.0228 0.0022 0.0010 -0.0001 -0.0289 0.0037 0.0009 0.0000 0.0047 -0.0003 0.0046 0.0001 0.0048 -0.0004 0.0109 -0.0016 -0.0101 0.0011 -0.0045 0.0010 -0.0096 0.0015 -0.0015 -0.0030 -0.0006 0.0002 0.0007 -0.0003 -0.0012 -0.0031 -0.0018 59. (1.97410) LP ( 1) S 6 s( 75.49%)p 0.32( 24.47%)d 0.00( 0.03%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.8689 -0.0022 0.0001 -0.0003 0.0000 0.0000 0.0000 0.0000 0.1833 -0.0023 0.0013 -0.0001 0.0000 0.0000 -0.4179 0.0037 -0.0034 -0.0009 0.0000 0.0000 0.1908 0.0023 0.0034 0.0014 0.0000 0.0076 -0.0005 -0.0005 -0.0001 -0.0050 0.0042 0.0014 0.0001 0.0113 -0.0046 0.0009 0.0003 0.0009 -0.0079 -0.0012 0.0000 0.0031 0.0023 0.0000 0.0000 -0.0015 0.0000 0.0020 -0.0005 0.0011 0.0002 -0.0026 0.0004 -0.0027 -0.0007 -0.0038 0.0003 -0.0041 -0.0005 0.0000 0.0000 -0.0002 0.0004 0.0001 -0.0001 0.0001 0.0002 0.0003 60. (1.90365) LP ( 2) S 6 s( 2.72%)p35.75( 97.07%)d 0.06( 0.17%) f 0.02( 0.05%)g 0.00( 0.00%) 0.0000 0.0000 0.1647 0.0037 -0.0007 0.0001 -0.0001 0.0000 0.0000 0.0000 0.2038 -0.0055 0.0023 0.0001 0.0000 0.0000 0.7227 -0.0110 0.0023 -0.0016 -0.0001 0.0000 0.6376 -0.0085 0.0035 -0.0003 0.0000 -0.0105 -0.0003 0.0005 0.0000 -0.0234 0.0046 0.0007 0.0002 0.0040 0.0007 0.0001 0.0001 -0.0241 0.0076 0.0000 0.0000 -0.0146 0.0100 0.0002 -0.0002 -0.0012 -0.0009 -0.0040 0.0002 -0.0064 0.0004 0.0125 -0.0001 -0.0099 -0.0002 0.0072 0.0004 0.0122 0.0000 -0.0004 0.0021 0.0006 -0.0003 0.0003 0.0003 0.0004 -0.0014 -0.0011 61. (1.90100) BD ( 1)Co 1- S 2 ( 37.03%) 0.6085*Co 1 s( 31.59%)p 0.01( 0.23%)d 2.16( 68.12%) f 0.00( 0.07%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5617 0.0171 -0.0079 0.0009 0.0003 0.0001 0.0000 0.0000 0.0000 0.0000 -0.0187 -0.0225 -0.0040 -0.0009 0.0000 0.0000 0.0038 -0.0296 0.0031 -0.0007 0.0000 0.0000 -0.0014 -0.0220 -0.0018 0.0012 0.3664 0.0263 -0.0014 0.0029 -0.0002 0.4207 0.0202 0.0061 0.0014 0.0004 0.5638 0.0427 0.0067 0.0018 -0.0007 0.1430 0.0238 0.0011 -0.0035 0.0005 0.1676 -0.0052 0.0003 -0.0007 0.0008 -0.0037 0.0002 -0.0003 0.0000 -0.0119 -0.0072 0.0000 0.0000 -0.0096 -0.0036 0.0001 0.0000 -0.0120 -0.0016 -0.0002 0.0000 -0.0008 -0.0018 -0.0004 0.0000 -0.0126 -0.0014 0.0001 -0.0001 0.0066 -0.0019 -0.0001 -0.0001 -0.0002 0.0000 -0.0001 0.0000 -0.0005 -0.0002 0.0001 0.0000 0.0004 -0.0002 -0.0002 -0.0001 -0.0004 -0.0001 -0.0003 0.0000 -0.0003 -0.0002 ( 62.97%) 0.7935* S 2 s( 10.51%)p 8.44( 88.72%)d 0.07( 0.70%) f 0.01( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.3229 -0.0288 0.0018 0.0005 0.0001 0.0000 0.0000 0.0000 0.3423 0.0104 -0.0049 0.0001 0.0000 0.0000 0.4337 -0.0041 -0.0031 -0.0008 0.0000 0.0000 0.7627 0.0023 -0.0012 -0.0007 0.0000 0.0258 -0.0026 0.0002 0.0000 0.0356 -0.0049 0.0006 -0.0001 0.0586 -0.0151 -0.0008 0.0000 -0.0139 0.0035 0.0003 0.0000 0.0346 -0.0020 0.0003 -0.0001 -0.0115 0.0014 0.0105 0.0007 0.0127 0.0018 0.0085 -0.0004 0.0097 0.0011 0.0034 0.0000 0.0064 -0.0003 -0.0024 0.0023 0.0017 0.0010 0.0041 -0.0017 0.0025 -0.0012 0.0002 62. (1.90224) BD ( 1)Co 1- S 6 ( 36.54%) 0.6045*Co 1 s( 31.80%)p 0.01( 0.23%)d 2.14( 67.91%) f 0.00( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5636 0.0167 -0.0079 0.0008 0.0002 0.0001 0.0000 0.0000 0.0000 0.0000 -0.0174 -0.0228 -0.0036 -0.0009 0.0000 0.0000 0.0038 -0.0312 0.0031 -0.0003 0.0000 0.0000 0.0022 0.0204 0.0022 -0.0014 0.3925 0.0278 -0.0004 0.0027 -0.0003 -0.3941 -0.0144 -0.0091 -0.0006 -0.0005 -0.5847 -0.0453 -0.0054 -0.0017 0.0007 0.1114 0.0214 0.0005 -0.0034 0.0005 0.1081 -0.0088 -0.0009 -0.0009 0.0008 0.0036 -0.0007 0.0003 0.0000 -0.0098 -0.0066 -0.0001 0.0000 -0.0117 -0.0037 0.0000 0.0000 0.0111 0.0011 0.0002 0.0000 0.0050 0.0029 0.0002 0.0000 -0.0123 -0.0012 0.0001 -0.0001 0.0056 -0.0019 -0.0001 -0.0001 -0.0001 0.0001 0.0001 0.0000 0.0006 0.0002 0.0002 0.0000 0.0003 -0.0002 0.0002 0.0001 0.0004 0.0001 -0.0003 0.0000 -0.0003 -0.0002 ( 63.46%) 0.7966* S 6 s( 10.61%)p 8.36( 88.66%)d 0.06( 0.67%) f 0.01( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.3244 -0.0288 0.0021 0.0004 0.0001 0.0000 0.0000 0.0000 0.3317 0.0101 -0.0048 0.0001 0.0000 0.0000 0.4826 -0.0038 -0.0029 -0.0009 0.0000 0.0000 -0.7372 -0.0028 0.0013 0.0006 0.0000 0.0269 -0.0032 0.0003 0.0000 -0.0322 0.0048 -0.0006 0.0001 -0.0598 0.0153 0.0007 0.0000 -0.0167 0.0035 0.0005 0.0000 0.0282 -0.0009 0.0004 -0.0001 0.0133 -0.0009 0.0094 0.0006 0.0113 0.0020 -0.0074 0.0006 -0.0109 -0.0012 0.0026 0.0000 0.0075 -0.0003 -0.0026 -0.0017 -0.0013 0.0005 0.0040 0.0023 -0.0023 -0.0014 0.0000 63. (1.86892) BD ( 1)Co 1- P 10 ( 37.67%) 0.6137*Co 1 s( 36.01%)p 0.00( 0.14%)d 1.77( 63.81%) f 0.00( 0.04%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5999 0.0145 -0.0055 -0.0006 0.0006 0.0000 0.0000 0.0000 0.0000 0.0000 0.0032 0.0012 -0.0042 0.0011 0.0000 0.0000 -0.0069 -0.0368 0.0026 -0.0017 0.0000 0.0000 0.0010 -0.0010 0.0003 -0.0001 -0.7216 -0.0440 -0.0138 0.0015 0.0000 -0.0224 0.0014 -0.0021 0.0002 0.0000 0.0197 0.0006 0.0000 0.0001 0.0000 -0.2219 -0.0207 -0.0033 -0.0030 0.0008 -0.2530 -0.0244 -0.0063 -0.0018 -0.0001 0.0002 -0.0002 0.0001 0.0000 0.0001 -0.0056 0.0001 -0.0001 0.0020 0.0014 0.0004 0.0001 0.0004 0.0001 -0.0001 0.0000 0.0005 0.0004 0.0000 0.0000 -0.0044 -0.0038 -0.0002 -0.0001 -0.0162 -0.0058 -0.0002 -0.0001 0.0001 0.0001 0.0001 0.0000 -0.0001 0.0000 0.0005 0.0001 0.0008 0.0000 0.0001 0.0000 0.0000 0.0000 0.0001 0.0002 0.0006 0.0001 ( 62.33%) 0.7895* P 10 s( 30.62%)p 2.25( 68.75%)d 0.02( 0.52%) f 0.00( 0.09%)g 0.00( 0.01%) 0.0000 0.0000 0.5508 -0.0529 0.0029 0.0004 0.0000 0.0000 0.0000 0.0000 -0.5673 -0.0214 -0.0014 0.0016 0.0000 0.0000 0.6028 0.0426 -0.0003 -0.0012 0.0003 0.0000 0.0050 0.0013 0.0000 0.0000 0.0000 0.0333 -0.0539 0.0042 -0.0001 0.0002 0.0014 0.0002 -0.0001 -0.0004 0.0005 0.0000 -0.0001 0.0038 -0.0119 0.0018 0.0000 0.0193 -0.0260 0.0020 -0.0001 0.0018 -0.0003 0.0154 0.0042 -0.0091 -0.0050 -0.0009 -0.0001 -0.0035 -0.0006 0.0194 0.0076 0.0055 0.0047 0.0043 0.0002 -0.0002 0.0008 0.0067 0.0002 0.0003 -0.0085 0.0012 64. (1.98218) BD ( 1) S 2- S 3 ( 47.51%) 0.6893* S 2 s( 11.36%)p 7.70( 87.45%)d 0.09( 1.05%) f 0.01( 0.13%)g 0.00( 0.01%) 0.0000 0.0000 0.3332 0.0503 0.0010 0.0005 0.0001 0.0000 0.0000 0.0000 -0.8850 -0.0513 0.0006 -0.0019 -0.0001 0.0000 0.2779 -0.0011 -0.0022 0.0009 0.0000 0.0000 0.1056 -0.0159 -0.0033 0.0012 0.0000 -0.0501 -0.0016 0.0001 -0.0003 -0.0374 0.0135 -0.0011 -0.0001 0.0152 -0.0084 -0.0003 0.0000 0.0631 0.0190 0.0003 0.0000 -0.0383 -0.0169 0.0003 -0.0002 0.0009 -0.0019 0.0177 0.0032 -0.0039 -0.0009 -0.0024 0.0022 -0.0063 0.0000 -0.0235 -0.0023 0.0197 0.0027 0.0035 0.0014 0.0000 -0.0047 0.0013 -0.0015 0.0000 0.0032 -0.0060 ( 52.49%) 0.7245* S 3 s( 14.23%)p 5.91( 84.13%)d 0.11( 1.50%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 0.3745 0.0449 -0.0018 0.0001 0.0003 0.0000 0.0000 0.0000 0.8665 0.0379 -0.0006 -0.0013 0.0000 0.0000 -0.2969 -0.0020 0.0021 0.0010 0.0000 0.0000 0.0018 -0.0278 -0.0067 -0.0002 -0.0001 -0.0606 -0.0007 0.0027 -0.0002 0.0144 -0.0050 0.0007 -0.0001 -0.0031 0.0036 0.0004 0.0000 0.0866 -0.0028 -0.0011 0.0002 -0.0592 -0.0009 0.0016 -0.0002 0.0023 -0.0003 -0.0192 0.0002 0.0050 0.0005 -0.0062 0.0011 -0.0018 -0.0004 0.0219 -0.0009 -0.0213 0.0005 0.0042 0.0013 -0.0003 -0.0056 0.0022 -0.0011 0.0012 0.0041 -0.0074 65. (1.98723) BD ( 1) S 3- S 4 ( 49.59%) 0.7042* S 3 s( 10.54%)p 8.35( 88.00%)d 0.13( 1.33%) f 0.01( 0.11%)g 0.00( 0.01%) 0.0000 0.0000 0.3218 0.0432 0.0025 0.0002 -0.0001 0.0000 0.0000 0.0000 -0.3137 -0.0421 -0.0042 -0.0006 -0.0001 0.0000 -0.5302 -0.0141 0.0017 -0.0004 0.0001 0.0000 0.7056 0.0269 -0.0018 0.0011 -0.0001 0.0332 0.0056 -0.0002 0.0001 -0.0407 -0.0059 -0.0006 0.0001 -0.0857 -0.0013 0.0013 -0.0002 -0.0217 -0.0019 0.0011 -0.0002 0.0514 -0.0008 0.0003 0.0001 -0.0048 0.0008 -0.0121 -0.0001 -0.0229 0.0002 -0.0034 -0.0006 0.0187 0.0000 0.0019 0.0007 -0.0048 0.0011 -0.0038 -0.0034 -0.0031 -0.0015 0.0067 0.0052 -0.0026 -0.0030 -0.0003 ( 50.41%) 0.7100* S 4 s( 10.98%)p 7.98( 87.65%)d 0.11( 1.26%) f 0.01( 0.10%)g 0.00( 0.01%) 0.0000 0.0000 0.3292 0.0385 0.0007 0.0002 0.0000 0.0000 0.0000 0.0000 0.3661 -0.0027 -0.0045 0.0001 -0.0001 0.0000 0.5371 -0.0086 -0.0041 -0.0001 -0.0001 0.0000 -0.6721 0.0464 -0.0027 -0.0005 0.0000 0.0532 -0.0037 -0.0011 0.0001 -0.0583 -0.0025 0.0004 0.0000 -0.0761 -0.0038 0.0015 -0.0002 -0.0104 -0.0014 0.0011 -0.0001 0.0199 -0.0024 0.0009 0.0000 -0.0022 0.0008 0.0104 0.0002 0.0173 -0.0009 0.0051 -0.0002 -0.0201 0.0002 -0.0096 0.0007 0.0054 -0.0005 -0.0036 -0.0030 -0.0043 -0.0022 0.0059 0.0041 -0.0017 -0.0017 -0.0006 66. (1.98706) BD ( 1) S 4- S 5 ( 50.49%) 0.7106* S 4 s( 10.99%)p 7.97( 87.64%)d 0.11( 1.25%) f 0.01( 0.10%)g 0.00( 0.01%) 0.0000 0.0000 0.3294 0.0383 0.0007 0.0002 0.0000 0.0000 0.0000 0.0000 0.3618 -0.0024 -0.0044 0.0001 -0.0001 0.0000 0.4690 -0.0044 -0.0043 -0.0001 -0.0001 0.0000 0.7234 -0.0469 0.0023 0.0005 0.0000 0.0466 -0.0039 -0.0011 0.0001 0.0627 0.0022 -0.0005 0.0001 0.0727 0.0035 -0.0018 0.0002 -0.0037 -0.0010 0.0009 0.0000 0.0330 -0.0030 0.0006 0.0000 0.0065 -0.0010 0.0131 0.0002 0.0170 -0.0007 -0.0021 0.0001 0.0191 -0.0003 -0.0073 0.0007 0.0057 -0.0005 -0.0020 0.0043 0.0055 -0.0010 0.0057 -0.0031 0.0021 -0.0014 -0.0002 ( 49.51%) 0.7036* S 5 s( 10.48%)p 8.41( 88.07%)d 0.13( 1.34%) f 0.01( 0.11%)g 0.00( 0.01%) 0.0000 0.0000 0.3208 0.0428 0.0025 0.0002 0.0000 0.0000 0.0000 0.0000 -0.3052 -0.0424 -0.0043 -0.0006 -0.0001 0.0000 -0.4637 -0.0123 0.0013 -0.0003 0.0001 0.0000 -0.7548 -0.0285 0.0019 -0.0012 0.0001 0.0289 0.0045 -0.0003 0.0001 0.0425 0.0061 0.0005 -0.0001 0.0782 0.0018 -0.0015 0.0002 -0.0150 -0.0019 0.0010 -0.0002 0.0656 -0.0003 0.0000 0.0001 -0.0010 -0.0007 -0.0144 -0.0002 -0.0239 0.0002 -0.0003 0.0008 -0.0167 0.0000 -0.0001 0.0006 -0.0050 0.0011 -0.0026 0.0048 0.0045 -0.0005 0.0067 -0.0041 0.0029 -0.0027 0.0001 67. (1.98192) BD ( 1) S 5- S 6 ( 52.45%) 0.7242* S 5 s( 14.35%)p 5.86( 84.00%)d 0.10( 1.50%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 0.3759 0.0462 -0.0019 0.0001 0.0002 0.0000 0.0000 0.0000 0.8724 0.0390 -0.0005 -0.0013 0.0000 0.0000 -0.2745 -0.0028 0.0018 0.0009 0.0000 0.0000 -0.0342 0.0276 0.0069 0.0003 0.0001 -0.0555 -0.0009 0.0026 -0.0002 -0.0209 0.0045 -0.0003 0.0000 0.0044 -0.0033 -0.0005 0.0000 0.0897 -0.0031 -0.0012 0.0003 -0.0581 -0.0016 0.0015 -0.0002 -0.0012 0.0005 -0.0190 0.0002 0.0040 0.0006 0.0041 -0.0009 0.0025 0.0004 0.0239 -0.0010 -0.0206 0.0007 0.0042 -0.0008 0.0001 -0.0058 0.0020 0.0005 -0.0006 0.0047 -0.0072 ( 47.55%) 0.6896* S 6 s( 11.42%)p 7.66( 87.40%)d 0.09( 1.04%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 0.3340 0.0513 0.0009 0.0005 0.0001 0.0000 0.0000 0.0000 -0.8920 -0.0513 0.0004 -0.0018 -0.0001 0.0000 0.2586 -0.0028 -0.0023 0.0012 0.0000 0.0000 -0.0926 0.0157 0.0029 -0.0011 0.0000 -0.0480 0.0002 0.0001 -0.0002 0.0342 -0.0138 0.0011 0.0000 -0.0141 0.0088 0.0003 0.0000 0.0655 0.0187 0.0001 0.0000 -0.0394 -0.0160 0.0004 -0.0002 -0.0019 0.0018 0.0184 0.0033 -0.0036 -0.0009 0.0036 -0.0021 0.0058 -0.0001 -0.0246 -0.0027 0.0178 0.0027 0.0034 -0.0012 -0.0001 -0.0048 0.0012 0.0011 0.0004 0.0039 -0.0059 68. (1.97765) BD ( 1) C 7- P 10 ( 61.89%) 0.7867* C 7 s( 27.43%)p 2.63( 72.16%)d 0.01( 0.33%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 0.5235 -0.0166 -0.0028 -0.0004 -0.0001 0.0000 -0.4313 -0.0095 -0.0041 0.0000 0.0723 0.0025 0.0016 -0.0002 -0.7280 -0.0140 -0.0062 -0.0005 -0.0035 -0.0005 0.0002 0.0436 0.0012 -0.0010 -0.0074 -0.0001 0.0001 0.0125 0.0008 -0.0003 0.0344 0.0002 -0.0004 -0.0045 0.0010 -0.0186 0.0021 0.0000 -0.0008 -0.0026 0.0021 0.0068 0.0004 -0.0119 -0.0014 -0.0049 -0.0010 -0.0003 0.0098 -0.0007 0.0061 -0.0031 0.0035 -0.0007 0.0020 0.0002 ( 38.11%) 0.6173* P 10 s( 22.99%)p 3.32( 76.28%)d 0.03( 0.71%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.4783 0.0327 0.0003 0.0000 0.0001 0.0000 0.0000 0.0000 0.4422 -0.0125 0.0008 0.0004 0.0000 0.0000 -0.0222 -0.0073 -0.0001 0.0003 0.0000 0.0000 0.7519 -0.0348 -0.0019 0.0013 -0.0002 0.0086 0.0080 -0.0003 0.0001 -0.0666 -0.0014 0.0046 0.0003 0.0098 0.0023 -0.0010 0.0000 -0.0209 0.0020 0.0017 0.0001 -0.0439 0.0073 0.0033 0.0003 -0.0012 0.0011 0.0014 0.0054 0.0037 -0.0002 -0.0049 0.0024 -0.0050 -0.0017 0.0052 0.0011 0.0032 0.0004 -0.0003 0.0051 -0.0002 0.0027 -0.0014 0.0016 0.0008 0.0029 0.0004 69. (1.98680) BD ( 1) C 7- H 16 ( 61.58%) 0.7847* C 7 s( 24.63%)p 3.05( 75.18%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4962 0.0070 0.0005 0.0003 0.0003 0.0000 0.5876 -0.0070 -0.0010 0.0002 -0.6351 0.0011 0.0000 -0.0003 -0.0550 -0.0110 -0.0014 0.0001 -0.0290 -0.0037 -0.0005 -0.0086 0.0006 -0.0001 0.0173 -0.0041 -0.0001 -0.0074 0.0010 0.0000 -0.0105 -0.0046 -0.0006 -0.0066 0.0008 -0.0116 -0.0012 -0.0056 0.0003 0.0011 -0.0005 0.0035 0.0022 -0.0065 -0.0009 -0.0025 0.0007 0.0046 -0.0001 -0.0010 -0.0019 0.0075 0.0021 0.0017 -0.0105 0.0024 ( 38.42%) 0.6199* H 16 s( 99.85%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0031 -0.0002 0.0000 0.0224 -0.0029 0.0017 -0.0264 0.0020 -0.0020 -0.0086 -0.0034 -0.0008 -0.0076 -0.0027 0.0002 -0.0001 0.0002 0.0001 -0.0004 -0.0001 -0.0038 -0.0017 -0.0001 0.0047 -0.0038 0.0000 -0.0010 0.0060 0.0047 70. (1.98495) BD ( 1) C 7- H 17 ( 61.59%) 0.7848* C 7 s( 23.93%)p 3.17( 75.88%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4891 0.0084 0.0008 0.0000 -0.0001 0.0000 0.4106 -0.0072 -0.0024 0.0000 0.7463 -0.0014 -0.0020 0.0000 0.1818 -0.0116 -0.0018 -0.0002 0.0214 0.0038 0.0005 0.0009 0.0016 -0.0003 -0.0040 0.0062 0.0003 -0.0256 0.0004 -0.0001 -0.0173 -0.0016 -0.0005 -0.0020 0.0002 -0.0119 -0.0019 0.0044 -0.0010 0.0028 -0.0004 0.0065 -0.0012 -0.0059 -0.0005 -0.0039 -0.0011 0.0032 -0.0047 -0.0037 0.0008 -0.0048 -0.0055 0.0008 -0.0029 -0.0093 ( 38.41%) 0.6198* H 17 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0011 0.0002 0.0000 0.0171 -0.0018 0.0018 0.0299 -0.0022 0.0024 0.0030 -0.0034 0.0005 0.0066 0.0023 0.0014 0.0005 0.0029 0.0011 -0.0037 -0.0013 -0.0027 -0.0014 0.0030 0.0028 0.0034 0.0020 -0.0035 0.0068 0.0006 71. (1.98106) BD ( 1) C 7- H 18 ( 62.81%) 0.7925* C 7 s( 23.84%)p 3.19( 75.95%)d 0.01( 0.16%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4882 0.0058 0.0015 -0.0001 -0.0001 0.0000 -0.5453 -0.0054 0.0012 0.0003 -0.1797 0.0012 0.0002 -0.0002 0.6556 -0.0106 -0.0035 -0.0006 0.0113 0.0001 0.0001 -0.0280 -0.0042 -0.0008 -0.0070 -0.0016 0.0000 0.0237 -0.0024 -0.0002 -0.0013 0.0049 -0.0001 -0.0001 -0.0024 -0.0090 -0.0007 0.0004 0.0008 -0.0055 0.0004 0.0038 0.0003 -0.0117 -0.0007 -0.0041 -0.0004 -0.0054 -0.0063 -0.0005 0.0056 0.0062 -0.0047 -0.0052 0.0022 0.0032 ( 37.19%) 0.6098* H 18 s( 99.87%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0014 0.0000 0.0000 -0.0232 0.0014 -0.0015 -0.0093 -0.0001 -0.0009 0.0229 -0.0044 0.0019 0.0022 0.0007 -0.0060 -0.0026 -0.0020 -0.0009 0.0023 0.0008 0.0038 0.0011 0.0007 0.0072 0.0021 -0.0042 -0.0036 0.0017 0.0017 72. (1.97789) BD ( 1) C 8- P 10 ( 60.71%) 0.7792* C 8 s( 26.66%)p 2.73( 72.92%)d 0.01( 0.35%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 0.5161 -0.0155 -0.0029 -0.0003 -0.0002 0.0000 0.2764 0.0060 0.0036 0.0002 0.7991 0.0135 0.0078 0.0002 0.1181 0.0021 0.0010 0.0001 0.0339 -0.0003 -0.0002 0.0054 0.0000 -0.0001 0.0125 0.0004 -0.0002 -0.0368 -0.0015 0.0007 -0.0280 -0.0007 0.0006 -0.0107 -0.0007 -0.0126 -0.0011 -0.0053 0.0023 0.0015 0.0015 0.0011 -0.0009 -0.0130 0.0021 -0.0105 0.0006 0.0033 -0.0021 -0.0044 0.0033 -0.0052 -0.0022 -0.0009 0.0026 -0.0090 ( 39.29%) 0.6268* P 10 s( 24.02%)p 3.13( 75.27%)d 0.03( 0.69%) f 0.00( 0.02%)g 0.00( 0.00%) 0.0000 0.0000 0.4890 0.0323 -0.0009 -0.0004 -0.0001 0.0000 0.0000 0.0000 -0.3585 0.0192 -0.0005 -0.0015 0.0001 0.0000 -0.7803 0.0245 0.0001 -0.0013 0.0001 0.0000 -0.1200 0.0044 0.0011 0.0000 0.0000 -0.0416 0.0062 0.0030 0.0004 -0.0064 -0.0005 0.0003 0.0001 -0.0181 0.0010 0.0012 0.0001 0.0554 0.0015 -0.0039 -0.0002 0.0403 0.0028 -0.0029 -0.0002 0.0016 0.0017 0.0092 0.0020 -0.0017 0.0025 -0.0013 0.0009 -0.0010 -0.0008 -0.0024 0.0039 0.0045 0.0029 0.0006 -0.0011 -0.0015 0.0007 -0.0041 -0.0017 0.0002 -0.0001 -0.0046 73. (1.98423) BD ( 1) C 8- H 19 ( 61.07%) 0.7815* C 8 s( 24.08%)p 3.14( 75.70%)d 0.01( 0.17%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4907 0.0041 0.0005 0.0002 0.0004 0.0000 0.6469 0.0040 0.0009 0.0002 -0.5622 0.0147 0.0033 -0.0006 0.1493 -0.0002 0.0009 0.0003 -0.0213 -0.0064 -0.0009 0.0149 -0.0010 -0.0002 -0.0041 -0.0015 -0.0003 0.0219 -0.0037 0.0002 -0.0205 -0.0001 0.0000 -0.0088 -0.0008 -0.0103 -0.0005 -0.0046 -0.0014 0.0024 0.0004 0.0033 -0.0001 -0.0066 0.0005 -0.0005 -0.0024 0.0032 -0.0052 0.0042 -0.0028 0.0066 -0.0012 -0.0035 -0.0095 -0.0010 ( 38.93%) 0.6239* H 19 s( 99.85%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0025 -0.0002 0.0000 0.0306 0.0000 0.0027 -0.0159 0.0058 -0.0016 0.0066 0.0003 0.0003 -0.0069 -0.0027 0.0019 0.0006 -0.0014 -0.0007 -0.0001 0.0002 -0.0047 -0.0013 0.0027 0.0040 -0.0027 -0.0003 0.0027 0.0048 0.0058 74. (1.98393) BD ( 1) C 8- H 20 ( 63.50%) 0.7969* C 8 s( 24.75%)p 3.03( 75.05%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4974 0.0074 0.0016 -0.0002 -0.0001 0.0000 -0.6537 0.0042 0.0036 0.0004 -0.1744 0.0096 0.0021 0.0002 0.5410 0.0050 -0.0012 -0.0002 -0.0024 0.0043 -0.0004 -0.0336 -0.0017 -0.0002 0.0043 -0.0038 -0.0005 0.0129 0.0031 0.0008 0.0109 -0.0018 0.0006 -0.0092 0.0001 -0.0084 -0.0015 -0.0009 -0.0008 -0.0035 0.0006 -0.0009 -0.0013 -0.0056 -0.0020 -0.0100 0.0006 -0.0079 0.0009 0.0011 0.0065 0.0035 -0.0056 -0.0047 0.0018 0.0051 ( 36.50%) 0.6041* H 20 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0016 0.0000 0.0000 -0.0225 0.0051 -0.0011 -0.0080 0.0002 -0.0011 0.0245 -0.0008 0.0018 0.0036 0.0009 -0.0064 -0.0025 -0.0017 -0.0009 0.0038 0.0015 0.0007 0.0003 0.0037 0.0044 0.0014 -0.0057 -0.0034 0.0031 0.0030 75. (1.98262) BD ( 1) C 8- H 21 ( 62.72%) 0.7920* C 8 s( 24.33%)p 3.10( 75.47%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4932 0.0075 0.0005 0.0001 0.0000 0.0000 -0.2740 0.0096 0.0019 -0.0003 -0.1023 0.0098 0.0026 0.0003 -0.8179 0.0012 0.0022 0.0003 -0.0012 0.0010 -0.0003 0.0132 0.0032 0.0002 -0.0104 0.0049 0.0002 -0.0036 0.0029 0.0005 0.0340 0.0022 0.0008 -0.0040 -0.0015 -0.0072 -0.0004 -0.0022 0.0009 0.0062 -0.0008 -0.0015 0.0017 -0.0086 -0.0014 -0.0104 -0.0003 0.0064 0.0114 0.0033 0.0014 0.0027 0.0015 0.0022 0.0000 0.0020 ( 37.28%) 0.6105* H 21 s( 99.85%)p 0.00( 0.14%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9992 -0.0013 0.0001 0.0000 -0.0037 0.0048 0.0003 -0.0014 0.0026 -0.0005 -0.0361 0.0028 -0.0030 0.0024 0.0002 0.0042 0.0016 0.0017 0.0008 -0.0001 0.0003 0.0065 0.0026 0.0062 0.0067 0.0027 0.0014 0.0012 0.0008 0.0008 76. (1.97743) BD ( 1) C 9- P 10 ( 62.07%) 0.7879* C 9 s( 27.55%)p 2.61( 72.04%)d 0.01( 0.33%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 0.5246 -0.0165 -0.0025 -0.0005 -0.0001 0.0000 -0.5638 -0.0121 -0.0056 0.0000 -0.0655 -0.0003 0.0003 -0.0003 0.6308 0.0124 0.0055 0.0005 0.0058 -0.0003 0.0000 -0.0492 -0.0006 0.0008 -0.0053 -0.0003 0.0001 0.0215 0.0010 -0.0005 0.0184 -0.0002 -0.0001 -0.0053 -0.0002 -0.0181 0.0014 -0.0003 0.0004 0.0035 -0.0032 0.0037 -0.0005 -0.0136 -0.0010 -0.0029 0.0002 -0.0053 -0.0052 -0.0002 0.0073 0.0022 -0.0052 -0.0023 0.0032 0.0013 ( 37.93%) 0.6159* P 10 s( 22.74%)p 3.36( 76.52%)d 0.03( 0.72%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 0.4757 0.0340 -0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 0.5835 -0.0174 0.0005 0.0008 0.0000 0.0000 0.1251 -0.0145 -0.0010 0.0004 -0.0001 0.0000 -0.6385 0.0298 0.0013 -0.0012 0.0002 -0.0062 0.0097 0.0003 0.0002 0.0730 0.0014 -0.0051 -0.0003 0.0083 -0.0033 -0.0006 -0.0001 -0.0350 0.0020 0.0025 0.0001 -0.0202 0.0036 0.0018 0.0000 0.0043 0.0016 0.0038 0.0047 0.0011 0.0004 0.0067 -0.0032 0.0026 -0.0009 0.0040 0.0023 0.0001 0.0002 -0.0031 -0.0028 0.0000 0.0030 0.0007 -0.0016 -0.0028 0.0028 0.0014 77. (1.98695) BD ( 1) C 9- H 22 ( 61.68%) 0.7853* C 9 s( 24.69%)p 3.04( 75.12%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4969 0.0068 0.0002 0.0003 0.0003 0.0000 0.5378 -0.0085 -0.0020 0.0001 -0.6795 -0.0012 -0.0002 -0.0001 -0.0024 0.0095 0.0011 -0.0001 -0.0260 -0.0042 -0.0007 0.0029 -0.0002 0.0002 -0.0142 0.0046 0.0002 -0.0156 0.0012 0.0000 -0.0157 -0.0030 -0.0004 -0.0030 -0.0013 -0.0129 -0.0012 -0.0050 0.0003 -0.0016 0.0007 0.0052 -0.0013 -0.0064 -0.0013 -0.0008 0.0011 0.0055 0.0005 0.0009 -0.0009 0.0075 0.0007 0.0011 -0.0092 0.0055 ( 38.32%) 0.6191* H 22 s( 99.86%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0032 -0.0002 0.0000 0.0192 -0.0034 0.0016 -0.0290 0.0013 -0.0022 0.0056 0.0030 0.0006 -0.0073 -0.0026 -0.0010 0.0000 0.0003 0.0002 -0.0011 -0.0005 -0.0039 -0.0016 -0.0001 0.0044 -0.0040 -0.0002 -0.0007 0.0068 0.0033 78. (1.98201) BD ( 1) C 9- H 23 ( 62.44%) 0.7902* C 9 s( 23.56%)p 3.24( 76.24%)d 0.01( 0.16%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4853 0.0061 0.0013 -0.0002 -0.0001 0.0000 -0.4129 -0.0070 0.0012 0.0001 0.0308 -0.0008 -0.0011 -0.0006 -0.7686 0.0101 0.0032 0.0004 0.0007 -0.0010 0.0001 0.0323 0.0019 0.0006 -0.0017 -0.0004 0.0000 0.0189 -0.0025 -0.0005 0.0103 0.0063 0.0001 -0.0038 0.0019 -0.0068 -0.0018 0.0002 -0.0005 0.0038 -0.0002 0.0020 0.0003 -0.0136 -0.0007 -0.0029 -0.0001 0.0011 0.0115 -0.0004 0.0053 -0.0017 0.0053 0.0000 0.0019 0.0000 ( 37.56%) 0.6129* H 23 s( 99.87%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0012 0.0000 0.0000 -0.0198 0.0006 -0.0014 -0.0002 -0.0007 -0.0001 -0.0274 0.0052 -0.0024 0.0005 -0.0001 0.0048 0.0022 -0.0007 -0.0001 0.0014 0.0004 0.0058 0.0021 0.0036 0.0080 -0.0005 0.0030 -0.0008 0.0014 -0.0001 79. (1.98540) BD ( 1) C 9- H 24 ( 61.53%) 0.7844* C 9 s( 24.02%)p 3.15( 75.78%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 0.4901 0.0083 0.0009 0.0001 0.0000 0.0000 0.4681 -0.0100 -0.0023 0.0001 0.7287 -0.0028 -0.0023 0.0000 0.0872 0.0085 0.0009 0.0004 0.0213 0.0049 0.0004 0.0058 0.0001 0.0006 0.0194 -0.0039 0.0000 -0.0200 0.0000 -0.0002 -0.0112 -0.0042 -0.0003 -0.0017 -0.0012 -0.0139 -0.0008 0.0043 0.0000 0.0001 0.0003 -0.0009 0.0018 -0.0071 -0.0005 -0.0012 -0.0014 0.0046 -0.0015 -0.0031 -0.0003 -0.0070 -0.0025 0.0002 -0.0060 -0.0086 ( 38.47%) 0.6202* H 24 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9993 -0.0011 0.0002 0.0000 0.0177 -0.0029 0.0018 0.0286 -0.0023 0.0024 0.0074 0.0024 0.0004 0.0075 0.0025 0.0007 0.0004 0.0008 0.0004 -0.0031 -0.0010 -0.0034 -0.0016 0.0014 0.0038 0.0044 0.0004 -0.0014 0.0074 -0.0009 80. (1.97189) BD ( 1) C 11- C 12 ( 49.86%) 0.7061* C 11 s( 31.65%)p 2.15( 68.13%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5626 0.0028 0.0003 -0.0001 0.0005 0.0001 0.6970 0.0010 0.0022 0.0019 -0.0284 -0.0086 -0.0075 0.0015 0.4390 -0.0417 -0.0036 0.0015 -0.0253 -0.0014 0.0011 0.0046 0.0108 0.0021 -0.0051 -0.0029 0.0001 0.0243 0.0101 -0.0007 -0.0116 -0.0019 0.0000 -0.0072 -0.0010 0.0025 -0.0009 0.0061 -0.0002 0.0100 0.0018 -0.0069 -0.0006 0.0095 0.0010 -0.0092 -0.0001 -0.0036 -0.0089 0.0006 0.0048 -0.0007 0.0034 -0.0019 0.0007 -0.0020 ( 50.14%) 0.7081* C 12 s( 33.59%)p 1.97( 66.20%)d 0.00( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5796 -0.0023 0.0006 0.0000 0.0003 0.0000 -0.7281 0.0253 -0.0024 -0.0017 0.2615 -0.0152 -0.0056 0.0022 -0.2482 -0.0313 -0.0038 -0.0001 -0.0010 -0.0083 -0.0006 0.0286 0.0061 -0.0003 0.0029 -0.0046 0.0001 0.0205 0.0079 -0.0006 0.0093 -0.0047 -0.0023 0.0066 0.0017 0.0017 -0.0001 0.0001 0.0000 -0.0133 -0.0007 0.0011 0.0015 -0.0075 -0.0006 0.0107 0.0009 0.0023 -0.0096 0.0020 0.0010 0.0015 0.0031 -0.0037 0.0010 -0.0025 81. (1.97525) BD ( 1) C 11- C 15 ( 50.01%) 0.7071* C 11 s( 32.03%)p 2.12( 67.75%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5659 0.0039 0.0011 0.0000 0.0003 0.0000 0.0511 0.0322 0.0030 0.0001 0.2180 -0.0159 -0.0081 0.0020 -0.7909 0.0210 -0.0019 -0.0024 -0.0065 0.0017 0.0008 -0.0182 -0.0022 0.0011 0.0131 -0.0045 -0.0011 0.0107 0.0004 -0.0016 0.0279 0.0149 0.0005 -0.0183 -0.0020 0.0049 0.0013 0.0012 0.0006 0.0004 0.0000 0.0043 -0.0007 0.0057 -0.0007 0.0029 0.0005 0.0095 -0.0023 -0.0018 -0.0048 0.0018 0.0014 0.0017 0.0023 -0.0021 ( 49.99%) 0.7071* C 15 s( 32.20%)p 2.10( 67.57%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5675 0.0031 0.0013 0.0001 0.0003 0.0001 -0.1429 0.0366 0.0022 -0.0003 0.2132 -0.0156 -0.0080 0.0020 0.7797 -0.0125 0.0019 0.0024 -0.0033 0.0005 0.0006 0.0070 -0.0042 -0.0015 -0.0148 0.0046 0.0012 0.0074 0.0009 -0.0013 0.0335 0.0142 0.0000 0.0179 0.0024 -0.0062 -0.0001 -0.0004 0.0008 0.0016 -0.0005 -0.0035 0.0005 0.0054 -0.0006 0.0039 0.0003 0.0076 -0.0071 0.0020 -0.0034 -0.0002 0.0015 -0.0026 0.0022 -0.0014 82. (1.98199) BD ( 1) C 11- H 25 ( 63.34%) 0.7959* C 11 s( 32.22%)p 2.10( 67.68%)d 0.00( 0.04%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 0.5676 0.0043 -0.0011 0.0002 -0.0004 -0.0001 -0.7042 -0.0097 -0.0057 0.0035 0.1436 -0.0016 -0.0010 -0.0012 0.4001 0.0046 0.0032 -0.0021 0.0038 -0.0038 0.0004 -0.0041 -0.0103 -0.0006 -0.0037 0.0016 0.0004 0.0093 0.0099 -0.0013 0.0013 -0.0018 -0.0012 -0.0082 -0.0013 -0.0029 -0.0001 0.0015 0.0001 0.0150 0.0015 -0.0084 -0.0003 -0.0095 -0.0008 0.0113 0.0001 -0.0026 0.0073 -0.0016 0.0033 -0.0018 -0.0041 0.0020 0.0020 -0.0012 ( 36.66%) 0.6054* H 25 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) 0.9994 -0.0035 -0.0007 0.0001 -0.0246 0.0060 -0.0001 0.0066 0.0010 -0.0002 0.0151 -0.0023 0.0001 -0.0032 -0.0009 -0.0092 -0.0023 0.0019 0.0005 0.0065 0.0021 -0.0023 -0.0004 0.0037 0.0008 -0.0001 -0.0062 0.0019 0.0046 -0.0023 83. (1.97529) BD ( 1) C 12- C 13 ( 49.66%) 0.7047* C 12 s( 32.04%)p 2.11( 67.74%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5660 0.0064 0.0006 -0.0001 0.0004 0.0000 0.6415 -0.0413 -0.0012 0.0026 0.0487 0.0017 -0.0065 0.0009 -0.5114 -0.0112 -0.0052 -0.0012 -0.0109 -0.0010 0.0008 -0.0186 -0.0135 -0.0010 0.0112 -0.0015 0.0000 0.0091 0.0066 0.0000 0.0277 0.0013 -0.0018 0.0009 0.0004 0.0122 0.0022 -0.0023 0.0001 -0.0113 -0.0009 0.0093 -0.0005 0.0083 0.0005 0.0011 -0.0002 -0.0064 0.0018 0.0012 0.0083 -0.0039 -0.0030 -0.0008 0.0000 -0.0005 ( 50.34%) 0.7095* C 13 s( 32.50%)p 2.07( 67.26%)d 0.01( 0.18%) f 0.00( 0.05%)g 0.00( 0.01%) 0.0000 0.5701 0.0051 0.0014 0.0001 0.0003 0.0000 -0.4116 -0.0167 -0.0049 -0.0012 0.2662 -0.0024 -0.0062 0.0021 0.6562 -0.0374 -0.0019 0.0020 -0.0053 -0.0044 0.0006 -0.0256 -0.0094 -0.0006 -0.0027 0.0048 0.0007 0.0300 0.0000 -0.0018 0.0016 0.0069 0.0006 0.0003 -0.0008 -0.0126 -0.0013 0.0080 0.0002 0.0131 0.0014 -0.0012 -0.0014 -0.0041 0.0004 0.0059 0.0001 -0.0063 -0.0053 0.0012 0.0061 -0.0055 0.0002 -0.0008 0.0014 -0.0005 84. (1.58692) BD ( 2) C 12- C 13 ( 50.75%) 0.7124* C 12 s( 2.03%)p47.97( 97.46%)d 0.20( 0.41%) f 0.04( 0.08%)g 0.01( 0.02%) 0.0000 0.1355 -0.0443 0.0001 -0.0004 -0.0003 0.0001 -0.1781 -0.0096 0.0038 0.0008 -0.9563 -0.0197 0.0050 -0.0009 -0.1642 -0.0302 0.0039 -0.0020 0.0143 -0.0098 -0.0005 0.0125 0.0005 -0.0008 0.0561 0.0030 0.0000 -0.0215 0.0010 -0.0010 -0.0065 0.0035 -0.0007 0.0071 -0.0002 -0.0018 0.0004 -0.0252 -0.0012 0.0010 -0.0009 -0.0057 0.0023 -0.0074 -0.0011 -0.0078 -0.0013 -0.0036 -0.0036 -0.0065 -0.0017 -0.0062 0.0033 0.0048 0.0032 -0.0005 ( 49.25%) 0.7018* C 13 s( 2.15%)p45.38( 97.37%)d 0.18( 0.38%) f 0.04( 0.08%)g 0.01( 0.01%) 0.0000 0.1373 -0.0510 -0.0003 -0.0001 0.0002 0.0000 -0.3474 -0.0329 0.0035 -0.0019 -0.9221 -0.0184 0.0019 0.0006 0.0364 -0.0060 0.0029 0.0021 0.0571 -0.0033 0.0008 -0.0014 -0.0022 -0.0010 0.0020 -0.0109 -0.0003 0.0042 0.0056 -0.0008 -0.0193 0.0037 -0.0003 -0.0023 -0.0003 -0.0039 -0.0014 -0.0038 -0.0015 0.0007 0.0010 -0.0024 0.0016 -0.0105 -0.0014 -0.0258 0.0000 -0.0004 0.0011 0.0026 0.0075 0.0067 -0.0023 -0.0023 -0.0044 -0.0020 85. (1.98272) BD ( 1) C 12- H 26 ( 62.79%) 0.7924* C 12 s( 32.25%)p 2.10( 67.65%)d 0.00( 0.03%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 0.5679 0.0029 -0.0010 0.0002 -0.0004 -0.0001 0.1472 0.0055 -0.0005 -0.0009 -0.0858 -0.0051 -0.0023 0.0003 0.8045 0.0080 0.0050 -0.0043 -0.0043 -0.0003 0.0008 0.0014 0.0040 0.0005 -0.0080 -0.0025 0.0003 0.0024 0.0007 -0.0016 0.0067 0.0134 -0.0003 0.0212 0.0019 0.0100 0.0009 -0.0015 -0.0008 0.0044 -0.0005 -0.0027 0.0001 0.0013 0.0000 0.0002 0.0001 0.0065 0.0059 -0.0030 -0.0021 0.0002 -0.0013 0.0011 0.0011 -0.0014 ( 37.21%) 0.6100* H 26 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) 0.9994 0.0014 -0.0016 0.0000 0.0077 0.0008 0.0004 -0.0022 0.0014 -0.0003 0.0291 -0.0053 0.0009 -0.0002 -0.0002 0.0041 0.0009 -0.0014 -0.0004 -0.0006 0.0002 0.0114 0.0029 -0.0077 -0.0035 0.0026 -0.0005 0.0009 -0.0001 0.0001 86. (1.97096) BD ( 1) C 13- C 14 ( 50.13%) 0.7080* C 13 s( 33.94%)p 1.94( 65.83%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5826 -0.0008 0.0009 0.0002 0.0004 0.0000 -0.2759 -0.0284 -0.0051 -0.0007 0.1622 -0.0055 -0.0056 0.0020 -0.7443 0.0310 0.0008 -0.0018 -0.0005 -0.0032 0.0008 0.0289 0.0053 -0.0003 0.0023 -0.0062 -0.0006 0.0235 -0.0013 -0.0019 0.0110 0.0105 0.0008 -0.0092 -0.0003 -0.0146 -0.0020 0.0072 0.0006 -0.0088 -0.0005 -0.0005 0.0012 -0.0021 0.0006 0.0031 -0.0003 0.0000 0.0101 -0.0032 0.0020 -0.0024 -0.0016 0.0026 0.0013 -0.0014 ( 49.87%) 0.7062* C 14 s( 31.74%)p 2.14( 68.04%)d 0.01( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5633 0.0054 0.0005 -0.0001 0.0004 0.0000 0.5037 -0.0418 -0.0027 0.0022 0.0381 0.0008 -0.0061 0.0009 0.6507 0.0017 0.0046 0.0018 -0.0080 -0.0010 0.0007 0.0074 0.0126 0.0016 -0.0130 0.0012 0.0001 0.0057 0.0032 -0.0002 0.0331 0.0066 -0.0012 0.0072 0.0009 0.0139 0.0023 -0.0052 0.0002 0.0080 0.0002 -0.0071 0.0003 0.0055 0.0003 0.0033 -0.0003 -0.0044 0.0069 -0.0027 0.0074 -0.0021 -0.0008 0.0021 -0.0004 -0.0009 87. (1.98192) BD ( 1) C 13- H 27 ( 61.81%) 0.7862* C 13 s( 31.37%)p 2.18( 68.52%)d 0.00( 0.04%) f 0.00( 0.05%)g 0.00( 0.01%) 0.0000 0.5601 0.0046 -0.0020 -0.0002 -0.0005 0.0000 0.7939 0.0061 0.0039 -0.0036 -0.2128 -0.0101 -0.0023 0.0007 0.0977 0.0001 0.0006 -0.0005 -0.0144 -0.0045 0.0005 0.0003 0.0032 0.0001 -0.0016 -0.0006 0.0000 0.0027 0.0117 -0.0010 -0.0007 -0.0071 -0.0011 -0.0032 -0.0004 -0.0105 -0.0015 0.0030 0.0005 0.0045 0.0005 -0.0021 -0.0002 0.0159 0.0010 -0.0111 -0.0008 0.0063 -0.0039 0.0008 -0.0042 0.0026 0.0014 -0.0013 0.0018 -0.0036 ( 38.19%) 0.6179* H 27 s( 99.88%)p 0.00( 0.10%)d 0.00( 0.01%) f 0.00( 0.01%) 0.9994 0.0027 0.0006 0.0001 0.0295 -0.0047 0.0011 -0.0096 -0.0015 -0.0005 0.0036 -0.0008 0.0001 -0.0045 -0.0012 0.0024 0.0006 -0.0006 -0.0001 0.0082 0.0024 -0.0068 -0.0013 0.0014 0.0044 -0.0013 -0.0017 0.0010 -0.0047 0.0051 88. (1.97544) BD ( 1) C 14- C 15 ( 50.33%) 0.7094* C 14 s( 32.02%)p 2.12( 67.77%)d 0.00( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5658 0.0032 0.0006 0.0001 0.0002 0.0000 -0.7360 0.0195 -0.0036 -0.0020 0.3616 -0.0131 -0.0064 0.0022 0.0597 0.0333 0.0036 -0.0005 -0.0037 -0.0088 -0.0004 -0.0232 -0.0016 0.0010 0.0020 0.0029 -0.0003 0.0286 0.0084 -0.0007 -0.0006 -0.0070 -0.0019 -0.0027 -0.0015 0.0090 0.0010 0.0025 -0.0003 0.0088 0.0003 0.0008 -0.0009 -0.0095 -0.0006 0.0120 0.0014 0.0080 0.0040 -0.0009 -0.0035 0.0045 -0.0016 0.0016 0.0014 -0.0036 ( 49.67%) 0.7048* C 15 s( 31.90%)p 2.13( 67.87%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5648 0.0034 0.0005 0.0000 0.0004 0.0001 0.7801 -0.0097 0.0010 0.0022 -0.0268 -0.0078 -0.0073 0.0014 -0.2600 0.0411 0.0038 -0.0009 -0.0266 -0.0021 0.0011 0.0062 -0.0067 -0.0019 -0.0010 0.0026 0.0002 0.0244 0.0120 -0.0002 -0.0109 -0.0055 -0.0009 0.0065 0.0002 -0.0050 -0.0018 0.0076 0.0000 -0.0064 -0.0009 0.0014 0.0005 0.0120 0.0014 -0.0107 -0.0002 0.0041 0.0095 -0.0007 -0.0021 0.0004 -0.0036 0.0012 0.0019 -0.0028 89. (1.98303) BD ( 1) C 14- H 29 ( 62.59%) 0.7911* C 14 s( 32.04%)p 2.12( 67.86%)d 0.00( 0.03%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 0.5660 0.0038 -0.0008 0.0001 -0.0003 -0.0001 0.3383 0.0066 0.0008 -0.0017 -0.0744 -0.0056 -0.0023 0.0001 -0.7473 -0.0058 -0.0058 0.0040 -0.0060 -0.0009 0.0009 -0.0031 -0.0088 -0.0007 0.0071 0.0023 -0.0001 0.0030 0.0021 -0.0014 0.0055 0.0109 -0.0007 -0.0124 -0.0011 0.0179 0.0018 -0.0004 -0.0006 -0.0089 -0.0001 0.0031 0.0002 0.0034 -0.0001 -0.0004 0.0002 0.0006 -0.0085 0.0025 0.0027 -0.0016 0.0015 -0.0011 0.0004 -0.0009 ( 37.41%) 0.6117* H 29 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) 0.9994 -0.0009 -0.0020 0.0001 0.0146 -0.0005 0.0007 -0.0034 0.0004 -0.0005 -0.0261 0.0058 -0.0009 -0.0005 -0.0003 -0.0083 -0.0020 0.0015 0.0003 0.0008 0.0006 0.0087 0.0025 0.0045 -0.0065 0.0020 0.0024 -0.0017 -0.0005 0.0005 90. (1.98202) BD ( 1) C 15- H 28 ( 63.17%) 0.7948* C 15 s( 31.93%)p 2.13( 67.97%)d 0.00( 0.04%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 0.5650 0.0043 -0.0014 0.0000 -0.0004 -0.0001 -0.5901 -0.0083 -0.0043 0.0029 0.1414 -0.0014 -0.0011 -0.0010 -0.5579 -0.0071 -0.0039 0.0029 0.0035 -0.0033 0.0005 0.0054 0.0121 0.0007 0.0052 -0.0025 -0.0003 0.0088 0.0070 -0.0014 0.0034 0.0030 -0.0009 0.0032 0.0009 -0.0120 -0.0013 0.0049 0.0002 -0.0138 -0.0014 0.0101 0.0002 -0.0052 -0.0004 0.0081 0.0000 -0.0061 -0.0009 0.0003 0.0072 -0.0030 0.0022 -0.0010 0.0009 -0.0006 ( 36.83%) 0.6068* H 28 s( 99.88%)p 0.00( 0.10%)d 0.00( 0.02%) f 0.00( 0.01%) 0.9994 -0.0031 -0.0006 0.0001 -0.0215 0.0047 -0.0001 0.0053 0.0002 -0.0001 -0.0210 0.0035 -0.0001 -0.0022 -0.0008 0.0107 0.0026 -0.0025 -0.0006 0.0039 0.0015 0.0017 0.0007 -0.0019 0.0050 -0.0008 0.0061 -0.0022 0.0028 -0.0016 91. (1.74282) 3C ( 1) C 11- C 14- C 15 ( 25.44%) 0.5044* C 11 s( 4.01%)p23.76( 95.30%)d 0.14( 0.58%) f 0.03( 0.10%)g 0.00( 0.01%) 0.0000 0.1952 -0.0448 0.0024 -0.0004 -0.0003 0.0000 -0.1146 0.0160 -0.0035 0.0003 -0.9598 -0.0209 0.0008 -0.0005 -0.1321 -0.0214 -0.0033 -0.0036 -0.0406 0.0021 0.0008 0.0026 0.0034 -0.0001 0.0396 0.0163 0.0015 -0.0455 0.0093 -0.0011 -0.0084 0.0022 0.0010 -0.0038 -0.0014 -0.0028 -0.0002 -0.0074 -0.0038 0.0158 -0.0006 0.0107 0.0002 -0.0207 0.0008 -0.0119 -0.0011 0.0034 0.0001 0.0057 -0.0005 -0.0006 -0.0032 -0.0086 0.0007 0.0008 ( 23.73%) 0.4872* C 14 s( 4.13%)p23.05( 95.22%)d 0.13( 0.54%) f 0.02( 0.10%)g 0.00( 0.01%) 0.0000 0.1979 -0.0460 0.0026 -0.0005 0.0000 0.0000 -0.2928 -0.0258 -0.0032 -0.0030 -0.9238 -0.0119 0.0008 0.0008 0.1083 0.0201 -0.0049 0.0009 0.0377 0.0107 0.0013 -0.0163 0.0014 -0.0011 -0.0555 0.0062 -0.0005 -0.0050 0.0119 0.0009 -0.0160 0.0071 -0.0019 -0.0066 0.0004 0.0048 0.0003 -0.0235 0.0003 0.0011 0.0015 0.0147 0.0000 -0.0040 -0.0036 -0.0094 -0.0025 0.0006 0.0033 0.0018 -0.0045 -0.0084 -0.0005 -0.0017 0.0030 -0.0008 ( 50.83%) 0.7129* C 15 s( 3.87%)p24.71( 95.56%)d 0.12( 0.47%) f 0.02( 0.09%)g 0.00( 0.01%) 0.0000 0.1917 -0.0438 0.0002 -0.0006 0.0000 0.0000 -0.1402 0.0148 0.0005 0.0010 -0.9618 -0.0308 0.0034 -0.0008 0.0971 0.0183 -0.0022 0.0016 -0.0283 -0.0032 0.0002 -0.0064 0.0005 -0.0005 -0.0425 -0.0020 -0.0001 -0.0422 0.0040 -0.0006 -0.0143 0.0037 -0.0005 0.0011 0.0011 -0.0095 -0.0005 -0.0114 -0.0015 -0.0150 0.0008 -0.0073 0.0010 -0.0160 -0.0003 -0.0093 -0.0022 0.0024 -0.0018 -0.0053 0.0020 0.0066 0.0031 0.0070 -0.0005 -0.0019 92. (1.07601) 3Cn( 1) C 11- C 14- C 15 ( 45.84%) 0.6770* C 11 s( 4.01%)p23.76( 95.30%)d 0.14( 0.58%) f 0.03( 0.10%)g 0.00( 0.01%) 0.0000 -0.1952 0.0448 -0.0024 0.0004 0.0003 0.0000 0.1146 -0.0160 0.0035 -0.0003 0.9598 0.0209 -0.0008 0.0005 0.1321 0.0214 0.0033 0.0036 0.0406 -0.0021 -0.0008 -0.0026 -0.0034 0.0001 -0.0396 -0.0163 -0.0015 0.0455 -0.0093 0.0011 0.0084 -0.0022 -0.0010 0.0038 0.0014 0.0028 0.0002 0.0074 0.0038 -0.0158 0.0006 -0.0107 -0.0002 0.0207 -0.0008 0.0119 0.0011 -0.0034 -0.0001 -0.0057 0.0005 0.0006 0.0032 0.0086 -0.0007 -0.0008 ( 54.11%) 0.7356* C 14 s( 4.13%)p23.05( 95.22%)d 0.13( 0.54%) f 0.02( 0.10%)g 0.00( 0.01%) 0.0000 0.1979 -0.0460 0.0026 -0.0005 0.0000 0.0000 -0.2928 -0.0258 -0.0032 -0.0030 -0.9238 -0.0119 0.0008 0.0008 0.1083 0.0201 -0.0049 0.0009 0.0377 0.0107 0.0013 -0.0163 0.0014 -0.0011 -0.0555 0.0062 -0.0005 -0.0050 0.0119 0.0009 -0.0160 0.0071 -0.0019 -0.0066 0.0004 0.0048 0.0003 -0.0235 0.0003 0.0011 0.0015 0.0147 0.0000 -0.0040 -0.0036 -0.0094 -0.0025 0.0006 0.0033 0.0018 -0.0045 -0.0084 -0.0005 -0.0017 0.0030 -0.0008 ( 0.06%) 0.0236* C 15 s( 3.87%)p24.71( 95.56%)d 0.12( 0.47%) f 0.02( 0.09%)g 0.00( 0.01%) 0.0000 -0.1917 0.0438 -0.0002 0.0006 0.0000 0.0000 0.1402 -0.0148 -0.0005 -0.0010 0.9618 0.0308 -0.0034 0.0008 -0.0971 -0.0183 0.0022 -0.0016 0.0283 0.0032 -0.0002 0.0064 -0.0005 0.0005 0.0425 0.0020 0.0001 0.0422 -0.0040 0.0006 0.0143 -0.0037 0.0005 -0.0011 -0.0011 0.0095 0.0005 0.0114 0.0015 0.0150 -0.0008 0.0073 -0.0010 0.0160 0.0003 0.0093 0.0022 -0.0024 0.0018 0.0053 -0.0020 -0.0066 -0.0031 -0.0070 0.0005 0.0019 ---------------- non-Lewis ---------------------------------------------------- 93. (0.49388) BD*( 1)Co 1- S 2 ( 62.97%) 0.7935*Co 1 s( 31.59%)p 0.01( 0.23%)d 2.16( 68.12%) f 0.00( 0.07%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5617 0.0171 -0.0079 0.0009 0.0003 0.0001 0.0000 0.0000 0.0000 0.0000 -0.0187 -0.0225 -0.0040 -0.0009 0.0000 0.0000 0.0038 -0.0296 0.0031 -0.0007 0.0000 0.0000 -0.0014 -0.0220 -0.0018 0.0012 0.3664 0.0263 -0.0014 0.0029 -0.0002 0.4207 0.0202 0.0061 0.0014 0.0004 0.5638 0.0427 0.0067 0.0018 -0.0007 0.1430 0.0238 0.0011 -0.0035 0.0005 0.1676 -0.0052 0.0003 -0.0007 0.0008 -0.0037 0.0002 -0.0003 0.0000 -0.0119 -0.0072 0.0000 0.0000 -0.0096 -0.0036 0.0001 0.0000 -0.0120 -0.0016 -0.0002 0.0000 -0.0008 -0.0018 -0.0004 0.0000 -0.0126 -0.0014 0.0001 -0.0001 0.0066 -0.0019 -0.0001 -0.0001 -0.0002 0.0000 -0.0001 0.0000 -0.0005 -0.0002 0.0001 0.0000 0.0004 -0.0002 -0.0002 -0.0001 -0.0004 -0.0001 -0.0003 0.0000 -0.0003 -0.0002 ( 37.03%) -0.6085* S 2 s( 10.51%)p 8.44( 88.72%)d 0.07( 0.70%) f 0.01( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.3229 -0.0288 0.0018 0.0005 0.0001 0.0000 0.0000 0.0000 0.3423 0.0104 -0.0049 0.0001 0.0000 0.0000 0.4337 -0.0041 -0.0031 -0.0008 0.0000 0.0000 0.7627 0.0023 -0.0012 -0.0007 0.0000 0.0258 -0.0026 0.0002 0.0000 0.0356 -0.0049 0.0006 -0.0001 0.0586 -0.0151 -0.0008 0.0000 -0.0139 0.0035 0.0003 0.0000 0.0346 -0.0020 0.0003 -0.0001 -0.0115 0.0014 0.0105 0.0007 0.0127 0.0018 0.0085 -0.0004 0.0097 0.0011 0.0034 0.0000 0.0064 -0.0003 -0.0024 0.0023 0.0017 0.0010 0.0041 -0.0017 0.0025 -0.0012 0.0002 94. (0.50289) BD*( 1)Co 1- S 6 ( 63.46%) 0.7966*Co 1 s( 31.80%)p 0.01( 0.23%)d 2.14( 67.91%) f 0.00( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5636 0.0167 -0.0079 0.0008 0.0002 0.0001 0.0000 0.0000 0.0000 0.0000 -0.0174 -0.0228 -0.0036 -0.0009 0.0000 0.0000 0.0038 -0.0312 0.0031 -0.0003 0.0000 0.0000 0.0022 0.0204 0.0022 -0.0014 0.3925 0.0278 -0.0004 0.0027 -0.0003 -0.3941 -0.0144 -0.0091 -0.0006 -0.0005 -0.5847 -0.0453 -0.0054 -0.0017 0.0007 0.1114 0.0214 0.0005 -0.0034 0.0005 0.1081 -0.0088 -0.0009 -0.0009 0.0008 0.0036 -0.0007 0.0003 0.0000 -0.0098 -0.0066 -0.0001 0.0000 -0.0117 -0.0037 0.0000 0.0000 0.0111 0.0011 0.0002 0.0000 0.0050 0.0029 0.0002 0.0000 -0.0123 -0.0012 0.0001 -0.0001 0.0056 -0.0019 -0.0001 -0.0001 -0.0001 0.0001 0.0001 0.0000 0.0006 0.0002 0.0002 0.0000 0.0003 -0.0002 0.0002 0.0001 0.0004 0.0001 -0.0003 0.0000 -0.0003 -0.0002 ( 36.54%) -0.6045* S 6 s( 10.61%)p 8.36( 88.66%)d 0.06( 0.67%) f 0.01( 0.06%)g 0.00( 0.00%) 0.0000 0.0000 0.3244 -0.0288 0.0021 0.0004 0.0001 0.0000 0.0000 0.0000 0.3317 0.0101 -0.0048 0.0001 0.0000 0.0000 0.4826 -0.0038 -0.0029 -0.0009 0.0000 0.0000 -0.7372 -0.0028 0.0013 0.0006 0.0000 0.0269 -0.0032 0.0003 0.0000 -0.0322 0.0048 -0.0006 0.0001 -0.0598 0.0153 0.0007 0.0000 -0.0167 0.0035 0.0005 0.0000 0.0282 -0.0009 0.0004 -0.0001 0.0133 -0.0009 0.0094 0.0006 0.0113 0.0020 -0.0074 0.0006 -0.0109 -0.0012 0.0026 0.0000 0.0075 -0.0003 -0.0026 -0.0017 -0.0013 0.0005 0.0040 0.0023 -0.0023 -0.0014 0.0000 95. (0.48385) BD*( 1)Co 1- P 10 ( 62.33%) 0.7895*Co 1 s( 36.01%)p 0.00( 0.14%)d 1.77( 63.81%) f 0.00( 0.04%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.5999 0.0145 -0.0055 -0.0006 0.0006 0.0000 0.0000 0.0000 0.0000 0.0000 0.0032 0.0012 -0.0042 0.0011 0.0000 0.0000 -0.0069 -0.0368 0.0026 -0.0017 0.0000 0.0000 0.0010 -0.0010 0.0003 -0.0001 -0.7216 -0.0440 -0.0138 0.0015 0.0000 -0.0224 0.0014 -0.0021 0.0002 0.0000 0.0197 0.0006 0.0000 0.0001 0.0000 -0.2219 -0.0207 -0.0033 -0.0030 0.0008 -0.2530 -0.0244 -0.0063 -0.0018 -0.0001 0.0002 -0.0002 0.0001 0.0000 0.0001 -0.0056 0.0001 -0.0001 0.0020 0.0014 0.0004 0.0001 0.0004 0.0001 -0.0001 0.0000 0.0005 0.0004 0.0000 0.0000 -0.0044 -0.0038 -0.0002 -0.0001 -0.0162 -0.0058 -0.0002 -0.0001 0.0001 0.0001 0.0001 0.0000 -0.0001 0.0000 0.0005 0.0001 0.0008 0.0000 0.0001 0.0000 0.0000 0.0000 0.0001 0.0002 0.0006 0.0001 ( 37.67%) -0.6137* P 10 s( 30.62%)p 2.25( 68.75%)d 0.02( 0.52%) f 0.00( 0.09%)g 0.00( 0.01%) 0.0000 0.0000 0.5508 -0.0529 0.0029 0.0004 0.0000 0.0000 0.0000 0.0000 -0.5673 -0.0214 -0.0014 0.0016 0.0000 0.0000 0.6028 0.0426 -0.0003 -0.0012 0.0003 0.0000 0.0050 0.0013 0.0000 0.0000 0.0000 0.0333 -0.0539 0.0042 -0.0001 0.0002 0.0014 0.0002 -0.0001 -0.0004 0.0005 0.0000 -0.0001 0.0038 -0.0119 0.0018 0.0000 0.0193 -0.0260 0.0020 -0.0001 0.0018 -0.0003 0.0154 0.0042 -0.0091 -0.0050 -0.0009 -0.0001 -0.0035 -0.0006 0.0194 0.0076 0.0055 0.0047 0.0043 0.0002 -0.0002 0.0008 0.0067 0.0002 0.0003 -0.0085 0.0012 96. (0.06965) BD*( 1) S 2- S 3 ( 52.49%) 0.7245* S 2 s( 11.36%)p 7.70( 87.45%)d 0.09( 1.05%) f 0.01( 0.13%)g 0.00( 0.01%) 0.0000 0.0000 -0.3332 -0.0503 -0.0010 -0.0005 -0.0001 0.0000 0.0000 0.0000 0.8850 0.0513 -0.0006 0.0019 0.0001 0.0000 -0.2779 0.0011 0.0022 -0.0009 0.0000 0.0000 -0.1056 0.0159 0.0033 -0.0012 0.0000 0.0501 0.0016 -0.0001 0.0003 0.0374 -0.0135 0.0011 0.0001 -0.0152 0.0084 0.0003 0.0000 -0.0631 -0.0190 -0.0003 0.0000 0.0383 0.0169 -0.0003 0.0002 -0.0009 0.0019 -0.0177 -0.0032 0.0039 0.0009 0.0024 -0.0022 0.0063 0.0000 0.0235 0.0023 -0.0197 -0.0027 -0.0035 -0.0014 0.0000 0.0047 -0.0013 0.0015 0.0000 -0.0032 0.0060 ( 47.51%) -0.6893* S 3 s( 14.23%)p 5.91( 84.13%)d 0.11( 1.50%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 -0.3745 -0.0449 0.0018 -0.0001 -0.0003 0.0000 0.0000 0.0000 -0.8665 -0.0379 0.0006 0.0013 0.0000 0.0000 0.2969 0.0020 -0.0021 -0.0010 0.0000 0.0000 -0.0018 0.0278 0.0067 0.0002 0.0001 0.0606 0.0007 -0.0027 0.0002 -0.0144 0.0050 -0.0007 0.0001 0.0031 -0.0036 -0.0004 0.0000 -0.0866 0.0028 0.0011 -0.0002 0.0592 0.0009 -0.0016 0.0002 -0.0023 0.0003 0.0192 -0.0002 -0.0050 -0.0005 0.0062 -0.0011 0.0018 0.0004 -0.0219 0.0009 0.0213 -0.0005 -0.0042 -0.0013 0.0003 0.0056 -0.0022 0.0011 -0.0012 -0.0041 0.0074 97. (0.11647) BD*( 1) S 3- S 4 ( 50.41%) 0.7100* S 3 s( 10.54%)p 8.35( 88.00%)d 0.13( 1.33%) f 0.01( 0.11%)g 0.00( 0.01%) 0.0000 0.0000 -0.3218 -0.0432 -0.0025 -0.0002 0.0001 0.0000 0.0000 0.0000 0.3137 0.0421 0.0042 0.0006 0.0001 0.0000 0.5302 0.0141 -0.0017 0.0004 -0.0001 0.0000 -0.7056 -0.0269 0.0018 -0.0011 0.0001 -0.0332 -0.0056 0.0002 -0.0001 0.0407 0.0059 0.0006 -0.0001 0.0857 0.0013 -0.0013 0.0002 0.0217 0.0019 -0.0011 0.0002 -0.0514 0.0008 -0.0003 -0.0001 0.0048 -0.0008 0.0121 0.0001 0.0229 -0.0002 0.0034 0.0006 -0.0187 0.0000 -0.0019 -0.0007 0.0048 -0.0011 0.0038 0.0034 0.0031 0.0015 -0.0067 -0.0052 0.0026 0.0030 0.0003 ( 49.59%) -0.7042* S 4 s( 10.98%)p 7.98( 87.65%)d 0.11( 1.26%) f 0.01( 0.10%)g 0.00( 0.01%) 0.0000 0.0000 -0.3292 -0.0385 -0.0007 -0.0002 0.0000 0.0000 0.0000 0.0000 -0.3661 0.0027 0.0045 -0.0001 0.0001 0.0000 -0.5371 0.0086 0.0041 0.0001 0.0001 0.0000 0.6721 -0.0464 0.0027 0.0005 0.0000 -0.0532 0.0037 0.0011 -0.0001 0.0583 0.0025 -0.0004 0.0000 0.0761 0.0038 -0.0015 0.0002 0.0104 0.0014 -0.0011 0.0001 -0.0199 0.0024 -0.0009 0.0000 0.0022 -0.0008 -0.0104 -0.0002 -0.0173 0.0009 -0.0051 0.0002 0.0201 -0.0002 0.0096 -0.0007 -0.0054 0.0005 0.0036 0.0030 0.0043 0.0022 -0.0059 -0.0041 0.0017 0.0017 0.0006 98. (0.11697) BD*( 1) S 4- S 5 ( 49.51%) 0.7036* S 4 s( 10.99%)p 7.97( 87.64%)d 0.11( 1.25%) f 0.01( 0.10%)g 0.00( 0.01%) 0.0000 0.0000 0.3294 0.0383 0.0007 0.0002 0.0000 0.0000 0.0000 0.0000 0.3618 -0.0024 -0.0044 0.0001 -0.0001 0.0000 0.4690 -0.0044 -0.0043 -0.0001 -0.0001 0.0000 0.7234 -0.0469 0.0023 0.0005 0.0000 0.0466 -0.0039 -0.0011 0.0001 0.0627 0.0022 -0.0005 0.0001 0.0727 0.0035 -0.0018 0.0002 -0.0037 -0.0010 0.0009 0.0000 0.0330 -0.0030 0.0006 0.0000 0.0065 -0.0010 0.0131 0.0002 0.0170 -0.0007 -0.0021 0.0001 0.0191 -0.0003 -0.0073 0.0007 0.0057 -0.0005 -0.0020 0.0043 0.0055 -0.0010 0.0057 -0.0031 0.0021 -0.0014 -0.0002 ( 50.49%) -0.7106* S 5 s( 10.48%)p 8.41( 88.07%)d 0.13( 1.34%) f 0.01( 0.11%)g 0.00( 0.01%) 0.0000 0.0000 0.3208 0.0428 0.0025 0.0002 0.0000 0.0000 0.0000 0.0000 -0.3052 -0.0424 -0.0043 -0.0006 -0.0001 0.0000 -0.4637 -0.0123 0.0013 -0.0003 0.0001 0.0000 -0.7548 -0.0285 0.0019 -0.0012 0.0001 0.0289 0.0045 -0.0003 0.0001 0.0425 0.0061 0.0005 -0.0001 0.0782 0.0018 -0.0015 0.0002 -0.0150 -0.0019 0.0010 -0.0002 0.0656 -0.0003 0.0000 0.0001 -0.0010 -0.0007 -0.0144 -0.0002 -0.0239 0.0002 -0.0003 0.0008 -0.0167 0.0000 -0.0001 0.0006 -0.0050 0.0011 -0.0026 0.0048 0.0045 -0.0005 0.0067 -0.0041 0.0029 -0.0027 0.0001 99. (0.06916) BD*( 1) S 5- S 6 ( 47.55%) 0.6896* S 5 s( 14.35%)p 5.86( 84.00%)d 0.10( 1.50%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 0.3759 0.0462 -0.0019 0.0001 0.0002 0.0000 0.0000 0.0000 0.8724 0.0390 -0.0005 -0.0013 0.0000 0.0000 -0.2745 -0.0028 0.0018 0.0009 0.0000 0.0000 -0.0342 0.0276 0.0069 0.0003 0.0001 -0.0555 -0.0009 0.0026 -0.0002 -0.0209 0.0045 -0.0003 0.0000 0.0044 -0.0033 -0.0005 0.0000 0.0897 -0.0031 -0.0012 0.0003 -0.0581 -0.0016 0.0015 -0.0002 -0.0012 0.0005 -0.0190 0.0002 0.0040 0.0006 0.0041 -0.0009 0.0025 0.0004 0.0239 -0.0010 -0.0206 0.0007 0.0042 -0.0008 0.0001 -0.0058 0.0020 0.0005 -0.0006 0.0047 -0.0072 ( 52.45%) -0.7242* S 6 s( 11.42%)p 7.66( 87.40%)d 0.09( 1.04%) f 0.01( 0.14%)g 0.00( 0.01%) 0.0000 0.0000 0.3340 0.0513 0.0009 0.0005 0.0001 0.0000 0.0000 0.0000 -0.8920 -0.0513 0.0004 -0.0018 -0.0001 0.0000 0.2586 -0.0028 -0.0023 0.0012 0.0000 0.0000 -0.0926 0.0157 0.0029 -0.0011 0.0000 -0.0480 0.0002 0.0001 -0.0002 0.0342 -0.0138 0.0011 0.0000 -0.0141 0.0088 0.0003 0.0000 0.0655 0.0187 0.0001 0.0000 -0.0394 -0.0160 0.0004 -0.0002 -0.0019 0.0018 0.0184 0.0033 -0.0036 -0.0009 0.0036 -0.0021 0.0058 -0.0001 -0.0246 -0.0027 0.0178 0.0027 0.0034 -0.0012 -0.0001 -0.0048 0.0012 0.0011 0.0004 0.0039 -0.0059 100. (0.05847) BD*( 1) C 7- P 10 ( 38.11%) 0.6173* C 7 s( 27.43%)p 2.63( 72.16%)d 0.01( 0.33%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 -0.5235 0.0166 0.0028 0.0004 0.0001 0.0000 0.4313 0.0095 0.0041 0.0000 -0.0723 -0.0025 -0.0016 0.0002 0.7280 0.0140 0.0062 0.0005 0.0035 0.0005 -0.0002 -0.0436 -0.0012 0.0010 0.0074 0.0001 -0.0001 -0.0125 -0.0008 0.0003 -0.0344 -0.0002 0.0004 0.0045 -0.0010 0.0186 -0.0021 0.0000 0.0008 0.0026 -0.0021 -0.0068 -0.0004 0.0119 0.0014 0.0049 0.0010 0.0003 -0.0098 0.0007 -0.0061 0.0031 -0.0035 0.0007 -0.0020 -0.0002 ( 61.89%) -0.7867* P 10 s( 22.99%)p 3.32( 76.28%)d 0.03( 0.71%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 -0.4783 -0.0327 -0.0003 0.0000 -0.0001 0.0000 0.0000 0.0000 -0.4422 0.0125 -0.0008 -0.0004 0.0000 0.0000 0.0222 0.0073 0.0001 -0.0003 0.0000 0.0000 -0.7519 0.0348 0.0019 -0.0013 0.0002 -0.0086 -0.0080 0.0003 -0.0001 0.0666 0.0014 -0.0046 -0.0003 -0.0098 -0.0023 0.0010 0.0000 0.0209 -0.0020 -0.0017 -0.0001 0.0439 -0.0073 -0.0033 -0.0003 0.0012 -0.0011 -0.0014 -0.0054 -0.0037 0.0002 0.0049 -0.0024 0.0050 0.0017 -0.0052 -0.0011 -0.0032 -0.0004 0.0003 -0.0051 0.0002 -0.0027 0.0014 -0.0016 -0.0008 -0.0029 -0.0004 101. (0.01023) BD*( 1) C 7- H 16 ( 38.42%) 0.6199* C 7 s( 24.63%)p 3.05( 75.18%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4962 -0.0070 -0.0005 -0.0003 -0.0003 0.0000 -0.5876 0.0070 0.0010 -0.0002 0.6351 -0.0011 0.0000 0.0003 0.0550 0.0110 0.0014 -0.0001 0.0290 0.0037 0.0005 0.0086 -0.0006 0.0001 -0.0173 0.0041 0.0001 0.0074 -0.0010 0.0000 0.0105 0.0046 0.0006 0.0066 -0.0008 0.0116 0.0012 0.0056 -0.0003 -0.0011 0.0005 -0.0035 -0.0022 0.0065 0.0009 0.0025 -0.0007 -0.0046 0.0001 0.0010 0.0019 -0.0075 -0.0021 -0.0017 0.0105 -0.0024 ( 61.58%) -0.7847* H 16 s( 99.85%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0031 0.0002 0.0000 -0.0224 0.0029 -0.0017 0.0264 -0.0020 0.0020 0.0086 0.0034 0.0008 0.0076 0.0027 -0.0002 0.0001 -0.0002 -0.0001 0.0004 0.0001 0.0038 0.0017 0.0001 -0.0047 0.0038 0.0000 0.0010 -0.0060 -0.0047 102. (0.00551) BD*( 1) C 7- H 17 ( 38.41%) 0.6198* C 7 s( 23.93%)p 3.17( 75.88%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4891 -0.0084 -0.0008 0.0000 0.0001 0.0000 -0.4106 0.0072 0.0024 0.0000 -0.7463 0.0014 0.0020 0.0000 -0.1818 0.0116 0.0018 0.0002 -0.0214 -0.0038 -0.0005 -0.0009 -0.0016 0.0003 0.0040 -0.0062 -0.0003 0.0256 -0.0004 0.0001 0.0173 0.0016 0.0005 0.0020 -0.0002 0.0119 0.0019 -0.0044 0.0010 -0.0028 0.0004 -0.0065 0.0012 0.0059 0.0005 0.0039 0.0011 -0.0032 0.0047 0.0037 -0.0008 0.0048 0.0055 -0.0008 0.0029 0.0093 ( 61.59%) -0.7848* H 17 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0011 -0.0002 0.0000 -0.0171 0.0018 -0.0018 -0.0299 0.0022 -0.0024 -0.0030 0.0034 -0.0005 -0.0066 -0.0023 -0.0014 -0.0005 -0.0029 -0.0011 0.0037 0.0013 0.0027 0.0014 -0.0030 -0.0028 -0.0034 -0.0020 0.0035 -0.0068 -0.0006 103. (0.00567) BD*( 1) C 7- H 18 ( 37.19%) 0.6098* C 7 s( 23.84%)p 3.19( 75.95%)d 0.01( 0.16%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4882 -0.0058 -0.0015 0.0001 0.0001 0.0000 0.5453 0.0054 -0.0012 -0.0003 0.1797 -0.0012 -0.0002 0.0002 -0.6556 0.0106 0.0035 0.0006 -0.0113 -0.0001 -0.0001 0.0280 0.0042 0.0008 0.0070 0.0016 0.0000 -0.0237 0.0024 0.0002 0.0013 -0.0049 0.0001 0.0001 0.0024 0.0090 0.0007 -0.0004 -0.0008 0.0055 -0.0004 -0.0038 -0.0003 0.0117 0.0007 0.0041 0.0004 0.0054 0.0063 0.0005 -0.0056 -0.0062 0.0047 0.0052 -0.0022 -0.0032 ( 62.81%) -0.7925* H 18 s( 99.87%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0014 0.0000 0.0000 0.0232 -0.0014 0.0015 0.0093 0.0001 0.0009 -0.0229 0.0044 -0.0019 -0.0022 -0.0007 0.0060 0.0026 0.0020 0.0009 -0.0023 -0.0008 -0.0038 -0.0011 -0.0007 -0.0072 -0.0021 0.0042 0.0036 -0.0017 -0.0017 104. (0.04571) BD*( 1) C 8- P 10 ( 39.29%) 0.6268* C 8 s( 26.66%)p 2.73( 72.92%)d 0.01( 0.35%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 -0.5161 0.0155 0.0029 0.0003 0.0002 0.0000 -0.2764 -0.0060 -0.0036 -0.0002 -0.7991 -0.0135 -0.0078 -0.0002 -0.1181 -0.0021 -0.0010 -0.0001 -0.0339 0.0003 0.0002 -0.0054 0.0000 0.0001 -0.0125 -0.0004 0.0002 0.0368 0.0015 -0.0007 0.0280 0.0007 -0.0006 0.0107 0.0007 0.0126 0.0011 0.0053 -0.0023 -0.0015 -0.0015 -0.0011 0.0009 0.0130 -0.0021 0.0105 -0.0006 -0.0033 0.0021 0.0044 -0.0033 0.0052 0.0022 0.0009 -0.0026 0.0090 ( 60.71%) -0.7792* P 10 s( 24.02%)p 3.13( 75.27%)d 0.03( 0.69%) f 0.00( 0.02%)g 0.00( 0.00%) 0.0000 0.0000 -0.4890 -0.0323 0.0009 0.0004 0.0001 0.0000 0.0000 0.0000 0.3585 -0.0192 0.0005 0.0015 -0.0001 0.0000 0.7803 -0.0245 -0.0001 0.0013 -0.0001 0.0000 0.1200 -0.0044 -0.0011 0.0000 0.0000 0.0416 -0.0062 -0.0030 -0.0004 0.0064 0.0005 -0.0003 -0.0001 0.0181 -0.0010 -0.0012 -0.0001 -0.0554 -0.0015 0.0039 0.0002 -0.0403 -0.0028 0.0029 0.0002 -0.0016 -0.0017 -0.0092 -0.0020 0.0017 -0.0025 0.0013 -0.0009 0.0010 0.0008 0.0024 -0.0039 -0.0045 -0.0029 -0.0006 0.0011 0.0015 -0.0007 0.0041 0.0017 -0.0002 0.0001 0.0046 105. (0.00870) BD*( 1) C 8- H 19 ( 38.93%) 0.6239* C 8 s( 24.08%)p 3.14( 75.70%)d 0.01( 0.17%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4907 -0.0041 -0.0005 -0.0002 -0.0004 0.0000 -0.6469 -0.0040 -0.0009 -0.0002 0.5622 -0.0147 -0.0033 0.0006 -0.1493 0.0002 -0.0009 -0.0003 0.0213 0.0064 0.0009 -0.0149 0.0010 0.0002 0.0041 0.0015 0.0003 -0.0219 0.0037 -0.0002 0.0205 0.0001 0.0000 0.0088 0.0008 0.0103 0.0005 0.0046 0.0014 -0.0024 -0.0004 -0.0033 0.0001 0.0066 -0.0005 0.0005 0.0024 -0.0032 0.0052 -0.0042 0.0028 -0.0066 0.0012 0.0035 0.0095 0.0010 ( 61.07%) -0.7815* H 19 s( 99.85%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0025 0.0002 0.0000 -0.0306 0.0000 -0.0027 0.0159 -0.0058 0.0016 -0.0066 -0.0003 -0.0003 0.0069 0.0027 -0.0019 -0.0006 0.0014 0.0007 0.0001 -0.0002 0.0047 0.0013 -0.0027 -0.0040 0.0027 0.0003 -0.0027 -0.0048 -0.0058 106. (0.00669) BD*( 1) C 8- H 20 ( 36.50%) 0.6041* C 8 s( 24.75%)p 3.03( 75.05%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4974 -0.0074 -0.0016 0.0002 0.0001 0.0000 0.6537 -0.0042 -0.0036 -0.0004 0.1744 -0.0096 -0.0021 -0.0002 -0.5410 -0.0050 0.0012 0.0002 0.0024 -0.0043 0.0004 0.0336 0.0017 0.0002 -0.0043 0.0038 0.0005 -0.0129 -0.0031 -0.0008 -0.0109 0.0018 -0.0006 0.0092 -0.0001 0.0084 0.0015 0.0009 0.0008 0.0035 -0.0006 0.0009 0.0013 0.0056 0.0020 0.0100 -0.0006 0.0079 -0.0009 -0.0011 -0.0065 -0.0035 0.0056 0.0047 -0.0018 -0.0051 ( 63.50%) -0.7969* H 20 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0016 0.0000 0.0000 0.0225 -0.0051 0.0011 0.0080 -0.0002 0.0011 -0.0245 0.0008 -0.0018 -0.0036 -0.0009 0.0064 0.0025 0.0017 0.0009 -0.0038 -0.0015 -0.0007 -0.0003 -0.0037 -0.0044 -0.0014 0.0057 0.0034 -0.0031 -0.0030 107. (0.00520) BD*( 1) C 8- H 21 ( 37.28%) 0.6105* C 8 s( 24.33%)p 3.10( 75.47%)d 0.01( 0.15%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4932 -0.0075 -0.0005 -0.0001 0.0000 0.0000 0.2740 -0.0096 -0.0019 0.0003 0.1023 -0.0098 -0.0026 -0.0003 0.8179 -0.0012 -0.0022 -0.0003 0.0012 -0.0010 0.0003 -0.0132 -0.0032 -0.0002 0.0104 -0.0049 -0.0002 0.0036 -0.0029 -0.0005 -0.0340 -0.0022 -0.0008 0.0040 0.0015 0.0072 0.0004 0.0022 -0.0009 -0.0062 0.0008 0.0015 -0.0017 0.0086 0.0014 0.0104 0.0003 -0.0064 -0.0114 -0.0033 -0.0014 -0.0027 -0.0015 -0.0022 0.0000 -0.0020 ( 62.72%) -0.7920* H 21 s( 99.85%)p 0.00( 0.14%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9992 0.0013 -0.0001 0.0000 0.0037 -0.0048 -0.0003 0.0014 -0.0026 0.0005 0.0361 -0.0028 0.0030 -0.0024 -0.0002 -0.0042 -0.0016 -0.0017 -0.0008 0.0001 -0.0003 -0.0065 -0.0026 -0.0062 -0.0067 -0.0027 -0.0014 -0.0012 -0.0008 -0.0008 108. (0.05798) BD*( 1) C 9- P 10 ( 37.93%) 0.6159* C 9 s( 27.55%)p 2.61( 72.04%)d 0.01( 0.33%) f 0.00( 0.06%)g 0.00( 0.02%) 0.0000 -0.5246 0.0165 0.0025 0.0005 0.0001 0.0000 0.5638 0.0121 0.0056 0.0000 0.0655 0.0003 -0.0003 0.0003 -0.6308 -0.0124 -0.0055 -0.0005 -0.0058 0.0003 0.0000 0.0492 0.0006 -0.0008 0.0053 0.0003 -0.0001 -0.0215 -0.0010 0.0005 -0.0184 0.0002 0.0001 0.0053 0.0002 0.0181 -0.0014 0.0003 -0.0004 -0.0035 0.0032 -0.0037 0.0005 0.0136 0.0010 0.0029 -0.0002 0.0053 0.0052 0.0002 -0.0073 -0.0022 0.0052 0.0023 -0.0032 -0.0013 ( 62.07%) -0.7879* P 10 s( 22.74%)p 3.36( 76.52%)d 0.03( 0.72%) f 0.00( 0.01%)g 0.00( 0.00%) 0.0000 0.0000 -0.4757 -0.0340 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 -0.5835 0.0174 -0.0005 -0.0008 0.0000 0.0000 -0.1251 0.0145 0.0010 -0.0004 0.0001 0.0000 0.6385 -0.0298 -0.0013 0.0012 -0.0002 0.0062 -0.0097 -0.0003 -0.0002 -0.0730 -0.0014 0.0051 0.0003 -0.0083 0.0033 0.0006 0.0001 0.0350 -0.0020 -0.0025 -0.0001 0.0202 -0.0036 -0.0018 0.0000 -0.0043 -0.0016 -0.0038 -0.0047 -0.0011 -0.0004 -0.0067 0.0032 -0.0026 0.0009 -0.0040 -0.0023 -0.0001 -0.0002 0.0031 0.0028 0.0000 -0.0030 -0.0007 0.0016 0.0028 -0.0028 -0.0014 109. (0.01027) BD*( 1) C 9- H 22 ( 38.32%) 0.6191* C 9 s( 24.69%)p 3.04( 75.12%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4969 -0.0068 -0.0002 -0.0003 -0.0003 0.0000 -0.5378 0.0085 0.0020 -0.0001 0.6795 0.0012 0.0002 0.0001 0.0024 -0.0095 -0.0011 0.0001 0.0260 0.0042 0.0007 -0.0029 0.0002 -0.0002 0.0142 -0.0046 -0.0002 0.0156 -0.0012 0.0000 0.0157 0.0030 0.0004 0.0030 0.0013 0.0129 0.0012 0.0050 -0.0003 0.0016 -0.0007 -0.0052 0.0013 0.0064 0.0013 0.0008 -0.0011 -0.0055 -0.0005 -0.0009 0.0009 -0.0075 -0.0007 -0.0011 0.0092 -0.0055 ( 61.68%) -0.7853* H 22 s( 99.86%)p 0.00( 0.13%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0032 0.0002 0.0000 -0.0192 0.0034 -0.0016 0.0290 -0.0013 0.0022 -0.0056 -0.0030 -0.0006 0.0073 0.0026 0.0010 0.0000 -0.0003 -0.0002 0.0011 0.0005 0.0039 0.0016 0.0001 -0.0044 0.0040 0.0002 0.0007 -0.0068 -0.0033 110. (0.00498) BD*( 1) C 9- H 23 ( 37.56%) 0.6129* C 9 s( 23.56%)p 3.24( 76.24%)d 0.01( 0.16%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4853 -0.0061 -0.0013 0.0002 0.0001 0.0000 0.4129 0.0070 -0.0012 -0.0001 -0.0308 0.0008 0.0011 0.0006 0.7686 -0.0101 -0.0032 -0.0004 -0.0007 0.0010 -0.0001 -0.0323 -0.0019 -0.0006 0.0017 0.0004 0.0000 -0.0189 0.0025 0.0005 -0.0103 -0.0063 -0.0001 0.0038 -0.0019 0.0068 0.0018 -0.0002 0.0005 -0.0038 0.0002 -0.0020 -0.0003 0.0136 0.0007 0.0029 0.0001 -0.0011 -0.0115 0.0004 -0.0053 0.0017 -0.0053 0.0000 -0.0019 0.0000 ( 62.44%) -0.7902* H 23 s( 99.87%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0012 0.0000 0.0000 0.0198 -0.0006 0.0014 0.0002 0.0007 0.0001 0.0274 -0.0052 0.0024 -0.0005 0.0001 -0.0048 -0.0022 0.0007 0.0001 -0.0014 -0.0004 -0.0058 -0.0021 -0.0036 -0.0080 0.0005 -0.0030 0.0008 -0.0014 0.0001 111. (0.00559) BD*( 1) C 9- H 24 ( 38.47%) 0.6202* C 9 s( 24.02%)p 3.15( 75.78%)d 0.01( 0.14%) f 0.00( 0.03%)g 0.00( 0.02%) 0.0000 -0.4901 -0.0083 -0.0009 -0.0001 0.0000 0.0000 -0.4681 0.0100 0.0023 -0.0001 -0.7287 0.0028 0.0023 0.0000 -0.0872 -0.0085 -0.0009 -0.0004 -0.0213 -0.0049 -0.0004 -0.0058 -0.0001 -0.0006 -0.0194 0.0039 0.0000 0.0200 0.0000 0.0002 0.0112 0.0042 0.0003 0.0017 0.0012 0.0139 0.0008 -0.0043 0.0000 -0.0001 -0.0003 0.0009 -0.0018 0.0071 0.0005 0.0012 0.0014 -0.0046 0.0015 0.0031 0.0003 0.0070 0.0025 -0.0002 0.0060 0.0086 ( 61.53%) -0.7844* H 24 s( 99.86%)p 0.00( 0.12%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9993 0.0011 -0.0002 0.0000 -0.0177 0.0029 -0.0018 -0.0286 0.0023 -0.0024 -0.0074 -0.0024 -0.0004 -0.0075 -0.0025 -0.0007 -0.0004 -0.0008 -0.0004 0.0031 0.0010 0.0034 0.0016 -0.0014 -0.0038 -0.0044 -0.0004 0.0014 -0.0074 0.0009 112. (0.01587) BD*( 1) C 11- C 12 ( 50.14%) 0.7081* C 11 s( 31.65%)p 2.15( 68.13%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5626 -0.0028 -0.0003 0.0001 -0.0005 -0.0001 -0.6970 -0.0010 -0.0022 -0.0019 0.0284 0.0086 0.0075 -0.0015 -0.4390 0.0417 0.0036 -0.0015 0.0253 0.0014 -0.0011 -0.0046 -0.0108 -0.0021 0.0051 0.0029 -0.0001 -0.0243 -0.0101 0.0007 0.0116 0.0019 0.0000 0.0072 0.0010 -0.0025 0.0009 -0.0061 0.0002 -0.0100 -0.0018 0.0069 0.0006 -0.0095 -0.0010 0.0092 0.0001 0.0036 0.0089 -0.0006 -0.0048 0.0007 -0.0034 0.0019 -0.0007 0.0020 ( 49.86%) -0.7061* C 12 s( 33.59%)p 1.97( 66.20%)d 0.00( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5796 0.0023 -0.0006 0.0000 -0.0003 0.0000 0.7281 -0.0253 0.0024 0.0017 -0.2615 0.0152 0.0056 -0.0022 0.2482 0.0313 0.0038 0.0001 0.0010 0.0083 0.0006 -0.0286 -0.0061 0.0003 -0.0029 0.0046 -0.0001 -0.0205 -0.0079 0.0006 -0.0093 0.0047 0.0023 -0.0066 -0.0017 -0.0017 0.0001 -0.0001 0.0000 0.0133 0.0007 -0.0011 -0.0015 0.0075 0.0006 -0.0107 -0.0009 -0.0023 0.0096 -0.0020 -0.0010 -0.0015 -0.0031 0.0037 -0.0010 0.0025 113. (0.01934) BD*( 1) C 11- C 15 ( 49.99%) 0.7071* C 11 s( 32.03%)p 2.12( 67.75%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5659 -0.0039 -0.0011 0.0000 -0.0003 0.0000 -0.0511 -0.0322 -0.0030 -0.0001 -0.2180 0.0159 0.0081 -0.0020 0.7909 -0.0210 0.0019 0.0024 0.0065 -0.0017 -0.0008 0.0182 0.0022 -0.0011 -0.0131 0.0045 0.0011 -0.0107 -0.0004 0.0016 -0.0279 -0.0149 -0.0005 0.0183 0.0020 -0.0049 -0.0013 -0.0012 -0.0006 -0.0004 0.0000 -0.0043 0.0007 -0.0057 0.0007 -0.0029 -0.0005 -0.0095 0.0023 0.0018 0.0048 -0.0018 -0.0014 -0.0017 -0.0023 0.0021 ( 50.01%) -0.7071* C 15 s( 32.20%)p 2.10( 67.57%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5675 -0.0031 -0.0013 -0.0001 -0.0003 -0.0001 0.1429 -0.0366 -0.0022 0.0003 -0.2132 0.0156 0.0080 -0.0020 -0.7797 0.0125 -0.0019 -0.0024 0.0033 -0.0005 -0.0006 -0.0070 0.0042 0.0015 0.0148 -0.0046 -0.0012 -0.0074 -0.0009 0.0013 -0.0335 -0.0142 0.0000 -0.0179 -0.0024 0.0062 0.0001 0.0004 -0.0008 -0.0016 0.0005 0.0035 -0.0005 -0.0054 0.0006 -0.0039 -0.0003 -0.0076 0.0071 -0.0020 0.0034 0.0002 -0.0015 0.0026 -0.0022 0.0014 114. (0.01602) BD*( 1) C 11- H 25 ( 36.66%) 0.6054* C 11 s( 32.22%)p 2.10( 67.68%)d 0.00( 0.04%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 -0.5676 -0.0043 0.0011 -0.0002 0.0004 0.0001 0.7042 0.0097 0.0057 -0.0035 -0.1436 0.0016 0.0010 0.0012 -0.4001 -0.0046 -0.0032 0.0021 -0.0038 0.0038 -0.0004 0.0041 0.0103 0.0006 0.0037 -0.0016 -0.0004 -0.0093 -0.0099 0.0013 -0.0013 0.0018 0.0012 0.0082 0.0013 0.0029 0.0001 -0.0015 -0.0001 -0.0150 -0.0015 0.0084 0.0003 0.0095 0.0008 -0.0113 -0.0001 0.0026 -0.0073 0.0016 -0.0033 0.0018 0.0041 -0.0020 -0.0020 0.0012 ( 63.34%) -0.7959* H 25 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) -0.9994 0.0035 0.0007 -0.0001 0.0246 -0.0060 0.0001 -0.0066 -0.0010 0.0002 -0.0151 0.0023 -0.0001 0.0032 0.0009 0.0092 0.0023 -0.0019 -0.0005 -0.0065 -0.0021 0.0023 0.0004 -0.0037 -0.0008 0.0001 0.0062 -0.0019 -0.0046 0.0023 115. (0.02063) BD*( 1) C 12- C 13 ( 50.34%) 0.7095* C 12 s( 32.04%)p 2.11( 67.74%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5660 -0.0064 -0.0006 0.0001 -0.0004 0.0000 -0.6415 0.0413 0.0012 -0.0026 -0.0487 -0.0017 0.0065 -0.0009 0.5114 0.0112 0.0052 0.0012 0.0109 0.0010 -0.0008 0.0186 0.0135 0.0010 -0.0112 0.0015 0.0000 -0.0091 -0.0066 0.0000 -0.0277 -0.0013 0.0018 -0.0009 -0.0004 -0.0122 -0.0022 0.0023 -0.0001 0.0113 0.0009 -0.0093 0.0005 -0.0083 -0.0005 -0.0011 0.0002 0.0064 -0.0018 -0.0012 -0.0083 0.0039 0.0030 0.0008 0.0000 0.0005 ( 49.66%) -0.7047* C 13 s( 32.50%)p 2.07( 67.26%)d 0.01( 0.18%) f 0.00( 0.05%)g 0.00( 0.01%) 0.0000 -0.5701 -0.0051 -0.0014 -0.0001 -0.0003 0.0000 0.4116 0.0167 0.0049 0.0012 -0.2662 0.0024 0.0062 -0.0021 -0.6562 0.0374 0.0019 -0.0020 0.0053 0.0044 -0.0006 0.0256 0.0094 0.0006 0.0027 -0.0048 -0.0007 -0.0300 0.0000 0.0018 -0.0016 -0.0069 -0.0006 -0.0003 0.0008 0.0126 0.0013 -0.0080 -0.0002 -0.0131 -0.0014 0.0012 0.0014 0.0041 -0.0004 -0.0059 -0.0001 0.0063 0.0053 -0.0012 -0.0061 0.0055 -0.0002 0.0008 -0.0014 0.0005 116. (0.41812) BD*( 2) C 12- C 13 ( 49.25%) 0.7018* C 12 s( 2.03%)p47.97( 97.46%)d 0.20( 0.41%) f 0.04( 0.08%)g 0.01( 0.02%) 0.0000 -0.1355 0.0443 -0.0001 0.0004 0.0003 -0.0001 0.1781 0.0096 -0.0038 -0.0008 0.9563 0.0197 -0.0050 0.0009 0.1642 0.0302 -0.0039 0.0020 -0.0143 0.0098 0.0005 -0.0125 -0.0005 0.0008 -0.0561 -0.0030 0.0000 0.0215 -0.0010 0.0010 0.0065 -0.0035 0.0007 -0.0071 0.0002 0.0018 -0.0004 0.0252 0.0012 -0.0010 0.0009 0.0057 -0.0023 0.0074 0.0011 0.0078 0.0013 0.0036 0.0036 0.0065 0.0017 0.0062 -0.0033 -0.0048 -0.0032 0.0005 ( 50.75%) -0.7124* C 13 s( 2.15%)p45.38( 97.37%)d 0.18( 0.38%) f 0.04( 0.08%)g 0.01( 0.01%) 0.0000 -0.1373 0.0510 0.0003 0.0001 -0.0002 0.0000 0.3474 0.0329 -0.0035 0.0019 0.9221 0.0184 -0.0019 -0.0006 -0.0364 0.0060 -0.0029 -0.0021 -0.0571 0.0033 -0.0008 0.0014 0.0022 0.0010 -0.0020 0.0109 0.0003 -0.0042 -0.0056 0.0008 0.0193 -0.0037 0.0003 0.0023 0.0003 0.0039 0.0014 0.0038 0.0015 -0.0007 -0.0010 0.0024 -0.0016 0.0105 0.0014 0.0258 0.0000 0.0004 -0.0011 -0.0026 -0.0075 -0.0067 0.0023 0.0023 0.0044 0.0020 117. (0.01406) BD*( 1) C 12- H 26 ( 37.21%) 0.6100* C 12 s( 32.25%)p 2.10( 67.65%)d 0.00( 0.03%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 -0.5679 -0.0029 0.0010 -0.0002 0.0004 0.0001 -0.1472 -0.0055 0.0005 0.0009 0.0858 0.0051 0.0023 -0.0003 -0.8045 -0.0080 -0.0050 0.0043 0.0043 0.0003 -0.0008 -0.0014 -0.0040 -0.0005 0.0080 0.0025 -0.0003 -0.0024 -0.0007 0.0016 -0.0067 -0.0134 0.0003 -0.0212 -0.0019 -0.0100 -0.0009 0.0015 0.0008 -0.0044 0.0005 0.0027 -0.0001 -0.0013 0.0000 -0.0002 -0.0001 -0.0065 -0.0059 0.0030 0.0021 -0.0002 0.0013 -0.0011 -0.0011 0.0014 ( 62.79%) -0.7924* H 26 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) -0.9994 -0.0014 0.0016 0.0000 -0.0077 -0.0008 -0.0004 0.0022 -0.0014 0.0003 -0.0291 0.0053 -0.0009 0.0002 0.0002 -0.0041 -0.0009 0.0014 0.0004 0.0006 -0.0002 -0.0114 -0.0029 0.0077 0.0035 -0.0026 0.0005 -0.0009 0.0001 -0.0001 118. (0.01803) BD*( 1) C 13- C 14 ( 49.87%) 0.7062* C 13 s( 33.94%)p 1.94( 65.83%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5826 -0.0008 0.0009 0.0002 0.0004 0.0000 -0.2759 -0.0284 -0.0051 -0.0007 0.1622 -0.0055 -0.0056 0.0020 -0.7443 0.0310 0.0008 -0.0018 -0.0005 -0.0032 0.0008 0.0289 0.0053 -0.0003 0.0023 -0.0062 -0.0006 0.0235 -0.0013 -0.0019 0.0110 0.0105 0.0008 -0.0092 -0.0003 -0.0146 -0.0020 0.0072 0.0006 -0.0088 -0.0005 -0.0005 0.0012 -0.0021 0.0006 0.0031 -0.0003 0.0000 0.0101 -0.0032 0.0020 -0.0024 -0.0016 0.0026 0.0013 -0.0014 ( 50.13%) -0.7080* C 14 s( 31.74%)p 2.14( 68.04%)d 0.01( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 0.5633 0.0054 0.0005 -0.0001 0.0004 0.0000 0.5037 -0.0418 -0.0027 0.0022 0.0381 0.0008 -0.0061 0.0009 0.6507 0.0017 0.0046 0.0018 -0.0080 -0.0010 0.0007 0.0074 0.0126 0.0016 -0.0130 0.0012 0.0001 0.0057 0.0032 -0.0002 0.0331 0.0066 -0.0012 0.0072 0.0009 0.0139 0.0023 -0.0052 0.0002 0.0080 0.0002 -0.0071 0.0003 0.0055 0.0003 0.0033 -0.0003 -0.0044 0.0069 -0.0027 0.0074 -0.0021 -0.0008 0.0021 -0.0004 -0.0009 119. (0.01679) BD*( 1) C 13- H 27 ( 38.19%) 0.6179* C 13 s( 31.37%)p 2.18( 68.52%)d 0.00( 0.04%) f 0.00( 0.05%)g 0.00( 0.01%) 0.0000 -0.5601 -0.0046 0.0020 0.0002 0.0005 0.0000 -0.7939 -0.0061 -0.0039 0.0036 0.2128 0.0101 0.0023 -0.0007 -0.0977 -0.0001 -0.0006 0.0005 0.0144 0.0045 -0.0005 -0.0003 -0.0032 -0.0001 0.0016 0.0006 0.0000 -0.0027 -0.0117 0.0010 0.0007 0.0071 0.0011 0.0032 0.0004 0.0105 0.0015 -0.0030 -0.0005 -0.0045 -0.0005 0.0021 0.0002 -0.0159 -0.0010 0.0111 0.0008 -0.0063 0.0039 -0.0008 0.0042 -0.0026 -0.0014 0.0013 -0.0018 0.0036 ( 61.81%) -0.7862* H 27 s( 99.88%)p 0.00( 0.10%)d 0.00( 0.01%) f 0.00( 0.01%) -0.9994 -0.0027 -0.0006 -0.0001 -0.0295 0.0047 -0.0011 0.0096 0.0015 0.0005 -0.0036 0.0008 -0.0001 0.0045 0.0012 -0.0024 -0.0006 0.0006 0.0001 -0.0082 -0.0024 0.0068 0.0013 -0.0014 -0.0044 0.0013 0.0017 -0.0010 0.0047 -0.0051 120. (0.01837) BD*( 1) C 14- C 15 ( 49.67%) 0.7048* C 14 s( 32.02%)p 2.12( 67.77%)d 0.00( 0.16%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5658 -0.0032 -0.0006 -0.0001 -0.0002 0.0000 0.7360 -0.0195 0.0036 0.0020 -0.3616 0.0131 0.0064 -0.0022 -0.0597 -0.0333 -0.0036 0.0005 0.0037 0.0088 0.0004 0.0232 0.0016 -0.0010 -0.0020 -0.0029 0.0003 -0.0286 -0.0084 0.0007 0.0006 0.0070 0.0019 0.0027 0.0015 -0.0090 -0.0010 -0.0025 0.0003 -0.0088 -0.0003 -0.0008 0.0009 0.0095 0.0006 -0.0120 -0.0014 -0.0080 -0.0040 0.0009 0.0035 -0.0045 0.0016 -0.0016 -0.0014 0.0036 ( 50.33%) -0.7094* C 15 s( 31.90%)p 2.13( 67.87%)d 0.01( 0.17%) f 0.00( 0.04%)g 0.00( 0.01%) 0.0000 -0.5648 -0.0034 -0.0005 0.0000 -0.0004 -0.0001 -0.7801 0.0097 -0.0010 -0.0022 0.0268 0.0078 0.0073 -0.0014 0.2600 -0.0411 -0.0038 0.0009 0.0266 0.0021 -0.0011 -0.0062 0.0067 0.0019 0.0010 -0.0026 -0.0002 -0.0244 -0.0120 0.0002 0.0109 0.0055 0.0009 -0.0065 -0.0002 0.0050 0.0018 -0.0076 0.0000 0.0064 0.0009 -0.0014 -0.0005 -0.0120 -0.0014 0.0107 0.0002 -0.0041 -0.0095 0.0007 0.0021 -0.0004 0.0036 -0.0012 -0.0019 0.0028 121. (0.01429) BD*( 1) C 14- H 29 ( 37.41%) 0.6117* C 14 s( 32.04%)p 2.12( 67.86%)d 0.00( 0.03%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 -0.5660 -0.0038 0.0008 -0.0001 0.0003 0.0001 -0.3383 -0.0066 -0.0008 0.0017 0.0744 0.0056 0.0023 -0.0001 0.7473 0.0058 0.0058 -0.0040 0.0060 0.0009 -0.0009 0.0031 0.0088 0.0007 -0.0071 -0.0023 0.0001 -0.0030 -0.0021 0.0014 -0.0055 -0.0109 0.0007 0.0124 0.0011 -0.0179 -0.0018 0.0004 0.0006 0.0089 0.0001 -0.0031 -0.0002 -0.0034 0.0001 0.0004 -0.0002 -0.0006 0.0085 -0.0025 -0.0027 0.0016 -0.0015 0.0011 -0.0004 0.0009 ( 62.59%) -0.7911* H 29 s( 99.88%)p 0.00( 0.09%)d 0.00( 0.02%) f 0.00( 0.01%) -0.9994 0.0009 0.0020 -0.0001 -0.0146 0.0005 -0.0007 0.0034 -0.0004 0.0005 0.0261 -0.0058 0.0009 0.0005 0.0003 0.0083 0.0020 -0.0015 -0.0003 -0.0008 -0.0006 -0.0087 -0.0025 -0.0045 0.0065 -0.0020 -0.0024 0.0017 0.0005 -0.0005 122. (0.01554) BD*( 1) C 15- H 28 ( 36.83%) 0.6068* C 15 s( 31.93%)p 2.13( 67.97%)d 0.00( 0.04%) f 0.00( 0.06%)g 0.00( 0.01%) 0.0000 -0.5650 -0.0043 0.0014 0.0000 0.0004 0.0001 0.5901 0.0083 0.0043 -0.0029 -0.1414 0.0014 0.0011 0.0010 0.5579 0.0071 0.0039 -0.0029 -0.0035 0.0033 -0.0005 -0.0054 -0.0121 -0.0007 -0.0052 0.0025 0.0003 -0.0088 -0.0070 0.0014 -0.0034 -0.0030 0.0009 -0.0032 -0.0009 0.0120 0.0013 -0.0049 -0.0002 0.0138 0.0014 -0.0101 -0.0002 0.0052 0.0004 -0.0081 0.0000 0.0061 0.0009 -0.0003 -0.0072 0.0030 -0.0022 0.0010 -0.0009 0.0006 ( 63.17%) -0.7948* H 28 s( 99.88%)p 0.00( 0.10%)d 0.00( 0.02%) f 0.00( 0.01%) -0.9994 0.0031 0.0006 -0.0001 0.0215 -0.0047 0.0001 -0.0053 -0.0002 0.0001 0.0210 -0.0035 0.0001 0.0022 0.0008 -0.0107 -0.0026 0.0025 0.0006 -0.0039 -0.0015 -0.0017 -0.0007 0.0019 -0.0050 0.0008 -0.0061 0.0022 -0.0028 0.0016 123. (0.14427) 3C*( 1) C 11- C 14- C 15 ( 28.72%) 0.5359* C 11 s( 4.01%)p23.76( 95.30%)d 0.14( 0.58%) f 0.03( 0.10%)g 0.00( 0.01%) 0.0000 -0.1952 0.0448 -0.0024 0.0004 0.0003 0.0000 0.1146 -0.0160 0.0035 -0.0003 0.9598 0.0209 -0.0008 0.0005 0.1321 0.0214 0.0033 0.0036 0.0406 -0.0021 -0.0008 -0.0026 -0.0034 0.0001 -0.0396 -0.0163 -0.0015 0.0455 -0.0093 0.0011 0.0084 -0.0022 -0.0010 0.0038 0.0014 0.0028 0.0002 0.0074 0.0038 -0.0158 0.0006 -0.0107 -0.0002 0.0207 -0.0008 0.0119 0.0011 -0.0034 -0.0001 -0.0057 0.0005 0.0006 0.0032 0.0086 -0.0007 -0.0008 ( 22.16%) -0.4707* C 14 s( 4.13%)p23.05( 95.22%)d 0.13( 0.54%) f 0.02( 0.10%)g 0.00( 0.01%) 0.0000 0.1979 -0.0460 0.0026 -0.0005 0.0000 0.0000 -0.2928 -0.0258 -0.0032 -0.0030 -0.9238 -0.0119 0.0008 0.0008 0.1083 0.0201 -0.0049 0.0009 0.0377 0.0107 0.0013 -0.0163 0.0014 -0.0011 -0.0555 0.0062 -0.0005 -0.0050 0.0119 0.0009 -0.0160 0.0071 -0.0019 -0.0066 0.0004 0.0048 0.0003 -0.0235 0.0003 0.0011 0.0015 0.0147 0.0000 -0.0040 -0.0036 -0.0094 -0.0025 0.0006 0.0033 0.0018 -0.0045 -0.0084 -0.0005 -0.0017 0.0030 -0.0008 ( 49.12%) 0.7008* C 15 s( 3.87%)p24.71( 95.56%)d 0.12( 0.47%) f 0.02( 0.09%)g 0.00( 0.01%) 0.0000 0.1917 -0.0438 0.0002 -0.0006 0.0000 0.0000 -0.1402 0.0148 0.0005 0.0010 -0.9618 -0.0308 0.0034 -0.0008 0.0971 0.0183 -0.0022 0.0016 -0.0283 -0.0032 0.0002 -0.0064 0.0005 -0.0005 -0.0425 -0.0020 -0.0001 -0.0422 0.0040 -0.0006 -0.0143 0.0037 -0.0005 0.0011 0.0011 -0.0095 -0.0005 -0.0114 -0.0015 -0.0150 0.0008 -0.0073 0.0010 -0.0160 -0.0003 -0.0093 -0.0022 0.0024 -0.0018 -0.0053 0.0020 0.0066 0.0031 0.0070 -0.0005 -0.0019 124. (0.01741) RY ( 1)Co 1 s( 18.40%)p 2.74( 50.39%)d 1.61( 29.64%) f 0.09( 1.57%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 0.0085 0.4253 0.0537 0.0090 -0.0012 -0.0002 -0.0001 0.0000 0.0000 0.0000 0.6814 -0.1375 -0.0805 0.0494 0.0000 0.0000 0.0781 0.0092 -0.0576 -0.0475 0.0000 0.0000 0.0028 0.0020 0.0014 -0.0028 0.0168 -0.2999 0.0300 -0.0002 -0.0004 0.0011 0.0022 -0.0066 -0.0009 -0.0011 -0.0017 -0.0058 -0.0035 0.0012 0.0012 0.0079 -0.1996 0.3183 0.0027 0.0023 0.0333 0.2399 -0.0701 -0.0194 0.0013 -0.0008 0.0018 0.0000 0.0000 0.0630 -0.0137 -0.0012 -0.0002 -0.0716 0.0179 0.0013 -0.0005 0.0016 -0.0007 0.0006 0.0001 -0.0062 0.0008 0.0006 0.0000 0.0654 -0.0261 -0.0020 0.0011 0.0266 -0.0170 0.0071 -0.0003 0.0012 0.0001 -0.0002 0.0000 -0.0001 0.0000 0.0035 -0.0004 0.0011 -0.0003 0.0002 -0.0001 -0.0003 0.0000 0.0020 -0.0005 0.0027 -0.0006 125. (0.00757) RY ( 2)Co 1 s( 0.03%)p99.99( 26.31%)d99.99( 65.99%) f99.99( 7.67%)g 0.20( 0.01%) 0.0000 0.0000 0.0000 -0.0039 0.0153 -0.0030 0.0001 0.0001 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0198 0.0043 0.0006 -0.0010 0.0000 0.0000 0.0170 0.0060 -0.0036 -0.0038 0.0000 0.0000 -0.4773 -0.1845 -0.0099 -0.0186 0.0002 -0.0240 0.0113 0.0017 -0.0003 -0.0157 0.4701 -0.5282 -0.0085 0.0032 -0.0347 0.3059 0.2483 0.0293 -0.0036 -0.0008 0.0221 0.0238 -0.0023 0.0006 -0.0035 -0.0054 0.0222 0.0013 -0.0008 0.1152 -0.0061 0.0112 -0.0007 -0.0181 -0.0045 0.0001 0.0001 0.0021 0.0006 -0.0013 0.0004 -0.2442 0.0457 -0.0027 -0.0013 -0.0249 -0.0125 -0.0173 0.0016 -0.0071 0.0006 -0.0007 -0.0001 0.0051 -0.0035 0.0010 0.0000 -0.0004 0.0002 0.0004 0.0004 0.0005 0.0012 -0.0002 0.0001 -0.0001 -0.0001 -0.0056 0.0010 -0.0041 0.0010 -0.0003 0.0001 0.0003 0.0000 126. (0.00535) RY ( 3)Co 1 s( 0.65%)p41.45( 26.79%)d99.99( 70.02%) f 3.92( 2.53%)g 0.02( 0.01%) 0.0000 0.0000 0.0000 -0.0115 0.0625 -0.0491 0.0028 0.0014 0.0001 0.0001 0.0000 0.0000 0.0000 -0.0155 -0.0535 -0.0104 -0.0225 0.0000 0.0000 0.0271 -0.0254 0.0003 -0.0051 0.0000 0.0000 0.3572 0.3430 0.0531 0.1216 -0.0057 0.0210 0.0059 0.0093 -0.0004 0.0290 0.4113 -0.3790 -0.0333 0.0028 0.0322 -0.6101 0.0258 -0.0519 0.0324 0.0002 0.0637 0.0110 -0.0094 -0.0012 -0.0041 -0.0515 0.0133 -0.0055 0.0040 0.1040 -0.0088 -0.0179 0.0020 -0.0328 -0.0038 0.0004 0.0000 -0.0013 0.0026 0.0010 0.0000 -0.0324 0.0107 -0.0290 0.0017 -0.0969 0.0358 0.0126 -0.0012 -0.0111 -0.0007 0.0050 -0.0004 0.0018 -0.0012 -0.0001 0.0002 0.0009 -0.0002 0.0033 -0.0009 0.0070 -0.0021 0.0000 -0.0002 -0.0004 0.0002 0.0064 -0.0015 0.0016 -0.0015 -0.0003 0.0002 -0.0002 0.0001 127. (0.00483) RY ( 4)Co 1 s( 38.31%)p 0.78( 29.99%)d 0.71( 27.10%) f 0.12( 4.59%)g 0.00( 0.01%) 0.0000 0.0000 0.0000 -0.0541 0.5707 -0.2332 -0.0003 0.0066 0.0007 0.0006 0.0000 0.0000 0.0000 -0.2118 -0.3787 -0.1044 -0.1445 0.0000 0.0000 0.2459 -0.1231 -0.0068 -0.0262 0.0000 0.0000 -0.0279 -0.0491 -0.0087 -0.0165 -0.0362 0.2578 0.0196 0.0655 -0.0105 -0.0055 -0.0594 0.0736 0.0080 -0.0020 -0.0021 0.0712 0.0111 0.0088 -0.0069 -0.0056 0.3487 0.1368 -0.0280 -0.0089 -0.0322 -0.1874 -0.0764 -0.0280 0.0142 -0.0192 0.0027 0.0011 -0.0003 -0.1633 -0.0179 0.0020 0.0004 -0.0308 -0.0045 -0.0091 0.0018 0.0091 -0.0040 0.0037 -0.0002 0.0328 -0.0043 -0.0028 0.0003 -0.1050 0.0109 0.0268 -0.0032 0.0631 -0.0096 -0.0172 0.0026 -0.0060 0.0004 0.0007 0.0001 -0.0011 0.0003 0.0018 0.0006 0.0005 0.0007 -0.0013 0.0003 0.0000 0.0002 -0.0062 0.0024 -0.0026 0.0012 128. (0.00446) RY ( 5)Co 1 s( 7.70%)p 1.35( 10.41%)d10.51( 80.88%) f 0.13( 1.01%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 -0.0140 0.1083 0.2545 -0.0167 -0.0016 -0.0001 -0.0001 0.0000 0.0000 0.0000 -0.0002 -0.1641 -0.0084 0.0409 0.0000 0.0000 -0.1264 -0.2278 -0.0186 0.0819 0.0000 0.0000 0.0056 0.0122 -0.0059 0.0163 0.0097 0.2807 0.3970 -0.0136 0.0009 0.0014 0.0079 -0.0195 0.0004 0.0006 0.0026 0.0077 0.0698 -0.0063 0.0007 -0.0073 -0.5016 -0.2388 0.0532 -0.0122 -0.0151 -0.2280 -0.4496 -0.0136 -0.0236 0.0113 0.0032 -0.0022 0.0000 0.0470 0.0288 -0.0020 0.0000 0.0022 -0.0127 -0.0036 -0.0012 -0.0083 0.0012 -0.0018 -0.0003 -0.0055 0.0005 0.0012 -0.0001 -0.0318 0.0238 -0.0043 -0.0017 0.0561 -0.0426 0.0045 0.0000 -0.0028 0.0001 0.0000 0.0000 0.0006 0.0000 -0.0013 0.0002 -0.0004 0.0005 -0.0005 0.0000 0.0002 0.0000 -0.0024 0.0002 -0.0040 0.0008 129. (0.00239) RY ( 6)Co 1 s( 6.45%)p 6.72( 43.35%)d 6.97( 44.95%) f 0.81( 5.25%)g 0.00( 0.01%) 0.0000 0.0000 0.0000 0.0292 -0.0948 0.2329 -0.0184 -0.0061 -0.0018 0.0007 0.0000 0.0000 0.0000 -0.1572 -0.2116 -0.0022 -0.0384 0.0000 0.0000 -0.2254 0.5266 -0.1383 0.0863 0.0000 0.0000 -0.0503 0.0689 -0.0189 0.0161 -0.0214 0.3039 0.0469 -0.0242 -0.0143 0.0015 -0.0136 -0.0023 -0.0022 -0.0039 0.0038 -0.0310 -0.0164 -0.0168 0.0019 -0.0098 -0.0786 0.5723 0.1074 -0.0123 -0.0101 0.0499 0.0254 0.0544 0.0163 -0.0021 0.0046 -0.0051 0.0000 0.1201 0.0105 0.0090 -0.0014 -0.0699 -0.0057 -0.0139 -0.0012 -0.0225 0.0009 -0.0049 0.0001 0.0164 -0.0012 0.0007 0.0006 -0.1717 0.0324 0.0254 -0.0026 -0.0001 0.0211 -0.0157 0.0027 -0.0030 0.0004 0.0000 0.0000 0.0004 -0.0002 -0.0005 0.0005 -0.0053 0.0004 -0.0009 0.0001 -0.0003 -0.0002 -0.0030 0.0023 -0.0040 0.0021 130. (0.00204) RY ( 7)Co 1 s( 10.26%)p 2.74( 28.09%)d 5.43( 55.72%) f 0.58( 5.92%)g 0.00( 0.01%) 0.0000 0.0000 0.0000 -0.0050 0.3192 -0.0036 -0.0260 -0.0054 -0.0006 0.0002 0.0000 0.0000 0.0000 -0.3430 0.2345 -0.2941 -0.0591 0.0000 0.0000 0.0133 -0.0298 -0.1028 0.0142 0.0000 0.0000 0.0651 -0.0471 0.0019 -0.0030 0.0001 0.0881 -0.3131 0.0042 -0.0076 -0.0030 0.0281 0.0061 -0.0015 -0.0062 -0.0022 -0.0127 0.0474 0.0098 0.0009 -0.0096 -0.5157 -0.0766 0.0278 -0.0168 0.0192 0.3427 0.2322 0.0493 0.0301 -0.0131 0.0021 0.0005 0.0004 -0.1743 -0.0486 0.0004 0.0000 -0.1082 -0.0367 -0.0015 0.0014 -0.0164 0.0043 -0.0002 0.0003 -0.0012 0.0011 -0.0024 0.0000 -0.0514 0.0169 0.0015 0.0001 0.0999 0.0034 -0.0012 -0.0014 0.0058 -0.0002 0.0002 0.0000 -0.0009 0.0001 -0.0025 0.0007 -0.0012 -0.0004 -0.0005 0.0001 0.0012 -0.0001 -0.0036 -0.0001 -0.0059 0.0005 131. (0.00184) RY ( 8)Co 1 s( 0.26%)p99.99( 76.92%)d81.27( 21.22%) f 6.06( 1.58%)g 0.05( 0.01%) 0.0000 0.0000 0.0000 0.0018 -0.0320 0.0393 0.0062 0.0019 -0.0001 -0.0001 0.0000 0.0000 0.0000 0.0144 -0.0185 0.0017 0.0021 0.0000 0.0000 -0.0396 0.0629 -0.0180 0.0122 0.0000 0.0000 0.6149 -0.5596 0.2138 -0.1604 0.0000 0.0159 0.0358 -0.0117 -0.0025 -0.0161 0.3462 0.0808 0.0061 0.0084 -0.0342 0.2123 -0.0902 0.1509 -0.0034 -0.0017 0.0407 0.0512 0.0083 0.0019 -0.0050 -0.0197 -0.0422 0.0082 -0.0035 0.0654 0.0193 0.0290 0.0006 -0.0128 0.0006 0.0004 -0.0005 0.0150 0.0022 -0.0032 -0.0002 -0.0477 -0.0232 0.0339 0.0005 -0.0671 -0.0196 -0.0309 -0.0022 -0.0018 0.0013 -0.0013 -0.0005 -0.0101 0.0042 -0.0008 0.0004 -0.0011 0.0004 0.0056 0.0011 0.0026 0.0016 0.0008 0.0000 -0.0013 -0.0001 0.0058 0.0006 0.0066 0.0002 0.0002 0.0002 -0.0001 0.0001 132. (0.00168) RY ( 9)Co 1 s( 3.60%)p 3.61( 12.97%)d21.76( 78.23%) f 1.45( 5.20%)g 0.00( 0.01%) 0.0000 0.0000 0.0000 0.0173 -0.1220 0.1413 0.0279 0.0038 0.0005 -0.0001 -0.0001 0.0000 0.0000 0.2642 -0.0367 -0.0947 -0.1221 0.0000 0.0000 0.1440 0.0510 -0.0728 0.0737 0.0000 0.0000 -0.0149 0.0100 0.0122 0.0116 -0.0343 0.5060 -0.1601 0.0118 0.0112 -0.0016 0.0175 -0.0190 0.0027 -0.0006 0.0000 -0.0027 0.0497 -0.0157 -0.0025 -0.0249 0.2586 -0.2627 0.0337 -0.0078 0.0045 0.5333 -0.2675 0.0405 0.0199 0.0071 0.0018 -0.0047 0.0001 -0.0705 0.0064 0.0070 -0.0007 0.0718 -0.0717 -0.0080 -0.0008 0.0239 -0.0102 0.0033 -0.0003 -0.0016 0.0041 -0.0012 -0.0003 0.1097 0.0032 0.0364 0.0012 -0.1279 0.0756 -0.0193 -0.0023 0.0051 -0.0001 0.0006 -0.0001 0.0007 0.0000 0.0009 0.0011 -0.0012 0.0001 -0.0011 0.0001 -0.0012 -0.0001 0.0004 -0.0005 0.0047 0.0007 133. (0.00154) RY (10)Co 1 s( 1.29%)p32.52( 41.87%)d36.98( 47.61%) f 7.17( 9.23%)g 0.00( 0.00%) 0.0000 0.0000 0.0000 -0.0034 0.0984 -0.0148 -0.0523 -0.0145 -0.0017 0.0001 0.0000 0.0000 0.0000 0.3500 -0.1701 0.1327 -0.1684 0.0000 0.0000 -0.4111 0.0777 -0.1879 0.0995 0.0000 0.0000 0.0014 -0.0173 -0.0269 0.0022 0.0034 0.1984 -0.1085 0.0595 0.0021 -0.0020 -0.0025 -0.0089 -0.0022 -0.0013 0.0009 0.0247 0.0223 0.0029 0.0008 -0.0121 -0.0007 -0.3185 0.0925 -0.0097 -0.0128 -0.2794 0.4812 0.0124 0.0022 -0.0509 0.0025 0.0009 -0.0003 -0.1874 -0.0108 0.0048 0.0018 -0.2052 0.0189 -0.0047 -0.0004 0.0110 0.0124 -0.0013 -0.0003 0.0052 -0.0046 -0.0017 0.0000 0.0897 0.0118 0.0156 0.0007 -0.0498 0.0030 -0.0265 -0.0007 -0.0054 0.0001 -0.0002 -0.0001 -0.0015 0.0001 0.0004 -0.0002 -0.0013 0.0003 -0.0005 0.0003 0.0010 0.0001 0.0027 0.0010 0.0016 -0.0003 134. (0.00142) RY (11)Co 1 s( 0.17%)p65.27( 11.14%)d99.99( 75.82%) f75.39( 12.87%)g 0.01( 0.00%) 0.0000 0.0000 0.0000 -0.0028 0.0405 0.0026 -0.0070 -0.0013 0.0001 0.0001 0.0000 0.0000 0.0000 -0.0033 0.0038 -0.0349 -0.0202 0.0000 0.0000 -0.0272 -0.0285 -0.0243 0.0166 0.0000 0.0000 -0.2138 0.1151 0.0332 -0.2173 -0.0012 0.0290 0.0129 0.0095 -0.0058 0.0129 0.1383 0.0244 0.0248 0.0461 -0.0017 -0.0149 -0.8512 0.0581 0.0124 -0.0020 -0.0203 -0.0681 0.0037 -0.0028 -0.0006 0.0240 -0.0226 0.0086 0.0007 0.2741 -0.0308 0.0130 0.0010 -0.0174 0.0039 -0.0023 0.0002 -0.0506 -0.0041 -0.0017 0.0002 -0.2106 -0.0387 0.0022 0.0020 0.0523 -0.0167 -0.0181 0.0038 -0.0054 -0.0040 0.0024 -0.0003 -0.0150 0.0036 -0.0046 -0.0002 -0.0007 0.0000 -0.0010 0.0006 0.0000 -0.0008 -0.0001 0.0001 -0.0002 0.0000 0.0027 -0.0001 0.0030 -0.0006 0.0000 0.0000 -0.0013 0.0001 135. (0.00109) RY (12)Co 1 s( 4.35%)p 8.77( 38.15%)d10.74( 46.75%) f 2.47( 10.73%)g 0.00( 0.02%) 0.0000 0.0000 0.0000 -0.0082 0.1607 0.0818 -0.1016 0.0246 -0.0033 -0.0008 -0.0001 0.0000 0.0000 0.0395 0.3525 -0.3347 0.0752 0.0000 0.0000 -0.2928 0.0615 -0.2138 -0.0435 0.0000 0.0000 -0.0040 0.0215 -0.0175 0.0102 0.0261 -0.0681 -0.3365 -0.1085 0.0259 0.0011 -0.0272 -0.0515 -0.0049 -0.0019 0.0020 0.0154 0.0036 -0.0087 0.0012 0.0074 0.1842 0.0471 -0.0216 0.0292 -0.0093 -0.3383 -0.4161 0.0864 0.0036 -0.0376 0.0069 -0.0001 0.0002 -0.0441 0.0019 -0.0151 0.0029 -0.0294 0.0410 0.0022 0.0041 0.0264 -0.0136 0.0036 0.0002 0.0075 0.0064 0.0038 -0.0002 -0.0382 -0.0694 -0.0344 -0.0006 -0.3037 -0.0114 0.0161 -0.0034 0.0085 -0.0012 -0.0011 0.0000 0.0000 0.0000 0.0035 -0.0011 0.0024 -0.0017 0.0004 -0.0004 -0.0022 0.0001 0.0018 -0.0015 0.0072 -0.0031 136. (0.00083) RY (13)Co 1 s( 22.21%)p 1.74( 38.59%)d 1.29( 28.64%) f 0.47( 10.52%)g 0.00( 0.04%) 0.0000 0.0000 0.0000 0.0186 0.1475 0.4459 0.0332 -0.0043 -0.0021 -0.0004 0.0000 0.0000 0.0000 -0.0301 0.1705 -0.2044 0.1929 0.0000 0.0000 0.4328 0.2197 -0.0261 0.1480 0.0000 0.0000 0.0703 0.0937 -0.0709 -0.0060 -0.0050 -0.0022 0.3306 -0.1333 -0.0101 -0.0014 -0.0170 -0.0884 -0.0002 0.0032 -0.0004 0.1045 -0.0570 0.0280 0.0162 0.0090 0.1183 -0.1196 -0.0011 -0.0298 -0.0069 -0.1381 0.2897 0.0531 -0.0271 -0.0844 0.0331 0.0034 0.0007 -0.0845 0.0649 0.0064 -0.0030 -0.0714 0.1396 0.0025 -0.0013 0.0773 0.0301 0.0031 0.0015 0.0042 -0.0380 0.0006 0.0001 0.1511 0.0135 -0.0296 -0.0008 -0.1559 0.0650 0.0136 0.0007 -0.0040 -0.0008 -0.0047 0.0004 -0.0009 -0.0003 -0.0146 -0.0009 -0.0101 0.0008 0.0001 0.0001 0.0014 -0.0002 -0.0025 -0.0003 0.0041 -0.0011 137. (0.00070) RY (14)Co 1 s( 0.59%)p55.12( 32.29%)d88.07( 51.59%) f26.47( 15.51%)g 0.05( 0.03%) 0.0000 0.0000 0.0000 0.0062 0.0311 0.0696 -0.0004 0.0006 -0.0012 -0.0002 0.0000 0.0000 0.0000 0.0244 0.0603 -0.0735 0.0425 0.0000 0.0000 0.0860 0.0954 -0.0014 0.0571 0.0000 0.0000 -0.3343 -0.3455 0.2439 0.0330 0.0000 -0.0121 0.0661 -0.0305 0.0023 0.0081 0.0984 0.4516 -0.0406 0.0074 0.0053 -0.4784 0.1851 -0.1255 -0.0678 0.0030 0.0251 -0.0422 0.0247 -0.0083 -0.0019 -0.0793 0.0417 0.0183 -0.0119 0.2364 -0.1638 -0.0068 -0.0052 -0.0475 0.0425 -0.0012 -0.0005 -0.0301 0.0511 0.0015 0.0005 -0.1772 -0.0198 -0.0359 -0.0057 -0.1179 0.1131 0.0034 -0.0006 0.0249 0.0104 -0.0083 -0.0001 -0.0608 0.0192 0.0026 0.0003 -0.0012 -0.0001 0.0145 -0.0018 -0.0021 0.0020 -0.0036 0.0003 -0.0014 0.0000 0.0024 0.0005 0.0046 0.0011 0.0006 0.0000 0.0011 -0.0003 138. (0.00058) RY (15)Co 1 s( 30.58%)p 0.90( 27.57%)d 0.39( 11.78%) f 0.98( 29.99%)g 0.00( 0.08%) 0.0000 0.0000 0.0000 -0.0127 -0.0376 0.5502 0.0328 0.0204 0.0051 0.0019 0.0000 0.0000 0.0000 -0.0961 -0.2453 -0.1899 -0.0584 0.0000 0.0000 -0.1155 -0.2047 -0.0317 -0.2689 0.0000 0.0000 -0.0540 -0.1194 -0.1077 -0.0973 0.0006 -0.0844 -0.1857 0.0771 -0.0330 0.0008 -0.0246 -0.0273 0.0049 0.0005 0.0040 -0.1437 -0.0400 0.0454 -0.0090 -0.0011 0.1414 0.0105 -0.0788 0.0044 -0.0074 -0.0350 0.1159 -0.0283 0.0392 -0.1474 0.0156 0.0095 -0.0010 0.1060 -0.1220 0.0031 0.0006 0.2047 -0.0908 0.0233 -0.0022 -0.0540 -0.0281 0.0101 -0.0001 -0.0913 0.0226 -0.0087 0.0023 0.2270 -0.1881 0.0293 -0.0001 0.2837 -0.1401 0.0203 -0.0014 0.0069 -0.0013 0.0010 0.0002 -0.0080 0.0011 0.0207 -0.0019 0.0003 0.0023 0.0014 -0.0002 -0.0007 0.0007 0.0087 -0.0019 -0.0129 0.0010 139. (0.00053) RY (16)Co 1 s( 2.72%)p14.56( 39.55%)d 8.64( 23.46%) f12.60( 34.23%)g 0.02( 0.05%) 0.0000 0.0000 0.0000 -0.0051 0.0132 0.1632 -0.0135 0.0127 0.0006 0.0006 0.0000 0.0000 0.0000 -0.0863 -0.1268 -0.1195 -0.0201 0.0000 0.0000 -0.1040 -0.0182 -0.0454 -0.0929 0.0000 0.0000 0.0455 0.2878 0.4192 0.2734 -0.0012 -0.1397 -0.0055 0.0421 -0.0226 -0.0013 0.1148 0.1401 -0.0451 -0.0069 -0.0102 0.3317 0.0801 -0.1827 0.0113 0.0033 0.1088 -0.1039 0.0073 -0.0034 -0.0021 0.0633 0.0284 -0.0042 0.0183 0.4328 -0.1394 -0.0208 0.0008 0.1111 -0.0565 0.0097 0.0007 -0.1328 0.0039 0.0035 -0.0002 0.2555 0.0252 -0.0271 -0.0013 0.1282 -0.0253 0.0340 -0.0077 0.0089 -0.0644 0.0057 -0.0008 0.0990 -0.0532 0.0012 -0.0004 0.0022 -0.0004 0.0031 -0.0006 0.0173 -0.0027 0.0069 -0.0008 -0.0008 0.0004 0.0004 0.0003 -0.0071 -0.0005 0.0028 -0.0004 -0.0055 0.0004 140. (0.00036) RY (17)Co 1 s( 3.12%)p 6.20( 19.32%)d12.61( 39.30%) f12.27( 38.25%)g 0.01( 0.02%) 0.0000 0.0000 0.0000 0.0076 0.1178 0.1136 -0.0586 0.0295 -0.0033 0.0000 -0.0002 0.0000 0.0000 -0.1013 -0.1339 0.1467 -0.0037 0.0000 0.0000 0.0934 0.3281 0.1254 0.0240 0.0000 0.0000 0.0275 -0.0155 -0.0756 -0.0641 -0.0037 -0.2442 -0.2236 0.0912 0.0439 -0.0007 -0.0326 -0.0234 0.0251 0.0071 -0.0004 -0.0429 0.0181 0.0655 0.0064 0.0180 0.0872 -0.3654 0.2341 -0.0069 0.0028 0.0478 -0.2322 -0.1008 -0.0402 -0.1072 0.0466 0.0074 0.0012 0.2576 0.0552 0.0244 0.0006 -0.4151 0.1578 -0.0265 0.0022 -0.1376 0.0346 0.0036 0.0015 -0.0978 0.0209 -0.0073 0.0008 -0.1714 0.0601 -0.0002 -0.0017 0.1905 -0.0358 -0.0091 -0.0025 -0.0093 -0.0006 0.0007 -0.0003 -0.0008 0.0003 -0.0009 -0.0006 0.0004 -0.0013 0.0013 -0.0009 0.0019 0.0008 -0.0026 0.0018 0.0095 -0.0016 141. (0.00027) RY (18)Co 1 s( 2.70%)p 5.67( 15.31%)d 9.68( 26.15%) f20.66( 55.82%)g 0.01( 0.02%) 0.0000 0.0000 0.0000 0.0004 0.0560 0.1537 0.0124 0.0091 0.0013 0.0003 -0.0001 0.0000 0.0000 0.0571 0.0302 0.2389 0.0913 0.0000 0.0000 0.1513 0.0669 0.1638 -0.0435 0.0000 0.0000 -0.0786 -0.0569 -0.1091 -0.0782 0.0038 0.1042 -0.3137 0.0652 0.0438 0.0124 0.2576 0.1061 -0.0070 0.0079 -0.0035 -0.1109 0.0308 0.0146 0.0014 0.0017 -0.1158 0.0265 -0.0192 0.0300 -0.0019 -0.1558 -0.0203 -0.1114 -0.0474 0.0916 0.1570 -0.0460 -0.0025 -0.0252 0.0268 0.0048 -0.0015 0.1361 0.0810 -0.0061 0.0017 0.3173 -0.1299 -0.0161 -0.0047 0.5688 -0.2201 -0.0290 0.0016 -0.0093 0.0673 -0.0103 0.0008 0.0191 -0.0165 0.0235 -0.0028 -0.0035 -0.0005 -0.0048 0.0016 -0.0062 0.0038 -0.0045 -0.0004 0.0054 -0.0023 -0.0036 0.0040 0.0018 -0.0038 0.0003 -0.0006 0.0062 -0.0014 142. (0.00024) RY (19)Co 1 s( 3.58%)p 6.51( 23.30%)d 9.59( 34.35%) f10.82( 38.72%)g 0.01( 0.04%) 0.0000 0.0000 0.0000 0.0042 0.1187 0.1440 0.0306 0.0047 0.0026 0.0008 -0.0002 0.0000 0.0000 0.1229 0.1428 0.2388 0.1295 0.0000 0.0000 0.1389 0.0103 0.2065 -0.0748 0.0000 0.0000 0.0987 0.1357 0.1107 0.1252 0.0037 0.2738 -0.3405 0.0915 0.0538 -0.0100 -0.1465 -0.0072 -0.0144 0.0028 -0.0003 0.1823 -0.0169 0.0028 0.0111 -0.0020 -0.1017 0.0850 -0.0850 0.0554 -0.0050 -0.1936 0.0737 -0.1130 -0.0468 0.1742 -0.1274 0.0200 0.0037 0.0630 0.1280 -0.0227 -0.0001 0.2653 0.0982 -0.0025 0.0010 -0.2471 0.1682 -0.0152 0.0043 -0.3401 0.1421 0.0249 -0.0028 -0.0350 0.0955 -0.0083 0.0024 0.0452 -0.0154 0.0227 -0.0052 -0.0046 -0.0008 0.0045 -0.0023 0.0107 -0.0034 -0.0102 -0.0001 0.0109 -0.0020 0.0025 -0.0034 0.0002 0.0022 0.0017 -0.0015 0.0023 -0.0014 143. (0.00015) RY (20)Co 1 s( 0.58%)p37.77( 21.97%)d53.67( 31.22%) f78.92( 45.91%)g 0.54( 0.31%) 0.0000 0.0000 0.0000 -0.0029 -0.0380 0.0526 0.0347 0.0199 0.0018 0.0000 -0.0001 0.0000 0.0000 0.0858 0.1649 -0.0434 -0.0044 0.0000 0.0000 0.0057 -0.0479 0.1445 0.0079 0.0000 0.0000 -0.0742 -0.2418 0.2749 0.1429 -0.0080 0.1051 0.0253 0.2009 0.0352 -0.0007 -0.1244 -0.3233 0.0079 -0.0278 0.0103 -0.0508 -0.2120 -0.2582 -0.1089 -0.0010 0.0289 0.0684 -0.0428 0.0541 -0.0021 -0.0347 -0.0024 -0.0068 -0.0193 -0.2464 -0.2003 -0.0056 -0.0076 -0.0542 0.0043 0.0262 0.0029 -0.1635 0.1108 0.0045 0.0009 0.2724 -0.3921 0.0026 -0.0084 -0.0425 0.0804 0.0278 -0.0011 -0.1383 0.1194 0.0376 0.0059 0.2010 -0.0112 -0.0557 -0.0054 -0.0022 -0.0018 0.0182 -0.0009 0.0021 -0.0021 -0.0108 -0.0021 -0.0022 -0.0016 0.0144 -0.0020 -0.0453 0.0003 0.0153 -0.0009 0.0117 -0.0030 144. (0.00015) RY (21)Co 1 s( 4.01%)p 7.15( 28.65%)d 6.00( 24.03%) f10.74( 43.04%)g 0.07( 0.27%) 0.0000 0.0000 0.0000 0.0025 0.1915 0.0029 -0.0207 -0.0546 -0.0002 0.0011 0.0003 0.0000 0.0000 -0.2381 -0.3071 0.2641 0.0459 0.0000 0.0000 -0.0778 0.1155 -0.0191 -0.0024 0.0000 0.0000 -0.0298 -0.1283 0.1373 0.0876 0.0157 -0.1400 -0.1060 -0.2506 -0.0306 -0.0011 -0.1058 -0.1787 0.0165 -0.0057 0.0063 -0.0231 -0.0984 -0.1128 -0.0530 -0.0030 -0.1142 -0.1018 -0.0883 -0.0333 0.0042 0.1178 -0.0264 -0.1714 -0.0017 -0.0411 -0.0718 -0.0102 -0.0031 0.0691 0.0293 -0.0398 -0.0049 0.1756 0.0025 -0.0177 -0.0003 0.1119 -0.1979 0.0096 -0.0038 -0.0713 0.0751 0.0181 0.0008 0.2926 -0.0155 -0.0636 -0.0107 -0.4434 0.1664 0.0874 0.0137 -0.0029 0.0009 0.0093 0.0005 0.0026 -0.0009 0.0052 0.0010 -0.0133 0.0019 0.0015 -0.0009 -0.0182 -0.0008 -0.0444 0.0035 -0.0035 0.0037 145. (0.00010) RY (22)Co 1 s( 7.07%)p 3.91( 27.66%)d 3.35( 23.73%) f 5.84( 41.33%)g 0.03( 0.21%) 0.0000 0.0000 0.0000 -0.0117 0.2204 0.1483 -0.0018 0.0065 0.0038 0.0008 0.0000 0.0000 0.0000 -0.0727 0.2755 0.1472 -0.1435 0.0000 0.0000 -0.2161 -0.3060 0.0719 -0.0109 0.0000 0.0000 0.0405 -0.0636 0.0170 -0.0402 -0.0030 0.1291 0.1847 0.1148 -0.0129 0.0017 -0.1187 -0.0470 0.0943 0.0087 0.0055 -0.0970 0.0858 0.0777 0.0104 -0.0070 0.1725 0.0860 -0.0485 0.0317 -0.0012 0.1982 0.1480 -0.1520 -0.0068 0.0905 0.0384 0.0192 -0.0032 0.4063 -0.0707 0.0142 0.0036 -0.1506 0.2219 -0.0214 0.0045 -0.1496 0.0166 0.0083 -0.0025 0.1556 -0.1581 -0.0045 0.0010 -0.0721 0.0131 0.0336 -0.0005 -0.2833 -0.0400 0.0090 -0.0044 -0.0250 0.0016 -0.0014 0.0010 0.0040 0.0007 -0.0279 -0.0007 -0.0100 -0.0015 0.0103 0.0004 0.0104 0.0005 0.0176 -0.0026 -0.0043 0.0025 146. (0.00008) RY (23)Co 1 s( 1.37%)p 8.67( 11.91%)d26.25( 36.07%) f36.70( 50.44%)g 0.14( 0.20%) 147. (0.00007) RY (24)Co 1 s( 4.20%)p 2.19( 9.20%)d 6.82( 28.65%) f13.67( 57.41%)g 0.13( 0.53%) 148. (0.00005) RY (25)Co 1 s( 6.45%)p 4.38( 28.23%)d 3.54( 22.85%) f 6.54( 42.21%)g 0.04( 0.26%) 149. (0.00004) RY (26)Co 1 s( 0.20%)p99.99( 28.50%)d99.99( 20.89%) f99.99( 50.15%)g 1.26( 0.26%) 150. (0.00003) RY (27)Co 1 s( 1.09%)p26.53( 28.85%)d19.89( 21.62%) f44.09( 47.94%)g 0.47( 0.51%) 151. (0.00002) RY (28)Co 1 s( 7.96%)p 3.62( 28.85%)d 3.18( 25.29%) f 4.63( 36.86%)g 0.13( 1.03%) 152. (0.00002) RY (29)Co 1 s( 2.29%)p16.70( 38.26%)d 6.69( 15.33%) f19.05( 43.64%)g 0.21( 0.47%) 153. (0.00002) RY (30)Co 1 s( 1.94%)p19.14( 37.03%)d 9.34( 18.08%) f21.22( 41.07%)g 0.97( 1.88%) 154. (0.00002) RY (31)Co 1 s( 1.17%)p26.73( 31.22%)d24.71( 28.86%) f31.09( 36.32%)g 2.08( 2.43%) 155. (0.00001) RY (32)Co 1 s( 2.04%)p16.38( 33.43%)d11.38( 23.23%) f19.16( 39.11%)g 1.08( 2.20%) 156. (0.00001) RY (33)Co 1 s( 6.15%)p 4.33( 26.63%)d 4.93( 30.27%) f 5.77( 35.48%)g 0.24( 1.47%) 157. (0.00001) RY (34)Co 1 s( 7.36%)p 2.51( 18.50%)d 1.84( 13.53%) f 7.78( 57.24%)g 0.46( 3.37%) 158. (0.00000) RY (35)Co 1 s( 12.26%)p 0.94( 11.54%)d 1.23( 15.06%) f 2.78( 34.03%)g 2.21( 27.11%) 159. (0.00000) RY (36)Co 1 s( 0.88%)p 5.20( 4.57%)d32.65( 28.71%) f49.45( 43.47%)g25.46( 22.38%) 160. (0.00000) RY (37)Co 1 s( 6.63%)p 3.24( 21.44%)d 3.01( 19.97%) f 7.25( 48.06%)g 0.59( 3.90%) 161. (0.00000) RY (38)Co 1 s( 25.55%)p 0.13( 3.22%)d 1.08( 27.49%) f 1.16( 29.64%)g 0.55( 14.09%) 162. (0.00001) RY (39)Co 1 s( 0.87%)p14.21( 12.34%)d51.11( 44.37%) f47.00( 40.81%)g 1.86( 1.62%) 163. (0.00001) RY (40)Co 1 s( 9.02%)p 1.94( 17.45%)d 1.65( 14.91%) f 5.87( 52.97%)g 0.63( 5.65%) 164. (0.00000) RY (41)Co 1 s( 12.26%)p 1.24( 15.15%)d 1.55( 18.98%) f 4.01( 49.17%)g 0.36( 4.43%) 165. (0.00000) RY (42)Co 1 s( 0.17%)p37.11( 6.32%)d99.99( 38.84%) f99.99( 38.02%)g97.72( 16.65%) 166. (0.00000) RY (43)Co 1 s( 8.85%)p 0.09( 0.77%)d 1.45( 12.88%) f 7.29( 64.56%)g 1.46( 12.94%) 167. (0.00000) RY (44)Co 1 s( 1.07%)p 2.18( 2.34%)d15.09( 16.17%) f71.96( 77.12%)g 3.08( 3.30%) 168. (0.00000) RY (45)Co 1 s( 2.40%)p 2.55( 6.13%)d10.87( 26.06%) f21.14( 50.71%)g 6.13( 14.71%) 169. (0.00000) RY (46)Co 1 s( 1.31%)p 2.38( 3.13%)d14.60( 19.18%) f43.92( 57.67%)g14.25( 18.71%) 170. (0.00000) RY (47)Co 1 s( 1.17%)p 6.63( 7.75%)d14.37( 16.80%) f57.31( 66.97%)g 6.26( 7.31%) 171. (0.00000) RY (48)Co 1 s( 0.38%)p15.31( 5.78%)d99.99( 41.86%) f99.99( 46.55%)g14.43( 5.44%) 172. (0.00000) RY (49)Co 1 s( 1.99%)p 2.57( 5.13%)d17.85( 35.58%) f26.52( 52.87%)g 2.22( 4.43%) 173. (0.00000) RY (50)Co 1 s( 7.65%)p 0.55( 4.17%)d 2.94( 22.50%) f 8.00( 61.22%)g 0.58( 4.46%) 174. (0.00000) RY (51)Co 1 s( 1.04%)p 4.18( 4.34%)d64.50( 66.93%) f21.11( 21.90%)g 5.59( 5.80%) 175. (0.00000) RY (52)Co 1 s( 7.24%)p 1.06( 7.70%)d 4.98( 36.08%) f 3.14( 22.75%)g 3.62( 26.23%) 176. (0.00000) RY (53)Co 1 s( 68.65%)p 0.00( 0.02%)d 0.00( 0.06%) f 0.03( 2.15%)g 0.42( 29.12%) 177. (0.00000) RY (54)Co 1 s( 6.31%)p 0.01( 0.06%)d 0.02( 0.15%) f 0.18( 1.12%)g14.64( 92.37%) 178. (0.00000) RY (55)Co 1 s( 16.10%)p 0.00( 0.03%)d 0.01( 0.12%) f 0.21( 3.39%)g 4.99( 80.37%) 179. (0.00000) RY (56)Co 1 s( 12.30%)p 0.00( 0.05%)d 0.01( 0.08%) f 0.38( 4.63%)g 6.74( 82.93%) 180. (0.00000) RY (57)Co 1 s( 30.46%)p 0.00( 0.03%)d 0.00( 0.11%) f 0.05( 1.66%)g 2.22( 67.74%) 181. (0.00000) RY (58)Co 1 s( 36.10%)p 0.00( 0.02%)d 0.01( 0.24%) f 0.17( 6.27%)g 1.59( 57.37%) 182. (0.00000) RY (59)Co 1 s( 10.10%)p 0.00( 0.04%)d 0.02( 0.22%) f 0.16( 1.62%)g 8.72( 88.03%) 183. (0.00000) RY (60)Co 1 s( 19.25%)p 0.00( 0.08%)d 0.04( 0.72%) f 2.08( 40.12%)g 2.07( 39.83%) 184. (0.00000) RY (61)Co 1 s( 3.10%)p 0.02( 0.06%)d 0.06( 0.18%) f 3.57( 11.08%)g27.60( 85.58%) 185. (0.00000) RY (62)Co 1 s( 24.22%)p 0.00( 0.10%)d 0.01( 0.24%) f 1.18( 28.51%)g 1.94( 46.93%) 186. (0.00000) RY (63)Co 1 s( 29.55%)p 0.01( 0.16%)d 0.02( 0.54%) f 1.10( 32.41%)g 1.26( 37.33%) 187. (0.00000) RY (64)Co 1 s( 0.53%)p 0.10( 0.05%)d 0.42( 0.22%) f21.03( 11.11%)g99.99( 88.09%) 188. (0.00000) RY (65)Co 1 s( 25.47%)p 0.02( 0.39%)d 0.06( 1.51%) f 0.45( 11.55%)g 2.40( 61.08%) 189. (0.00000) RY (66)Co 1 s( 1.29%)p 0.49( 0.62%)d 0.47( 0.60%) f35.52( 45.67%)g40.30( 51.82%) 190. (0.00000) RY (67)Co 1 s( 3.15%)p 0.04( 0.13%)d 0.14( 0.44%) f13.07( 41.18%)g17.48( 55.10%) 191. (0.00000) RY (68)Co 1 s( 0.68%)p 0.67( 0.46%)d 4.28( 2.91%) f65.31( 44.45%)g75.65( 51.49%) 192. (0.00000) RY (69)Co 1 s( 0.44%)p 2.99( 1.31%)d23.83( 10.42%) f38.18( 16.69%)g99.99( 71.15%) 193. (0.00000) RY (70)Co 1 s( 6.79%)p 0.14( 0.93%)d 0.81( 5.47%) f 5.19( 35.21%)g 7.60( 51.59%) 194. (0.00000) RY (71)Co 1 s( 1.57%)p 0.60( 0.94%)d 4.80( 7.53%) f19.23( 30.14%)g38.16( 59.82%) 195. (0.00000) RY (72)Co 1 s( 1.49%)p 2.16( 3.22%)d 4.70( 7.00%) f39.95( 59.52%)g19.31( 28.77%) 196. (0.00000) RY (73)Co 1 s( 1.06%)p 1.96( 2.07%)d13.13( 13.93%) f33.57( 35.63%)g44.57( 47.30%) 197. (0.00000) RY (74)Co 1 s( 2.79%)p 0.78( 2.19%)d 1.95( 5.43%) f12.50( 34.87%)g19.61( 54.72%) 198. (0.00000) RY (75)Co 1 s( 4.79%)p 1.04( 5.00%)d 5.62( 26.92%) f 7.86( 37.67%)g 5.35( 25.61%) 199. (0.00000) RY (76)Co 1 s( 4.45%)p 0.58( 2.59%)d 4.28( 19.01%) f 9.95( 44.21%)g 6.69( 29.74%) 200. (0.00000) RY (77)Co 1 s( 1.02%)p 2.49( 2.53%)d10.33( 10.53%) f48.33( 49.27%)g35.95( 36.65%) 201. (0.00000) RY (78)Co 1 s( 6.39%)p 0.86( 5.49%)d 3.70( 23.67%) f 8.93( 57.05%)g 1.16( 7.40%) 202. (0.00000) RY (79)Co 1 s( 3.76%)p 1.76( 6.62%)d 7.28( 27.38%) f11.73( 44.07%)g 4.83( 18.17%) 203. (0.00000) RY (80)Co 1 s( 10.64%)p 0.24( 2.56%)d 1.74( 18.52%) f 3.18( 33.87%)g 3.24( 34.41%) 204. (0.00000) RY (81)Co 1 s( 43.43%)p 0.13( 5.80%)d 0.28( 11.94%) f 0.60( 26.10%)g 0.29( 12.72%) 205. (0.00000) RY (82)Co 1 s( 2.70%)p 2.72( 7.36%)d 7.46( 20.17%) f14.06( 38.02%)g11.74( 31.75%) 206. (0.00000) RY (83)Co 1 s( 3.33%)p 1.95( 6.51%)d 3.40( 11.34%) f16.35( 54.47%)g 7.31( 24.35%) 207. (0.00000) RY (84)Co 1 s( 1.72%)p 3.07( 5.26%)d13.50( 23.18%) f34.46( 59.16%)g 6.22( 10.67%) 208. (0.00000) RY (85)Co 1 s( 5.41%)p 1.13( 6.09%)d 4.51( 24.38%) f 7.22( 39.05%)g 4.63( 25.07%) 209. (0.00724) RY ( 1) S 2 s( 4.09%)p 1.48( 6.06%)d21.21( 86.78%) f 0.70( 2.86%)g 0.05( 0.20%) 0.0000 0.0000 -0.0102 0.2014 0.0157 0.0020 -0.0005 0.0001 0.0000 0.0000 -0.0116 0.0964 -0.0095 0.0040 0.0000 0.0000 -0.0098 -0.2040 0.0414 0.0066 0.0002 0.0000 -0.0163 -0.0803 0.0302 0.0043 0.0005 0.4705 0.1376 -0.0010 -0.0004 0.6207 0.1887 0.0070 -0.0002 0.0025 -0.1092 0.0120 -0.0008 0.3820 0.1984 -0.0024 0.0003 -0.0823 -0.0490 0.0046 0.0000 0.0331 0.0238 0.0624 0.0255 0.0508 0.0014 -0.0591 -0.0093 0.0654 0.0349 -0.0884 -0.0450 -0.0044 -0.0299 0.0016 -0.0205 0.0084 -0.0047 0.0124 0.0076 -0.0037 0.0347 0.0100 210. (0.00360) RY ( 2) S 2 s( 0.11%)p99.99( 18.48%)d99.99( 78.65%) f23.78( 2.64%)g 1.03( 0.11%) 0.0000 0.0000 -0.0134 0.0032 0.0302 0.0023 0.0021 0.0001 0.0001 0.0000 0.1079 -0.1266 -0.0004 0.0007 -0.0009 0.0000 -0.0036 0.0603 -0.0423 0.0087 0.0000 0.0000 0.0131 -0.3875 -0.0318 0.0177 0.0006 -0.3785 -0.1369 0.0002 0.0005 -0.2053 0.2646 -0.0237 0.0046 -0.0480 -0.1904 -0.0033 0.0030 0.4676 0.1237 0.0370 -0.0056 -0.4104 -0.2630 -0.0123 0.0034 0.0261 -0.0490 0.0066 0.0100 0.0035 -0.0649 -0.0110 0.0618 -0.0289 -0.0123 -0.0769 0.0451 0.0284 0.0726 0.0113 -0.0118 -0.0140 0.0024 0.0012 0.0142 0.0059 -0.0079 -0.0194 211. (0.00321) RY ( 3) S 2 s( 9.78%)p 6.27( 61.29%)d 2.76( 26.97%) f 0.18( 1.80%)g 0.02( 0.16%) 0.0000 0.0000 -0.0098 0.3070 -0.0590 0.0006 0.0017 0.0002 -0.0002 0.0000 0.0580 -0.5122 0.0080 0.0366 -0.0006 0.0000 -0.0123 -0.5130 0.0399 0.0011 0.0008 0.0000 0.0143 0.2758 -0.0657 -0.0152 -0.0009 -0.0565 0.1132 -0.0292 0.0013 -0.2257 -0.2912 0.0160 -0.0027 -0.0853 -0.1129 -0.0124 0.0021 0.1918 0.2185 -0.0109 0.0010 0.0975 0.0497 0.0020 -0.0027 -0.0332 -0.0146 -0.0510 0.0129 -0.0079 -0.0027 -0.0184 0.0904 -0.0107 -0.0490 0.0055 -0.0275 0.0345 -0.0296 0.0120 0.0190 -0.0002 -0.0030 -0.0187 -0.0086 0.0098 0.0228 -0.0032 212. (0.00229) RY ( 4) S 2 s( 1.97%)p 9.82( 19.30%)d37.76( 74.21%) f 2.25( 4.42%)g 0.06( 0.11%) 0.0000 0.0000 0.0026 0.1399 -0.0088 -0.0012 -0.0006 0.0000 -0.0001 0.0000 -0.0003 0.2243 0.0654 -0.0293 -0.0005 0.0000 -0.0172 -0.1449 -0.0531 -0.0151 0.0007 0.0000 0.0140 0.3093 0.1316 -0.0053 -0.0008 -0.5324 -0.2185 -0.0050 0.0023 0.2830 0.2872 0.0014 -0.0030 -0.0487 -0.1980 -0.0005 0.0002 -0.0110 0.0336 0.0109 -0.0011 0.0240 0.4525 0.0044 -0.0041 -0.1029 0.1071 -0.0877 0.0759 0.0218 -0.0009 -0.0351 0.0106 0.0210 -0.0196 -0.0006 0.0615 0.0407 0.0234 0.0055 0.0055 0.0186 0.0092 0.0056 0.0198 -0.0057 -0.0056 -0.0126 213. (0.00134) RY ( 5) S 2 s( 6.10%)p 2.15( 13.13%)d11.82( 72.10%) f 1.40( 8.56%)g 0.02( 0.11%) 0.0000 0.0000 -0.0041 0.2468 0.0028 -0.0053 0.0032 0.0000 -0.0003 0.0000 0.0161 0.1084 0.2293 0.0052 -0.0012 0.0000 -0.0066 0.1650 0.1611 0.0127 -0.0007 0.0000 -0.0078 0.1031 -0.0502 -0.0087 0.0002 -0.4367 0.3430 -0.0007 -0.0031 0.2397 -0.0933 0.0246 -0.0058 0.1411 0.1068 0.0230 -0.0063 0.0974 -0.0484 -0.0170 0.0068 0.3296 -0.4394 0.0059 -0.0009 0.2017 -0.1115 0.0624 -0.0130 0.0375 -0.0155 0.0282 0.0080 -0.1131 0.0537 0.0842 -0.0306 0.0293 0.0371 0.0018 0.0109 -0.0132 -0.0132 -0.0029 -0.0136 0.0180 0.0048 -0.0113 214. (0.00105) RY ( 6) S 2 s( 7.45%)p 4.58( 34.14%)d 7.51( 55.93%) f 0.32( 2.38%)g 0.01( 0.09%) 0.0000 0.0000 0.0064 0.2041 0.1809 -0.0073 -0.0052 -0.0004 -0.0003 0.0000 0.0356 0.1516 0.0922 0.0068 0.0012 0.0000 0.0184 0.2530 0.1426 -0.0362 -0.0001 0.0000 0.0093 0.4070 0.2385 -0.0036 0.0004 0.1885 0.2770 -0.0040 0.0005 -0.4170 0.3224 -0.0028 0.0014 -0.0154 0.2527 -0.0037 -0.0020 0.2491 0.0709 0.0162 -0.0052 -0.1478 0.1253 0.0138 0.0015 -0.0763 -0.0330 -0.0069 0.0442 0.0026 0.0486 0.0671 0.0330 -0.0044 0.0696 -0.0197 -0.0346 -0.0144 0.0173 -0.0160 -0.0003 0.0016 0.0086 0.0125 -0.0076 0.0160 -0.0072 0.0074 215. (0.00077) RY ( 7) S 2 s( 5.69%)p 5.08( 28.90%)d10.16( 57.85%) f 1.31( 7.46%)g 0.02( 0.10%) 0.0000 0.0000 -0.0092 0.2383 -0.0058 0.0027 0.0005 0.0004 0.0001 0.0000 0.0269 -0.3351 -0.1490 -0.0075 0.0006 0.0000 0.0001 0.3591 -0.0100 0.0112 -0.0002 0.0000 0.0194 0.1467 0.0488 -0.0143 0.0013 -0.0316 -0.3790 0.0168 -0.0026 0.3132 -0.2429 -0.0125 0.0040 -0.1205 0.3972 -0.0161 0.0048 0.1755 -0.1755 -0.0116 0.0059 -0.2016 0.0365 0.0015 -0.0013 -0.0073 -0.0047 -0.0257 0.0232 -0.1692 0.0639 0.1375 -0.0617 0.0511 -0.0287 0.0162 -0.0043 0.1191 -0.0019 0.0023 0.0068 -0.0035 -0.0129 0.0158 0.0023 0.0051 -0.0069 -0.0221 216. (0.00053) RY ( 8) S 2 s( 2.48%)p 4.04( 10.02%)d31.01( 76.90%) f 4.14( 10.26%)g 0.14( 0.35%) 0.0000 0.0000 0.0038 0.1372 0.0768 -0.0076 0.0022 0.0006 0.0003 0.0000 -0.0065 0.0276 0.1194 0.0191 -0.0011 0.0000 -0.0216 0.0488 -0.1967 0.0455 -0.0010 0.0000 0.0148 0.1586 0.1232 -0.0245 0.0019 -0.0182 0.0405 -0.0280 -0.0042 0.1172 -0.1682 0.0637 -0.0068 0.1811 -0.0368 -0.0092 0.0028 -0.4400 0.3898 0.0008 0.0103 -0.5416 -0.2161 0.0048 -0.0050 -0.0112 -0.0872 -0.1437 0.0537 0.0270 -0.0438 -0.1200 0.0962 0.0367 -0.0054 0.1178 -0.0511 -0.1406 0.0858 0.0031 0.0154 -0.0260 -0.0113 0.0228 -0.0152 0.0279 0.0063 -0.0301 217. (0.00047) RY ( 9) S 2 s( 7.15%)p 0.58( 4.12%)d11.10( 79.31%) f 1.29( 9.20%)g 0.03( 0.22%) 0.0000 0.0000 0.0126 -0.1836 0.1933 0.0142 0.0048 0.0007 0.0003 0.0000 -0.0210 0.0290 0.0177 -0.0470 0.0025 0.0000 0.0180 0.1213 -0.0027 -0.0075 0.0020 0.0000 0.0153 0.0859 -0.1173 0.0294 -0.0033 0.0466 -0.2504 -0.0176 -0.0030 0.0165 0.0964 0.0035 0.0023 -0.5625 0.0952 -0.0093 0.0035 0.0002 0.5061 0.0362 0.0016 0.3288 -0.1643 -0.0156 -0.0044 0.1056 -0.0389 -0.1279 0.0743 -0.0229 -0.0284 -0.0496 0.0906 0.0205 0.0222 0.1791 -0.0056 -0.0783 0.0794 0.0102 -0.0282 -0.0007 0.0074 -0.0029 0.0247 0.0038 -0.0224 -0.0113 218. (0.00023) RY (10) S 2 s( 13.03%)p 2.86( 37.23%)d 3.14( 40.93%) f 0.66( 8.63%)g 0.01( 0.19%) 0.0000 0.0000 0.0131 0.2885 -0.2165 0.0030 -0.0066 0.0000 0.0001 0.0000 0.0047 0.4230 -0.0867 -0.0079 -0.0015 0.0000 0.0170 -0.3237 0.2162 -0.0062 -0.0012 0.0000 0.0375 -0.1679 0.0608 -0.0239 0.0001 -0.0505 0.0068 0.0124 -0.0019 -0.0863 -0.0999 0.0041 -0.0037 -0.4957 0.1926 -0.0413 0.0099 -0.1647 -0.0873 -0.0489 0.0017 -0.2368 -0.1054 0.0052 0.0023 -0.0291 -0.0522 0.1694 -0.0685 -0.0348 -0.0431 0.1452 -0.0138 0.0062 -0.0277 0.0962 -0.0217 0.1048 -0.0588 -0.0092 0.0190 -0.0094 0.0021 -0.0184 -0.0188 -0.0024 -0.0247 0.0073 219. (0.00021) RY (11) S 2 s( 28.13%)p 0.42( 11.74%)d 1.95( 54.83%) f 0.18( 4.93%)g 0.01( 0.37%) 0.0000 0.0000 -0.0007 0.5225 0.0883 0.0223 0.0015 0.0007 -0.0004 0.0000 0.0065 0.2060 -0.0006 -0.0718 -0.0012 0.0000 0.0014 0.0483 -0.0307 0.0357 0.0004 0.0000 -0.0153 0.0586 -0.2402 0.0616 -0.0044 0.2359 -0.4646 0.0048 -0.0046 -0.2102 0.0610 -0.0218 -0.0039 0.2002 -0.2959 0.0476 -0.0102 -0.0552 -0.1401 0.0453 -0.0030 0.1622 -0.2176 -0.0069 0.0000 0.0138 -0.0239 -0.1769 0.0375 0.0632 -0.0420 0.0785 -0.0364 -0.0004 -0.0133 0.0148 -0.0099 0.0451 -0.0086 0.0032 -0.0191 -0.0048 0.0322 -0.0006 0.0225 -0.0238 -0.0345 -0.0045 220. (0.00013) RY (12) S 2 s( 2.80%)p 5.90( 16.51%)d10.40( 29.09%) f18.23( 51.00%)g 0.22( 0.60%) 0.0000 0.0000 0.0021 0.0580 0.1564 0.0033 0.0115 0.0001 -0.0004 0.0000 -0.0064 -0.1597 0.0184 -0.0311 0.0018 0.0000 0.0072 0.1835 0.0871 0.0307 -0.0007 0.0000 0.0105 -0.0209 -0.3068 -0.0362 -0.0002 -0.0002 0.2430 -0.0254 0.0018 0.1002 -0.0077 -0.0728 0.0159 -0.2297 -0.2806 0.0298 0.0001 -0.0318 -0.1593 0.0020 0.0099 -0.1524 0.1396 -0.1175 0.0151 -0.2432 0.1522 0.0173 0.0083 0.2056 -0.1156 0.2772 -0.1374 -0.1435 0.0835 0.3952 -0.1660 -0.2451 0.0681 0.0162 -0.0375 -0.0045 0.0374 0.0092 0.0402 -0.0295 -0.0179 0.0075 221. (0.00008) RY (13) S 2 s( 3.15%)p 6.21( 19.58%)d12.05( 37.98%) f12.26( 38.64%)g 0.21( 0.65%) 222. (0.00008) RY (14) S 2 s( 12.51%)p 3.36( 42.09%)d 2.00( 25.06%) f 1.61( 20.13%)g 0.02( 0.21%) 223. (0.00005) RY (15) S 2 s( 0.91%)p24.36( 22.22%)d23.74( 21.65%) f59.54( 54.30%)g 1.01( 0.93%) 224. (0.00004) RY (16) S 2 s( 4.64%)p 6.96( 32.31%)d 6.27( 29.11%) f 7.19( 33.38%)g 0.12( 0.56%) 225. (0.00003) RY (17) S 2 s( 1.45%)p20.06( 29.02%)d 6.38( 9.23%) f40.63( 58.77%)g 1.07( 1.54%) 226. (0.00003) RY (18) S 2 s( 20.12%)p 2.00( 40.24%)d 0.94( 18.83%) f 0.95( 19.16%)g 0.08( 1.66%) 227. (0.00002) RY (19) S 2 s( 12.90%)p 2.04( 26.38%)d 1.82( 23.44%) f 2.72( 35.10%)g 0.17( 2.18%) 228. (0.00001) RY (20) S 2 s( 11.57%)p 1.94( 22.47%)d 2.12( 24.49%) f 3.44( 39.85%)g 0.14( 1.62%) 229. (0.00001) RY (21) S 2 s( 1.06%)p34.49( 36.57%)d13.20( 13.99%) f44.09( 46.75%)g 1.54( 1.63%) 230. (0.00001) RY (22) S 2 s( 7.36%)p 2.60( 19.11%)d 0.90( 6.66%) f 8.18( 60.23%)g 0.90( 6.64%) 231. (0.00001) RY (23) S 2 s( 16.03%)p 0.47( 7.52%)d 1.01( 16.25%) f 3.57( 57.25%)g 0.18( 2.95%) 232. (0.00001) RY (24) S 2 s( 1.37%)p14.92( 20.37%)d14.47( 19.75%) f37.06( 50.59%)g 5.81( 7.93%) 233. (0.00001) RY (25) S 2 s( 9.71%)p 2.26( 21.99%)d 0.84( 8.21%) f 5.50( 53.41%)g 0.69( 6.68%) 234. (0.00000) RY (26) S 2 s( 3.06%)p 2.29( 7.01%)d10.16( 31.05%) f 3.78( 11.56%)g15.49( 47.32%) 235. (0.00000) RY (27) S 2 s( 8.92%)p 0.38( 3.36%)d 2.39( 21.29%) f 2.86( 25.49%)g 4.59( 40.94%) 236. (0.00000) RY (28) S 2 s( 2.23%)p 3.34( 7.46%)d14.44( 32.22%) f13.50( 30.12%)g12.54( 27.97%) 237. (0.00000) RY (29) S 2 s( 0.83%)p 6.17( 5.09%)d29.39( 24.27%) f45.02( 37.17%)g39.52( 32.64%) 238. (0.00000) RY (30) S 2 s( 2.02%)p 7.12( 14.36%)d13.49( 27.19%) f17.47( 35.22%)g10.52( 21.22%) 239. (0.00000) RY (31) S 2 s( 3.67%)p 2.17( 7.96%)d13.41( 49.27%) f 9.24( 33.94%)g 1.40( 5.15%) 240. (0.00000) RY (32) S 2 s( 4.56%)p 1.66( 7.56%)d 7.57( 34.49%) f 5.84( 26.59%)g 5.88( 26.80%) 241. (0.00000) RY (33) S 2 s( 1.74%)p15.54( 27.01%)d18.26( 31.75%) f14.63( 25.44%)g 8.09( 14.06%) 242. (0.00000) RY (34) S 2 s( 2.44%)p13.55( 33.00%)d15.15( 36.89%) f 4.72( 11.50%)g 6.64( 16.17%) 243. (0.00000) RY (35) S 2 s( 0.66%)p49.61( 32.89%)d30.29( 20.08%) f39.16( 25.97%)g30.76( 20.39%) 244. (0.00000) RY (36) S 2 s( 1.10%)p21.19( 23.39%)d23.70( 26.16%) f34.13( 37.67%)g10.58( 11.67%) 245. (0.00000) RY (37) S 2 s( 0.64%)p42.44( 27.28%)d77.58( 49.87%) f24.87( 15.99%)g 9.66( 6.21%) 246. (0.00000) RY (38) S 2 s( 3.36%)p 4.30( 14.44%)d19.76( 66.41%) f 3.72( 12.48%)g 0.98( 3.31%) 247. (0.00000) RY (39) S 2 s( 1.79%)p 3.32( 5.95%)d35.81( 64.15%) f14.34( 25.69%)g 1.35( 2.42%) 248. (0.00000) RY (40) S 2 s( 3.47%)p 6.59( 22.89%)d11.16( 38.72%) f 9.54( 33.12%)g 0.52( 1.80%) 249. (0.00000) RY (41) S 2 s( 98.67%)p 0.01( 0.86%)d 0.00( 0.21%) f 0.00( 0.09%)g 0.00( 0.18%) 250. (0.00000) RY (42) S 2 s( 97.97%)p 0.00( 0.34%)d 0.01( 1.04%) f 0.01( 0.51%)g 0.00( 0.13%) 251. (0.00000) RY (43) S 2 s( 2.24%)p37.88( 84.68%)d 3.71( 8.30%) f 0.91( 2.04%)g 1.23( 2.75%) 252. (0.00000) RY (44) S 2 s( 3.59%)p24.41( 87.56%)d 1.64( 5.89%) f 0.43( 1.55%)g 0.39( 1.41%) 253. (0.00000) RY (45) S 2 s( 4.24%)p 8.84( 37.51%)d 5.68( 24.11%) f 5.75( 24.41%)g 2.29( 9.73%) 254. (0.00000) RY (46) S 2 s( 53.75%)p 0.22( 11.75%)d 0.25( 13.47%) f 0.12( 6.25%)g 0.27( 14.78%) 255. (0.00000) RY (47) S 2 s( 1.98%)p20.29( 40.20%)d 8.62( 17.08%) f11.82( 23.42%)g 8.75( 17.33%) 256. (0.00000) RY (48) S 2 s( 0.39%)p23.53( 9.27%)d99.99( 40.22%) f17.32( 6.82%)g99.99( 43.29%) 257. (0.00000) RY (49) S 2 s( 3.41%)p 1.49( 5.08%)d 8.29( 28.25%) f 3.61( 12.29%)g14.95( 50.96%) 258. (0.00000) RY (50) S 2 s( 0.74%)p 9.87( 7.27%)d14.16( 10.42%) f41.99( 30.91%)g68.83( 50.66%) 259. (0.00000) RY (51) S 2 s( 12.98%)p 0.45( 5.90%)d 2.41( 31.22%) f 1.51( 19.54%)g 2.34( 30.36%) 260. (0.00000) RY (52) S 2 s( 11.62%)p 0.58( 6.69%)d 1.26( 14.62%) f 1.74( 20.24%)g 4.03( 46.82%) 261. (0.00000) RY (53) S 2 s( 26.31%)p 0.38( 9.97%)d 0.60( 15.86%) f 1.04( 27.27%)g 0.78( 20.59%) 262. (0.00000) RY (54) S 2 s( 0.79%)p25.79( 20.34%)d49.21( 38.81%) f25.10( 19.80%)g25.69( 20.26%) 263. (0.00000) RY (55) S 2 s( 5.67%)p 0.67( 3.82%)d 3.59( 20.35%) f 2.77( 15.68%)g 9.62( 54.49%) 264. (0.00000) RY (56) S 2 s( 2.34%)p 0.75( 1.76%)d 4.93( 11.55%) f 6.29( 14.73%)g29.74( 69.62%) 265. (0.00000) RY (57) S 2 s( 13.87%)p 0.35( 4.85%)d 2.05( 28.40%) f 1.34( 18.52%)g 2.48( 34.36%) 266. (0.00000) RY (58) S 2 s( 5.76%)p 0.28( 1.60%)d 6.89( 39.65%) f 3.65( 21.01%)g 5.55( 31.97%) 267. (0.00000) RY (59) S 2 s( 0.80%)p11.64( 9.33%)d62.27( 49.94%) f35.46( 28.44%)g14.32( 11.48%) 268. (0.00000) RY (60) S 2 s( 0.27%)p11.74( 3.23%)d99.99( 30.66%) f81.55( 22.42%)g99.99( 43.41%) 269. (0.00000) RY (61) S 2 s( 20.35%)p 0.49( 10.03%)d 1.27( 25.94%) f 0.70( 14.18%)g 1.45( 29.50%) 270. (0.01931) RY ( 1) S 3 s( 11.73%)p 0.20( 2.38%)d 7.12( 83.55%) f 0.18( 2.15%)g 0.02( 0.19%) 0.0000 0.0000 -0.0195 0.3418 0.0107 -0.0021 -0.0007 0.0001 0.0000 0.0000 -0.0048 -0.0677 0.0116 -0.0020 -0.0003 0.0000 0.0378 0.1040 -0.0398 -0.0067 0.0005 0.0000 -0.0355 -0.0433 0.0449 0.0053 -0.0003 0.4227 0.0031 0.0079 -0.0008 -0.6488 -0.0158 -0.0120 0.0011 -0.0187 -0.0065 -0.0045 -0.0005 0.4843 -0.0148 0.0106 -0.0013 0.0080 0.0070 -0.0020 -0.0002 0.0429 0.0053 -0.0558 -0.0090 -0.0309 -0.0048 -0.0204 -0.0018 0.0854 0.0098 0.0862 0.0114 0.0060 0.0012 -0.0089 0.0205 -0.0079 0.0087 0.0145 -0.0110 -0.0091 0.0264 0.0134 271. (0.01042) RY ( 2) S 3 s( 0.56%)p36.12( 20.34%)d99.99( 74.78%) f 7.24( 4.08%)g 0.41( 0.23%) 0.0000 0.0000 -0.0080 0.0737 -0.0114 -0.0006 0.0004 0.0000 0.0000 0.0000 -0.1287 0.3141 0.0299 -0.0045 0.0008 0.0000 -0.0145 -0.1165 0.0451 0.0053 -0.0003 0.0000 0.0619 -0.2595 -0.0156 -0.0041 0.0003 -0.5742 -0.0145 -0.0121 0.0011 -0.1039 -0.0018 -0.0007 0.0011 0.3954 0.0300 0.0089 -0.0019 0.4014 -0.0035 0.0113 -0.0003 -0.2969 0.0084 -0.0099 -0.0003 -0.0229 0.0047 -0.0628 -0.0123 0.0779 0.0253 0.0950 0.0311 -0.0109 0.0037 -0.0446 -0.0228 -0.1236 -0.0389 0.0181 -0.0035 0.0050 0.0203 0.0142 -0.0166 -0.0123 -0.0184 -0.0238 272. (0.00629) RY ( 3) S 3 s( 0.09%)p99.99( 41.14%)d99.99( 56.54%) f21.72( 1.96%)g 3.04( 0.27%) 0.0000 0.0000 0.0008 0.0293 -0.0059 0.0020 -0.0014 0.0001 0.0000 0.0000 -0.0464 0.2183 0.1232 -0.0025 -0.0015 0.0000 -0.0073 0.4627 -0.0171 0.0055 -0.0008 0.0000 0.0380 0.3602 -0.0247 -0.0080 0.0003 0.2682 -0.0089 0.0088 -0.0003 0.5147 0.0306 0.0123 -0.0049 0.0867 -0.0275 0.0189 -0.0020 0.4188 0.0223 0.0099 -0.0062 -0.2053 0.0187 -0.0079 0.0023 -0.0717 -0.0194 0.0129 -0.0221 0.0118 0.0035 0.0883 0.0477 -0.0290 -0.0248 0.0320 0.0249 -0.0007 0.0105 0.0094 -0.0270 0.0059 -0.0037 -0.0126 0.0116 -0.0318 0.0221 0.0089 273. (0.00311) RY ( 4) S 3 s( 3.80%)p 6.82( 25.94%)d17.85( 67.88%) f 0.58( 2.19%)g 0.05( 0.17%) 0.0000 0.0000 0.0026 0.1949 0.0073 -0.0015 -0.0013 0.0002 0.0000 0.0000 0.0250 -0.0871 -0.0961 -0.0027 -0.0005 0.0000 0.0008 0.1777 -0.0756 0.0061 -0.0010 0.0000 -0.0161 0.4467 0.0696 0.0040 -0.0008 -0.3527 -0.0195 0.0022 0.0023 -0.0592 -0.0269 -0.0028 0.0019 0.3081 -0.0293 0.0042 0.0003 0.0667 0.0074 0.0009 -0.0008 0.6644 0.0887 0.0132 -0.0075 0.1083 0.0633 -0.0045 -0.0208 -0.0300 -0.0270 -0.0064 0.0087 -0.0131 -0.0106 -0.0524 -0.0196 -0.0236 0.0070 0.0088 -0.0113 -0.0306 0.0137 -0.0033 -0.0190 0.0053 -0.0042 0.0003 274. (0.00082) RY ( 5) S 3 s( 24.43%)p 1.10( 26.80%)d 1.90( 46.50%) f 0.07( 1.71%)g 0.02( 0.56%) 0.0000 0.0000 -0.0162 0.4869 -0.0819 -0.0178 -0.0022 0.0004 0.0002 0.0000 -0.0164 0.0472 0.1151 -0.0030 -0.0009 0.0000 0.0573 -0.1073 0.2658 -0.0046 -0.0002 0.0000 -0.0275 0.3878 0.1223 -0.0237 0.0049 -0.2729 -0.0763 -0.0085 0.0092 -0.0436 -0.0425 0.0205 -0.0061 -0.4605 0.0622 -0.0085 -0.0080 -0.1007 -0.1042 0.0173 -0.0033 -0.2997 0.2246 -0.0519 0.0003 -0.0175 0.0429 0.0694 -0.0240 -0.0579 -0.0394 -0.0218 -0.0386 -0.0205 -0.0059 -0.0432 -0.0169 0.0074 -0.0014 -0.0036 -0.0202 -0.0532 -0.0203 0.0319 -0.0041 0.0256 -0.0083 -0.0139 275. (0.00042) RY ( 6) S 3 s( 4.33%)p 6.08( 26.33%)d14.83( 64.19%) f 1.17( 5.04%)g 0.03( 0.11%) 0.0000 0.0000 -0.0117 0.1794 -0.1027 0.0132 -0.0163 0.0001 -0.0003 0.0000 -0.0351 -0.1157 0.2316 -0.0329 -0.0002 0.0000 0.0109 0.0604 -0.1252 0.0396 0.0023 0.0000 -0.0492 -0.4096 0.0508 -0.0087 0.0003 -0.1580 0.0129 0.0106 0.0054 0.2952 -0.0226 0.0257 0.0046 -0.4114 0.2845 -0.0217 0.0051 0.2785 -0.1943 0.0163 -0.0072 0.3543 -0.1823 0.0556 0.0070 -0.0182 -0.0228 -0.0485 0.0784 -0.0977 0.0588 0.0704 0.0088 0.0249 -0.0723 0.0732 -0.0627 -0.0798 0.0392 0.0271 -0.0156 0.0022 0.0052 -0.0084 -0.0030 0.0003 0.0073 0.0022 276. (0.00036) RY ( 7) S 3 s( 25.67%)p 1.16( 29.75%)d 1.50( 38.48%) f 0.22( 5.69%)g 0.02( 0.41%) 0.0000 0.0000 0.0022 0.5007 0.0760 0.0096 -0.0095 0.0005 -0.0003 0.0000 -0.0056 0.3131 0.1798 -0.0105 -0.0047 0.0000 -0.0061 -0.2122 -0.2110 0.0177 -0.0010 0.0000 0.0053 -0.2195 -0.1698 0.0071 -0.0015 0.2509 0.0230 0.0329 0.0134 0.2145 -0.1398 0.0107 0.0056 0.2762 -0.1209 0.0055 -0.0023 -0.2352 -0.1450 0.0036 -0.0088 0.1134 0.2709 -0.0255 0.0065 0.0461 0.0567 0.0398 0.0425 0.0116 -0.0529 -0.1220 -0.0415 -0.0851 0.0635 0.0871 -0.0628 0.0668 0.0375 -0.0280 0.0321 -0.0122 0.0081 -0.0133 -0.0034 0.0331 -0.0095 0.0265 277. (0.00029) RY ( 8) S 3 s( 2.69%)p24.32( 65.37%)d10.27( 27.60%) f 1.36( 3.65%)g 0.26( 0.69%) 0.0000 0.0000 -0.0130 -0.0604 0.1509 -0.0067 0.0158 -0.0003 -0.0003 0.0000 -0.0088 0.3379 -0.2281 0.0358 0.0001 0.0000 0.0002 -0.5617 0.0825 -0.0211 0.0000 0.0000 -0.0299 0.2524 -0.3104 0.0496 -0.0045 0.0852 0.0518 -0.0098 -0.0076 0.0709 0.0410 -0.0291 -0.0001 -0.2209 -0.0222 -0.0501 0.0054 0.2978 0.0301 0.0396 0.0049 0.2255 -0.2501 0.0434 0.0040 -0.0391 -0.0615 0.0813 -0.0314 -0.0382 0.0322 0.0030 0.0017 -0.0705 0.0810 -0.0015 0.0787 0.0049 -0.0579 -0.0344 0.0460 0.0464 0.0209 -0.0200 0.0057 -0.0160 -0.0124 0.0143 278. (0.00014) RY ( 9) S 3 s( 0.63%)p99.99( 63.82%)d43.34( 27.40%) f12.18( 7.70%)g 0.71( 0.45%) 0.0000 0.0000 -0.0032 0.0746 0.0086 -0.0254 0.0053 0.0001 0.0002 0.0000 -0.0152 -0.4978 -0.1636 -0.0190 0.0037 0.0000 0.0027 0.0671 0.3231 -0.0125 -0.0004 0.0000 -0.0063 -0.0934 -0.4951 0.0098 0.0014 -0.0923 0.1851 -0.0024 0.0029 0.1260 -0.2133 0.0032 0.0028 0.0507 -0.2588 0.0008 -0.0062 0.1611 -0.2450 -0.0328 0.0115 -0.0582 0.0925 0.0320 -0.0042 -0.0083 -0.0152 0.1786 -0.0488 0.1335 -0.0614 -0.0294 -0.0198 0.0219 0.0349 0.1161 -0.0159 0.0573 -0.0289 -0.0217 0.0256 0.0217 -0.0237 0.0222 0.0153 -0.0069 0.0391 -0.0054 279. (0.00011) RY (10) S 3 s( 2.52%)p17.46( 44.07%)d13.91( 35.10%) f 6.87( 17.34%)g 0.38( 0.97%) 0.0000 0.0000 0.0019 0.1569 -0.0218 -0.0108 0.0052 -0.0003 -0.0003 0.0000 -0.0034 -0.2554 -0.5306 0.0716 -0.0005 0.0000 -0.0053 -0.1481 -0.2292 0.0207 -0.0028 0.0000 0.0011 -0.0475 0.1023 -0.0340 -0.0009 0.1137 -0.3953 0.0055 -0.0058 0.1940 -0.0878 0.0593 0.0071 0.1277 0.2406 0.0107 0.0068 0.0873 -0.0556 0.1015 0.0112 -0.1527 0.0507 -0.1069 -0.0059 0.0006 0.0798 0.1847 -0.0184 -0.1576 0.0749 0.1115 -0.0715 0.0714 -0.0498 -0.2721 0.0281 -0.0273 -0.0376 0.0154 0.0310 -0.0213 0.0529 -0.0227 -0.0375 0.0062 -0.0569 -0.0018 280. (0.00004) RY (11) S 3 s( 7.36%)p 5.40( 39.74%)d 4.75( 34.94%) f 2.26( 16.63%)g 0.18( 1.33%) 281. (0.00003) RY (12) S 3 s( 5.85%)p 4.08( 23.86%)d 6.75( 39.51%) f 4.82( 28.18%)g 0.44( 2.60%) 282. (0.00003) RY (13) S 3 s( 4.92%)p 8.90( 43.77%)d 5.32( 26.14%) f 4.90( 24.08%)g 0.22( 1.08%) 283. (0.00002) RY (14) S 3 s( 6.12%)p 4.20( 25.72%)d 7.88( 48.23%) f 2.97( 18.16%)g 0.29( 1.76%) 284. (0.00001) RY (15) S 3 s( 26.93%)p 0.21( 5.56%)d 1.60( 43.22%) f 0.87( 23.49%)g 0.03( 0.80%) 285. (0.00001) RY (16) S 3 s( 13.64%)p 1.04( 14.21%)d 2.85( 38.85%) f 2.06( 28.09%)g 0.38( 5.20%) 286. (0.00001) RY (17) S 3 s( 16.34%)p 1.33( 21.72%)d 0.86( 14.02%) f 2.88( 47.07%)g 0.05( 0.85%) 287. (0.00001) RY (18) S 3 s( 5.11%)p 2.57( 13.12%)d11.44( 58.52%) f 4.09( 20.93%)g 0.45( 2.32%) 288. (0.00000) RY (19) S 3 s( 4.80%)p 1.82( 8.71%)d 8.26( 39.61%) f 8.12( 38.97%)g 1.65( 7.91%) 289. (0.00000) RY (20) S 3 s( 2.53%)p 8.03( 20.29%)d25.94( 65.53%) f 3.89( 9.82%)g 0.73( 1.84%) 290. (0.00000) RY (21) S 3 s( 7.22%)p 1.34( 9.65%)d 8.70( 62.83%) f 2.67( 19.27%)g 0.14( 1.04%) 291. (0.00000) RY (22) S 3 s( 0.69%)p 4.23( 2.92%)d51.71( 35.75%) f38.23( 26.43%)g49.46( 34.20%) 292. (0.00000) RY (23) S 3 s( 3.66%)p 1.03( 3.78%)d 6.09( 22.30%) f 6.91( 25.28%)g12.30( 44.99%) 293. (0.00000) RY (24) S 3 s( 2.71%)p 3.45( 9.38%)d 3.69( 10.02%) f14.13( 38.37%)g14.56( 39.52%) 294. (0.00000) RY (25) S 3 s( 5.25%)p 1.45( 7.59%)d 3.39( 17.80%) f 6.41( 33.62%)g 6.81( 35.75%) 295. (0.00000) RY (26) S 3 s( 1.20%)p10.28( 12.36%)d38.41( 46.18%) f13.60( 16.35%)g19.88( 23.90%) 296. (0.00000) RY (27) S 3 s( 2.12%)p 8.77( 18.57%)d 5.79( 12.25%) f15.99( 33.84%)g15.71( 33.24%) 297. (0.00000) RY (28) S 3 s( 0.34%)p17.42( 5.95%)d60.82( 20.78%) f99.99( 41.12%)g93.12( 31.81%) 298. (0.00000) RY (29) S 3 s( 0.64%)p 9.65( 6.14%)d36.10( 22.97%) f28.94( 18.41%)g81.48( 51.84%) 299. (0.00000) RY (30) S 3 s( 28.50%)p 0.45( 12.84%)d 0.71( 20.16%) f 0.38( 10.87%)g 0.97( 27.63%) 300. (0.00000) RY (31) S 3 s( 1.17%)p24.93( 29.05%)d 8.05( 9.39%) f26.21( 30.55%)g25.61( 29.85%) 301. (0.00000) RY (32) S 3 s( 10.38%)p 0.92( 9.55%)d 2.56( 26.56%) f 3.76( 39.01%)g 1.40( 14.50%) 302. (0.00000) RY (33) S 3 s( 4.36%)p 5.11( 22.31%)d 3.75( 16.37%) f 7.79( 34.01%)g 5.26( 22.95%) 303. (0.00000) RY (34) S 3 s( 0.41%)p55.74( 22.60%)d99.99( 46.73%) f45.45( 18.43%)g29.21( 11.84%) 304. (0.00000) RY (35) S 3 s( 2.53%)p12.54( 31.74%)d10.88( 27.54%) f10.25( 25.94%)g 4.84( 12.25%) 305. (0.00000) RY (36) S 3 s( 7.13%)p 0.26( 1.86%)d 2.92( 20.80%) f 7.96( 56.76%)g 1.89( 13.45%) 306. (0.00000) RY (37) S 3 s( 22.90%)p 1.36( 31.19%)d 0.39( 8.97%) f 0.87( 19.83%)g 0.75( 17.11%) 307. (0.00000) RY (38) S 3 s( 8.03%)p 1.57( 12.61%)d 2.91( 23.34%) f 5.81( 46.61%)g 1.17( 9.41%) 308. (0.00000) RY (39) S 3 s( 0.34%)p51.04( 17.11%)d68.95( 23.11%) f99.99( 36.04%)g69.83( 23.41%) 309. (0.00000) RY (40) S 3 s( 4.35%)p 2.44( 10.64%)d 7.88( 34.28%) f 7.51( 32.67%)g 4.15( 18.06%) 310. (0.00000) RY (41) S 3 s( 7.05%)p 0.82( 5.77%)d 4.61( 32.50%) f 6.94( 48.97%)g 0.81( 5.71%) 311. (0.00000) RY (42) S 3 s( 5.05%)p 1.23( 6.20%)d 3.09( 15.60%) f 9.19( 46.37%)g 5.31( 26.78%) 312. (0.00000) RY (43) S 3 s( 0.90%)p 8.76( 7.87%)d58.25( 52.34%) f37.50( 33.70%)g 5.77( 5.19%) 313. (0.00000) RY (44) S 3 s( 1.36%)p10.39( 14.18%)d35.26( 48.11%) f21.04( 28.70%)g 5.61( 7.65%) 314. (0.00000) RY (45) S 3 s( 0.13%)p99.99( 16.36%)d99.99( 61.46%) f99.99( 19.33%)g20.13( 2.72%) 315. (0.00000) RY (46) S 3 s( 1.59%)p 9.06( 14.38%)d16.89( 26.80%) f26.02( 41.30%)g10.04( 15.94%) 316. (0.00000) RY (47) S 3 s( 98.91%)p 0.01( 0.77%)d 0.00( 0.12%) f 0.00( 0.09%)g 0.00( 0.10%) 317. (0.00000) RY (48) S 3 s( 97.85%)p 0.01( 1.06%)d 0.00( 0.41%) f 0.00( 0.40%)g 0.00( 0.27%) 318. (0.00000) RY (49) S 3 s( 39.04%)p 1.33( 52.11%)d 0.15( 5.76%) f 0.05( 1.88%)g 0.03( 1.21%) 319. (0.00000) RY (50) S 3 s( 13.75%)p 3.12( 42.84%)d 2.48( 34.12%) f 0.39( 5.41%)g 0.28( 3.88%) 320. (0.00000) RY (51) S 3 s( 35.34%)p 0.57( 20.13%)d 0.89( 31.29%) f 0.30( 10.65%)g 0.07( 2.60%) 321. (0.00000) RY (52) S 3 s( 5.44%)p14.34( 78.01%)d 1.47( 8.00%) f 0.30( 1.62%)g 1.27( 6.93%) 322. (0.00000) RY (53) S 3 s( 0.55%)p54.98( 30.47%)d63.37( 35.12%) f16.99( 9.42%)g44.11( 24.44%) 323. (0.00000) RY (54) S 3 s( 0.55%)p24.43( 13.54%)d23.83( 13.21%) f31.20( 17.29%)g99.93( 55.40%) 324. (0.00000) RY (55) S 3 s( 1.45%)p21.92( 31.77%)d16.88( 24.47%) f 8.43( 12.22%)g20.77( 30.10%) 325. (0.00000) RY (56) S 3 s( 1.33%)p 5.35( 7.14%)d10.57( 14.09%) f40.48( 53.97%)g17.61( 23.47%) 326. (0.00000) RY (57) S 3 s( 1.24%)p 1.91( 2.37%)d41.24( 51.31%) f12.10( 15.05%)g24.13( 30.02%) 327. (0.00000) RY (58) S 3 s( 1.59%)p 5.67( 9.00%)d 9.89( 15.70%) f29.21( 46.37%)g17.23( 27.34%) 328. (0.00000) RY (59) S 3 s( 1.02%)p 2.80( 2.85%)d17.78( 18.10%) f38.24( 38.92%)g38.44( 39.12%) 329. (0.00000) RY (60) S 3 s( 1.02%)p 2.63( 2.68%)d20.87( 21.21%) f31.29( 31.81%)g42.58( 43.29%) 330. (0.00000) RY (61) S 3 s( 0.58%)p 6.29( 3.64%)d83.82( 48.57%) f44.72( 25.92%)g36.74( 21.29%) 331. (0.01597) RY ( 1) S 4 s( 9.33%)p 0.15( 1.38%)d 9.37( 87.43%) f 0.19( 1.73%)g 0.01( 0.13%) 0.0000 0.0000 -0.0163 0.3050 0.0038 -0.0021 -0.0004 0.0001 -0.0001 0.0000 -0.0202 -0.0355 0.0341 0.0042 -0.0005 0.0000 -0.0279 0.0900 0.0423 0.0112 -0.0010 0.0000 0.0006 0.0138 0.0019 0.0010 0.0000 -0.1804 -0.0027 -0.0003 0.0009 -0.0128 -0.0003 -0.0004 0.0001 -0.0966 0.0022 -0.0032 0.0004 0.1862 -0.0167 0.0094 -0.0012 0.8924 0.0098 0.0248 -0.0021 0.0144 0.0016 0.0724 0.0200 0.0986 0.0111 0.0086 0.0015 -0.0090 -0.0024 0.0360 0.0087 0.0070 -0.0008 0.0252 0.0022 -0.0040 0.0027 0.0218 0.0032 -0.0005 0.0088 0.0109 332. (0.00839) RY ( 2) S 4 s( 0.00%)p 1.00( 21.19%)d 3.51( 74.33%) f 0.20( 4.21%)g 0.01( 0.27%) 0.0000 0.0000 -0.0002 0.0058 0.0013 0.0001 -0.0001 0.0000 0.0000 0.0000 0.0004 0.0016 -0.0037 0.0003 -0.0001 0.0000 0.0067 0.0222 -0.0012 0.0005 -0.0001 0.0000 -0.1466 -0.4330 0.0480 0.0043 0.0001 -0.0250 -0.0005 -0.0009 0.0000 0.3578 0.0019 0.0205 0.0002 0.7779 0.0281 0.0283 -0.0020 0.0326 0.0026 0.0003 0.0000 0.0805 -0.0029 0.0030 -0.0003 -0.1463 -0.0429 0.0114 0.0030 0.0247 0.0078 -0.0572 -0.0267 0.1123 0.0365 0.0081 0.0021 0.0026 0.0009 -0.0014 -0.0202 -0.0109 -0.0021 0.0065 -0.0458 -0.0011 0.0006 0.0031 333. (0.00412) RY ( 3) S 4 s( 10.15%)p 5.35( 54.29%)d 3.40( 34.57%) f 0.08( 0.82%)g 0.02( 0.17%) 0.0000 0.0000 0.0012 0.3186 -0.0005 -0.0014 -0.0029 0.0004 0.0001 0.0000 0.0000 -0.6527 0.0585 -0.0223 -0.0001 0.0000 -0.0056 0.3204 0.1005 0.0039 -0.0002 0.0000 -0.0008 0.0110 0.0030 0.0001 0.0000 0.0528 0.0232 0.0057 -0.0041 0.0102 0.0001 0.0003 -0.0001 -0.0009 0.0010 -0.0011 0.0003 0.5166 0.0489 0.0126 -0.0048 -0.2688 0.0213 0.0009 0.0002 -0.0040 -0.0031 -0.0122 0.0328 -0.0264 -0.0301 0.0020 -0.0014 0.0010 -0.0027 0.0206 0.0147 0.0646 0.0228 -0.0069 0.0008 -0.0020 0.0326 0.0026 0.0010 -0.0017 -0.0161 0.0179 334. (0.00297) RY ( 4) S 4 s( 0.00%)p 1.00( 15.85%)d 5.15( 81.61%) f 0.15( 2.37%)g 0.01( 0.17%) 0.0000 0.0000 0.0001 0.0001 0.0019 0.0005 -0.0001 0.0000 0.0000 0.0000 0.0009 -0.0046 0.0002 0.0003 -0.0001 0.0000 -0.0011 -0.0129 0.0106 -0.0002 -0.0001 0.0000 0.0301 0.3413 -0.2019 0.0065 0.0009 0.0195 0.0060 0.0003 -0.0006 -0.7228 -0.0872 -0.0161 0.0113 0.5316 -0.0080 -0.0095 0.0032 0.0284 0.0018 -0.0005 0.0002 0.0410 0.0008 -0.0010 0.0003 -0.0055 0.0152 -0.0034 -0.0024 0.0099 0.0038 -0.1253 -0.0707 -0.0449 -0.0235 -0.0017 -0.0005 0.0062 0.0039 0.0019 -0.0219 0.0114 -0.0014 0.0025 -0.0135 -0.0296 -0.0018 0.0010 335. (0.00062) RY ( 5) S 4 s( 12.05%)p 3.55( 42.83%)d 3.56( 42.90%) f 0.10( 1.25%)g 0.08( 0.96%) 0.0000 0.0000 -0.0031 0.3057 -0.1632 -0.0219 0.0021 0.0001 0.0002 0.0000 0.0095 -0.2233 0.5526 -0.0074 0.0027 0.0000 -0.0367 0.1682 -0.2059 -0.0196 0.0017 0.0000 -0.0016 0.0189 -0.0073 -0.0013 -0.0003 0.0663 0.0717 -0.0331 -0.0022 0.0084 -0.0057 0.0022 -0.0007 0.0295 0.0059 0.0041 -0.0019 -0.6238 0.1301 -0.0197 -0.0112 0.0205 0.0999 -0.0201 0.0063 -0.0075 -0.0021 -0.0595 0.0328 -0.0582 -0.0218 -0.0059 -0.0038 0.0053 -0.0029 -0.0469 -0.0082 -0.0179 0.0361 -0.0550 0.0049 0.0044 0.0402 0.0604 0.0056 -0.0043 -0.0332 0.0108 336. (0.00047) RY ( 6) S 4 s( 8.26%)p 9.14( 75.43%)d 1.69( 13.97%) f 0.24( 2.01%)g 0.04( 0.33%) 0.0000 0.0000 -0.0169 0.2058 0.1986 -0.0216 0.0042 0.0000 0.0001 0.0000 -0.0312 -0.3853 -0.3256 0.0146 0.0010 0.0000 -0.0341 -0.6030 -0.3625 0.0141 0.0025 0.0000 -0.0012 -0.0407 -0.0235 0.0003 0.0003 0.3198 0.1054 0.0188 0.0094 0.0027 0.0086 -0.0003 0.0004 -0.0035 -0.0006 0.0007 -0.0005 -0.1059 -0.0440 -0.0141 0.0026 0.0962 -0.0553 -0.0039 0.0100 -0.0051 0.0138 -0.0752 0.0430 -0.0175 0.1019 -0.0001 0.0070 0.0052 -0.0009 -0.0301 -0.0260 0.0047 -0.0062 0.0075 0.0022 0.0047 -0.0500 0.0166 0.0000 0.0053 -0.0044 -0.0202 337. (0.00036) RY ( 7) S 4 s( 1.21%)p10.07( 12.20%)d67.64( 81.94%) f 3.75( 4.54%)g 0.08( 0.10%) 0.0000 0.0000 0.0158 0.0082 0.1078 -0.0103 0.0079 -0.0002 0.0001 0.0000 0.0612 -0.1830 -0.2322 -0.0283 0.0028 0.0000 0.0279 0.0407 -0.1630 0.0293 0.0018 0.0000 0.0020 -0.0141 -0.0040 -0.0009 0.0005 -0.7952 0.2758 -0.0518 0.0043 -0.0423 0.0270 -0.0075 -0.0004 0.0030 -0.0327 0.0028 0.0015 -0.1728 0.0738 -0.0249 -0.0097 -0.1173 -0.2294 -0.0472 0.0036 -0.0042 0.0059 0.0101 0.0633 -0.0160 0.0652 -0.0058 0.0121 -0.0008 -0.0028 0.0691 0.0034 -0.1756 0.0307 0.0113 0.0030 -0.0007 -0.0204 0.0158 0.0021 0.0075 0.0070 -0.0087 338. (0.00024) RY ( 8) S 4 s( 0.01%)p 1.00( 36.19%)d 1.56( 56.57%) f 0.16( 5.77%)g 0.04( 1.45%) 0.0000 0.0000 0.0001 -0.0008 0.0098 -0.0007 0.0004 0.0000 0.0000 0.0000 0.0004 -0.0050 -0.0275 -0.0003 0.0002 0.0000 0.0006 -0.0250 -0.0225 0.0016 0.0004 0.0000 -0.0087 0.5145 0.3065 0.0347 -0.0095 -0.0224 0.0358 -0.0056 0.0005 0.3445 -0.6184 0.0967 0.0066 0.1424 -0.1737 0.0418 -0.0313 0.0058 -0.0060 0.0013 -0.0018 0.0104 0.0069 0.0038 -0.0026 0.1028 0.0703 -0.0018 -0.0093 -0.0163 0.0038 0.0723 -0.1210 0.0118 -0.1471 0.0023 -0.0075 -0.0087 0.0076 0.0071 -0.0315 0.0230 -0.0090 -0.0057 0.0589 -0.0965 -0.0053 -0.0041 339. (0.00010) RY ( 9) S 4 s( 0.01%)p99.99( 28.30%)d99.99( 51.17%) f99.99( 16.34%)g99.99( 4.18%) 340. (0.00005) RY (10) S 4 s( 8.21%)p 1.88( 15.41%)d 4.22( 34.68%) f 5.04( 41.40%)g 0.04( 0.29%) 341. (0.00004) RY (11) S 4 s( 0.04%)p99.99( 33.97%)d99.99( 42.97%) f99.99( 20.36%)g64.02( 2.67%) 342. (0.00002) RY (12) S 4 s( 8.63%)p 6.92( 59.72%)d 1.45( 12.49%) f 2.16( 18.64%)g 0.06( 0.52%) 343. (0.00001) RY (13) S 4 s( 0.64%)p62.18( 39.59%)d27.52( 17.52%) f59.19( 37.69%)g 7.18( 4.57%) 344. (0.00001) RY (14) S 4 s( 1.96%)p 4.57( 8.95%)d38.26( 75.03%) f 5.99( 11.75%)g 1.18( 2.31%) 345. (0.00000) RY (15) S 4 s( 38.33%)p 0.42( 16.02%)d 0.89( 33.93%) f 0.30( 11.50%)g 0.01( 0.22%) 346. (0.00000) RY (16) S 4 s( 5.45%)p 2.95( 16.10%)d13.42( 73.19%) f 0.94( 5.12%)g 0.02( 0.13%) 347. (0.00001) RY (17) S 4 s( 12.83%)p 1.71( 21.97%)d 4.75( 60.98%) f 0.30( 3.88%)g 0.03( 0.34%) 348. (0.00000) RY (18) S 4 s( 2.63%)p 1.44( 3.77%)d 9.79( 25.72%) f11.03( 28.97%)g14.81( 38.91%) 349. (0.00000) RY (19) S 4 s( 0.68%)p11.35( 7.72%)d25.17( 17.12%) f53.00( 36.05%)g56.49( 38.43%) 350. (0.00000) RY (20) S 4 s( 2.31%)p 3.48( 8.05%)d 9.31( 21.49%) f14.79( 34.17%)g14.71( 33.98%) 351. (0.00000) RY (21) S 4 s( 1.18%)p 7.82( 9.22%)d52.53( 61.92%) f 5.90( 6.95%)g17.58( 20.72%) 352. (0.00000) RY (22) S 4 s( 2.87%)p 2.30( 6.58%)d 4.72( 13.55%) f19.11( 54.82%)g 7.73( 22.18%) 353. (0.00000) RY (23) S 4 s( 1.04%)p 1.95( 2.03%)d43.63( 45.33%) f30.41( 31.59%)g19.26( 20.01%) 354. (0.00000) RY (24) S 4 s( 5.84%)p 1.63( 9.51%)d 3.05( 17.80%) f 7.88( 45.99%)g 3.57( 20.86%) 355. (0.00000) RY (25) S 4 s( 2.18%)p 1.35( 2.95%)d10.44( 22.80%) f23.00( 50.26%)g 9.98( 21.80%) 356. (0.00000) RY (26) S 4 s( 2.22%)p 4.96( 11.04%)d 6.04( 13.44%) f 9.02( 20.07%)g23.94( 53.23%) 357. (0.00000) RY (27) S 4 s( 4.23%)p 1.04( 4.41%)d 7.33( 30.99%) f 7.66( 32.40%)g 6.61( 27.98%) 358. (0.00000) RY (28) S 4 s( 1.03%)p 6.72( 6.91%)d12.42( 12.78%) f48.09( 49.49%)g28.95( 29.79%) 359. (0.00000) RY (29) S 4 s( 0.89%)p 9.32( 8.29%)d48.87( 43.51%) f19.57( 17.42%)g33.58( 29.89%) 360. (0.00000) RY (30) S 4 s( 0.19%)p99.99( 41.42%)d99.99( 26.49%) f99.99( 21.01%)g57.25( 10.90%) 361. (0.00000) RY (31) S 4 s( 8.21%)p 2.23( 18.30%)d 3.00( 24.65%) f 3.66( 30.01%)g 2.29( 18.83%) 362. (0.00000) RY (32) S 4 s( 3.26%)p 7.22( 23.54%)d11.40( 37.18%) f 8.07( 26.32%)g 2.98( 9.70%) 363. (0.00000) RY (33) S 4 s( 16.41%)p 0.56( 9.24%)d 0.78( 12.73%) f 2.19( 35.92%)g 1.57( 25.70%) 364. (0.00000) RY (34) S 4 s( 9.00%)p 0.97( 8.74%)d 2.11( 18.95%) f 4.87( 43.83%)g 2.16( 19.48%) 365. (0.00000) RY (35) S 4 s( 7.60%)p 2.75( 20.89%)d 2.49( 18.91%) f 5.93( 45.07%)g 0.99( 7.52%) 366. (0.00000) RY (36) S 4 s( 13.83%)p 0.22( 3.04%)d 2.83( 39.08%) f 1.51( 20.90%)g 1.67( 23.15%) 367. (0.00000) RY (37) S 4 s( 21.11%)p 0.97( 20.37%)d 1.46( 30.80%) f 1.08( 22.78%)g 0.23( 4.93%) 368. (0.00000) RY (38) S 4 s( 2.58%)p 7.01( 18.09%)d 7.52( 19.40%) f11.48( 29.62%)g11.75( 30.31%) 369. (0.00000) RY (39) S 4 s( 2.11%)p 8.58( 18.05%)d11.47( 24.15%) f12.59( 26.50%)g13.86( 29.19%) 370. (0.00000) RY (40) S 4 s( 2.18%)p 7.06( 15.41%)d 7.22( 15.75%) f26.13( 57.04%)g 4.41( 9.62%) 371. (0.00000) RY (41) S 4 s( 1.22%)p 6.04( 7.38%)d32.01( 39.12%) f27.83( 34.01%)g14.96( 18.28%) 372. (0.00000) RY (42) S 4 s( 3.53%)p 2.06( 7.29%)d13.18( 46.52%) f 7.56( 26.71%)g 4.52( 15.95%) 373. (0.00000) RY (43) S 4 s( 5.12%)p 5.31( 27.18%)d 8.46( 43.32%) f 3.60( 18.44%)g 1.16( 5.95%) 374. (0.00000) RY (44) S 4 s( 2.39%)p 3.23( 7.73%)d26.65( 63.73%) f 8.34( 19.95%)g 2.59( 6.19%) 375. (0.00000) RY (45) S 4 s( 31.56%)p 0.58( 18.39%)d 0.58( 18.37%) f 0.92( 29.08%)g 0.08( 2.61%) 376. (0.00000) RY (46) S 4 s( 4.55%)p 4.47( 20.33%)d 7.68( 34.94%) f 8.09( 36.80%)g 0.74( 3.38%) 377. (0.00000) RY (47) S 4 s( 17.46%)p 0.87( 15.22%)d 1.28( 22.26%) f 2.08( 36.24%)g 0.51( 8.82%) 378. (0.00000) RY (48) S 4 s( 6.25%)p 4.59( 28.67%)d 8.80( 54.98%) f 1.41( 8.83%)g 0.20( 1.28%) 379. (0.00000) RY (49) S 4 s( 98.35%)p 0.01( 0.87%)d 0.00( 0.39%) f 0.00( 0.21%)g 0.00( 0.18%) 380. (0.00000) RY (50) S 4 s( 93.76%)p 0.02( 2.27%)d 0.02( 1.69%) f 0.02( 1.74%)g 0.01( 0.55%) 381. (0.00000) RY (51) S 4 s( 5.99%)p12.51( 74.99%)d 1.08( 6.47%) f 0.80( 4.77%)g 1.30( 7.77%) 382. (0.00000) RY (52) S 4 s( 0.52%)p99.99( 79.10%)d23.37( 12.16%) f 5.15( 2.68%)g10.64( 5.54%) 383. (0.00000) RY (53) S 4 s( 33.60%)p 0.11( 3.55%)d 0.37( 12.43%) f 0.30( 10.06%)g 1.20( 40.35%) 384. (0.00000) RY (54) S 4 s( 16.63%)p 0.82( 13.68%)d 2.14( 35.59%) f 0.86( 14.26%)g 1.19( 19.85%) 385. (0.00000) RY (55) S 4 s( 25.38%)p 0.47( 12.06%)d 1.15( 29.24%) f 0.54( 13.59%)g 0.78( 19.74%) 386. (0.00000) RY (56) S 4 s( 7.47%)p 4.99( 37.22%)d 1.42( 10.59%) f 3.03( 22.61%)g 2.96( 22.11%) 387. (0.00000) RY (57) S 4 s( 5.17%)p 0.94( 4.86%)d 4.69( 24.26%) f 8.45( 43.65%)g 4.27( 22.06%) 388. (0.00000) RY (58) S 4 s( 0.42%)p17.40( 7.25%)d35.39( 14.75%) f41.56( 17.32%)g99.99( 60.26%) 389. (0.00000) RY (59) S 4 s( 1.59%)p23.37( 37.21%)d 9.81( 15.62%) f12.93( 20.59%)g15.70( 25.00%) 390. (0.00000) RY (60) S 4 s( 2.06%)p 2.95( 6.07%)d14.72( 30.29%) f15.11( 31.09%)g14.82( 30.50%) 391. (0.00000) RY (61) S 4 s( 6.09%)p 2.45( 14.89%)d 1.76( 10.70%) f 8.31( 50.60%)g 2.91( 17.72%) 392. (0.01929) RY ( 1) S 5 s( 12.19%)p 0.19( 2.26%)d 6.83( 83.27%) f 0.17( 2.09%)g 0.02( 0.19%) 0.0000 0.0000 -0.0195 0.3484 0.0114 -0.0022 -0.0007 0.0001 0.0000 0.0000 -0.0061 -0.0630 0.0109 -0.0025 -0.0003 0.0000 0.0346 0.0970 -0.0345 -0.0056 0.0004 0.0000 0.0392 0.0529 -0.0477 -0.0069 0.0004 0.3805 -0.0022 0.0080 -0.0007 0.6842 0.0147 0.0132 -0.0013 -0.0129 0.0073 0.0032 0.0007 0.4676 -0.0116 0.0111 -0.0016 0.0032 0.0103 -0.0019 0.0001 -0.0496 -0.0060 -0.0696 -0.0108 -0.0254 -0.0036 0.0193 0.0016 -0.0816 -0.0096 0.0740 0.0106 0.0096 0.0021 -0.0065 -0.0171 0.0074 0.0112 0.0159 0.0155 0.0052 0.0261 0.0145 393. (0.01050) RY ( 2) S 5 s( 0.54%)p38.34( 20.68%)d99.99( 74.59%) f 7.34( 3.96%)g 0.44( 0.24%) 0.0000 0.0000 -0.0082 0.0720 -0.0117 -0.0006 0.0005 0.0000 0.0000 0.0000 -0.1261 0.3041 0.0294 -0.0049 0.0010 0.0000 -0.0117 -0.1535 0.0444 0.0049 -0.0002 0.0000 -0.0609 0.2602 0.0187 0.0045 -0.0003 -0.5868 -0.0132 -0.0119 0.0012 0.0792 0.0022 0.0000 -0.0012 -0.3798 -0.0275 -0.0084 0.0017 0.3689 -0.0062 0.0105 0.0003 -0.3370 0.0005 -0.0100 -0.0004 0.0385 0.0005 -0.0616 -0.0125 0.0834 0.0296 -0.0917 -0.0300 0.0211 -0.0010 -0.0380 -0.0214 -0.1155 -0.0364 0.0150 0.0051 -0.0136 0.0201 0.0114 0.0160 0.0101 -0.0152 -0.0282 394. (0.00628) RY ( 3) S 5 s( 0.08%)p99.99( 41.43%)d99.99( 56.13%) f26.64( 2.09%)g 3.49( 0.27%) 0.0000 0.0000 0.0000 0.0275 -0.0047 0.0020 -0.0015 0.0001 0.0000 0.0000 -0.0525 0.2240 0.1200 -0.0033 -0.0013 0.0000 -0.0049 0.4949 -0.0172 0.0052 -0.0009 0.0000 -0.0419 -0.3151 0.0231 0.0097 -0.0004 0.2983 -0.0036 0.0092 -0.0009 -0.4795 -0.0327 -0.0095 0.0046 -0.1295 0.0187 -0.0177 0.0020 0.4147 0.0223 0.0079 -0.0058 -0.2251 0.0202 -0.0104 0.0022 0.0741 0.0202 0.0134 -0.0195 0.0132 0.0073 -0.0944 -0.0474 0.0208 0.0233 0.0341 0.0240 0.0050 0.0163 0.0083 0.0250 -0.0087 0.0021 -0.0152 -0.0148 0.0276 0.0251 0.0109 395. (0.00313) RY ( 4) S 5 s( 3.69%)p 6.88( 25.34%)d18.61( 68.59%) f 0.60( 2.21%)g 0.05( 0.17%) 0.0000 0.0000 0.0024 0.1919 0.0064 -0.0009 -0.0010 0.0002 0.0000 0.0000 0.0279 -0.0983 -0.1031 -0.0041 -0.0005 0.0000 -0.0004 0.2090 -0.0741 0.0052 -0.0009 0.0000 0.0180 -0.4201 -0.0794 -0.0046 0.0008 -0.3446 -0.0175 0.0004 0.0027 0.0427 0.0255 0.0031 -0.0017 -0.4191 0.0160 -0.0064 0.0009 0.0329 0.0077 0.0004 -0.0010 0.6162 0.0860 0.0138 -0.0074 -0.1141 -0.0678 -0.0004 -0.0174 -0.0050 -0.0101 0.0037 -0.0100 0.0174 0.0150 -0.0487 -0.0185 -0.0249 0.0075 0.0164 0.0090 0.0228 0.0189 -0.0083 0.0177 -0.0073 -0.0056 -0.0020 396. (0.00078) RY ( 5) S 5 s( 24.05%)p 1.20( 28.75%)d 1.86( 44.64%) f 0.08( 1.95%)g 0.03( 0.60%) 0.0000 0.0000 -0.0163 0.4832 -0.0800 -0.0187 -0.0019 0.0004 0.0002 0.0000 -0.0187 0.0421 0.1037 -0.0026 -0.0013 0.0000 0.0525 -0.0849 0.2878 -0.0040 0.0001 0.0000 0.0321 -0.4155 -0.0877 0.0212 -0.0049 -0.2802 -0.0900 -0.0039 0.0101 0.0006 0.0425 -0.0256 0.0068 0.4922 -0.0603 0.0094 0.0085 -0.0335 -0.0969 0.0140 -0.0027 -0.2215 0.2207 -0.0515 0.0011 0.0054 -0.0569 0.0810 -0.0255 -0.0607 -0.0368 0.0213 0.0306 0.0147 0.0151 -0.0445 -0.0102 0.0070 -0.0078 0.0130 0.0253 0.0589 -0.0149 0.0258 0.0102 -0.0206 -0.0091 -0.0157 397. (0.00042) RY ( 6) S 5 s( 7.11%)p 3.66( 25.99%)d 8.77( 62.36%) f 0.63( 4.47%)g 0.01( 0.07%) 0.0000 0.0000 -0.0126 0.2573 -0.0653 0.0124 -0.0182 0.0003 -0.0003 0.0000 -0.0377 -0.0383 0.2534 -0.0339 -0.0010 0.0000 0.0059 -0.0359 -0.1316 0.0408 0.0020 0.0000 0.0517 0.4101 -0.0222 0.0053 0.0001 -0.0806 0.0223 0.0157 0.0068 -0.3393 0.0415 -0.0221 -0.0053 0.3045 -0.2056 0.0146 -0.0050 0.2938 -0.2192 0.0178 -0.0094 0.4362 -0.1882 0.0569 0.0081 -0.0165 0.0307 -0.0393 0.0847 -0.0850 0.0434 -0.0768 0.0069 0.0010 0.0490 0.0934 -0.0607 -0.0568 0.0404 0.0178 0.0053 -0.0116 0.0050 -0.0120 -0.0013 -0.0046 0.0046 0.0063 398. (0.00037) RY ( 7) S 5 s( 23.71%)p 1.02( 24.07%)d 1.94( 46.04%) f 0.25( 5.83%)g 0.02( 0.36%) 0.0000 0.0000 0.0050 0.4801 0.0799 0.0068 -0.0081 0.0005 -0.0002 0.0000 -0.0004 0.3068 0.1695 -0.0100 -0.0045 0.0000 -0.0061 -0.1655 -0.2019 0.0092 -0.0016 0.0000 -0.0157 0.1732 0.1382 -0.0045 0.0009 0.2617 0.0028 0.0306 0.0115 -0.1377 0.1292 -0.0037 -0.0044 -0.3226 0.1220 -0.0102 0.0044 -0.3483 -0.1026 -0.0029 -0.0074 -0.0119 0.3208 -0.0348 0.0044 -0.0396 -0.0773 0.0483 0.0242 0.0200 -0.0527 0.1407 0.0394 0.0665 -0.0613 0.0759 -0.0672 0.0640 0.0270 -0.0206 -0.0314 0.0221 0.0028 -0.0041 0.0077 -0.0301 -0.0158 0.0212 399. (0.00029) RY ( 8) S 5 s( 2.76%)p25.70( 71.00%)d 7.76( 21.43%) f 1.45( 4.02%)g 0.29( 0.79%) 0.0000 0.0000 -0.0117 -0.0396 0.1599 -0.0065 0.0174 -0.0003 -0.0003 0.0000 -0.0069 0.3687 -0.2584 0.0365 0.0002 0.0000 -0.0051 -0.5397 0.0442 -0.0192 -0.0005 0.0000 0.0249 -0.2971 0.3473 -0.0519 0.0044 0.1351 0.0512 -0.0096 -0.0079 -0.0624 -0.0170 0.0302 -0.0005 0.0974 0.0835 0.0398 -0.0065 0.2688 0.0407 0.0398 0.0050 0.2320 -0.1973 0.0420 0.0039 0.0242 0.0583 0.1020 -0.0494 -0.0290 0.0054 0.0063 0.0022 0.0664 -0.0970 0.0059 0.0707 0.0228 -0.0554 -0.0530 -0.0534 -0.0372 0.0151 -0.0066 -0.0088 0.0107 -0.0138 0.0153 400. (0.00013) RY ( 9) S 5 s( 0.25%)p99.99( 55.11%)d99.99( 32.78%) f44.17( 10.92%)g 3.81( 0.94%) 0.0000 0.0000 -0.0031 0.0176 0.0403 -0.0226 0.0036 0.0003 0.0002 0.0000 -0.0124 -0.3550 0.0165 -0.0399 0.0036 0.0000 0.0045 0.1554 0.3161 -0.0204 0.0006 0.0000 0.0058 0.0938 0.5372 -0.0342 -0.0016 -0.1276 0.3486 -0.0192 0.0031 -0.0374 0.1783 0.0225 -0.0005 -0.0018 0.3105 0.0056 0.0065 0.0959 -0.1690 -0.0642 0.0064 -0.0040 0.1138 0.0675 0.0013 0.0332 0.0338 0.0837 -0.0505 0.1685 -0.0865 0.0842 -0.0239 -0.0084 -0.0519 0.2128 -0.0331 0.0673 -0.0142 -0.0375 -0.0107 -0.0239 -0.0417 0.0329 -0.0332 0.0129 0.0565 0.0063 401. (0.00010) RY (10) S 5 s( 4.00%)p13.36( 53.45%)d 6.86( 27.45%) f 3.61( 14.44%)g 0.17( 0.66%) 402. (0.00004) RY (11) S 5 s( 7.40%)p 5.43( 40.17%)d 5.24( 38.75%) f 1.60( 11.85%)g 0.25( 1.83%) 403. (0.00003) RY (12) S 5 s( 4.43%)p 9.51( 42.14%)d 5.68( 25.18%) f 6.09( 26.98%)g 0.28( 1.26%) 404. (0.00002) RY (13) S 5 s( 2.32%)p11.89( 27.60%)d13.02( 30.23%) f16.21( 37.64%)g 0.95( 2.21%) 405. (0.00002) RY (14) S 5 s( 5.56%)p 4.43( 24.65%)d 8.54( 47.46%) f 3.75( 20.84%)g 0.27( 1.50%) 406. (0.00001) RY (15) S 5 s( 28.98%)p 0.19( 5.42%)d 1.44( 41.79%) f 0.80( 23.11%)g 0.02( 0.70%) 407. (0.00001) RY (16) S 5 s( 8.11%)p 1.63( 13.23%)d 5.40( 43.84%) f 3.49( 28.33%)g 0.80( 6.49%) 408. (0.00001) RY (17) S 5 s( 3.48%)p 4.61( 16.02%)d 8.50( 29.56%) f14.36( 49.92%)g 0.29( 1.02%) 409. (0.00001) RY (18) S 5 s( 17.96%)p 0.74( 13.36%)d 2.94( 52.84%) f 0.82( 14.77%)g 0.06( 1.07%) 410. (0.00000) RY (19) S 5 s( 7.95%)p 1.97( 15.67%)d 7.75( 61.60%) f 1.70( 13.49%)g 0.16( 1.30%) 411. (0.00000) RY (20) S 5 s( 9.28%)p 1.39( 12.89%)d 6.68( 62.03%) f 1.67( 15.54%)g 0.03( 0.25%) 412. (0.00000) RY (21) S 5 s( 1.40%)p 4.58( 6.42%)d20.38( 28.58%) f18.08( 25.35%)g27.28( 38.25%) 413. (0.00000) RY (22) S 5 s( 0.48%)p10.35( 5.01%)d69.15( 33.46%) f33.09( 16.01%)g93.06( 45.03%) 414. (0.00000) RY (23) S 5 s( 2.68%)p 0.47( 1.26%)d 3.08( 8.24%) f 8.49( 22.74%)g24.31( 65.08%) 415. (0.00000) RY (24) S 5 s( 0.68%)p13.05( 8.85%)d20.48( 13.89%) f76.30( 51.77%)g36.57( 24.81%) 416. (0.00000) RY (25) S 5 s( 1.85%)p11.33( 20.94%)d 7.82( 14.46%) f14.61( 27.01%)g19.32( 35.73%) 417. (0.00000) RY (26) S 5 s( 1.96%)p 1.20( 2.36%)d10.47( 20.55%) f19.96( 39.17%)g18.33( 35.97%) 418. (0.00000) RY (27) S 5 s( 0.24%)p33.66( 7.94%)d99.99( 45.80%) f69.61( 16.41%)g99.99( 29.61%) 419. (0.00000) RY (28) S 5 s( 1.70%)p 8.91( 15.11%)d 5.83( 9.89%) f19.13( 32.46%)g24.08( 40.85%) 420. (0.00000) RY (29) S 5 s( 0.85%)p19.58( 16.74%)d27.13( 23.19%) f51.94( 44.40%)g17.33( 14.81%) 421. (0.00000) RY (30) S 5 s( 0.88%)p19.47( 17.08%)d34.53( 30.31%) f31.91( 28.01%)g27.03( 23.72%) 422. (0.00000) RY (31) S 5 s( 27.23%)p 0.59( 16.02%)d 0.88( 24.08%) f 0.82( 22.44%)g 0.38( 10.23%) 423. (0.00000) RY (32) S 5 s( 14.10%)p 1.83( 25.83%)d 1.28( 18.08%) f 2.16( 30.51%)g 0.81( 11.48%) 424. (0.00000) RY (33) S 5 s( 2.19%)p 7.57( 16.56%)d 6.79( 14.86%) f14.83( 32.46%)g15.51( 33.94%) 425. (0.00000) RY (34) S 5 s( 0.25%)p91.53( 22.88%)d99.99( 30.02%) f99.99( 34.13%)g50.89( 12.72%) 426. (0.00000) RY (35) S 5 s( 10.98%)p 1.36( 14.88%)d 2.13( 23.41%) f 3.00( 32.96%)g 1.62( 17.76%) 427. (0.00000) RY (36) S 5 s( 14.21%)p 1.72( 24.46%)d 0.92( 13.02%) f 1.75( 24.88%)g 1.65( 23.43%) 428. (0.00000) RY (37) S 5 s( 0.49%)p20.51( 9.99%)d34.90( 17.00%) f91.79( 44.70%)g57.13( 27.82%) 429. (0.00000) RY (38) S 5 s( 11.99%)p 1.00( 11.94%)d 0.86( 10.32%) f 3.32( 39.84%)g 2.16( 25.92%) 430. (0.00000) RY (39) S 5 s( 1.06%)p26.64( 28.35%)d23.80( 25.32%) f33.21( 35.33%)g 9.34( 9.94%) 431. (0.00000) RY (40) S 5 s( 9.94%)p 0.49( 4.85%)d 1.09( 10.79%) f 5.09( 50.58%)g 2.40( 23.85%) 432. (0.00000) RY (41) S 5 s( 0.89%)p 6.90( 6.12%)d74.71( 66.28%) f23.10( 20.50%)g 7.01( 6.22%) 433. (0.00000) RY (42) S 5 s( 6.81%)p 1.21( 8.26%)d 5.66( 38.51%) f 5.63( 38.35%)g 1.19( 8.08%) 434. (0.00000) RY (43) S 5 s( 0.79%)p10.89( 8.56%)d44.83( 35.25%) f63.09( 49.60%)g 7.38( 5.80%) 435. (0.00000) RY (44) S 5 s( 1.22%)p 8.27( 10.12%)d42.85( 52.39%) f22.20( 27.14%)g 7.47( 9.13%) 436. (0.00000) RY (45) S 5 s( 0.54%)p27.57( 14.92%)d67.98( 36.78%) f58.75( 31.79%)g29.53( 15.97%) 437. (0.00000) RY (46) S 5 s( 2.83%)p 6.63( 18.76%)d15.08( 42.66%) f10.19( 28.82%)g 2.45( 6.93%) 438. (0.00000) RY (47) S 5 s( 98.05%)p 0.02( 1.63%)d 0.00( 0.21%) f 0.00( 0.08%)g 0.00( 0.04%) 439. (0.00000) RY (48) S 5 s( 97.32%)p 0.02( 1.62%)d 0.00( 0.33%) f 0.01( 0.52%)g 0.00( 0.20%) 440. (0.00000) RY (49) S 5 s( 2.30%)p37.27( 85.73%)d 2.54( 5.83%) f 1.70( 3.91%)g 0.97( 2.23%) 441. (0.00000) RY (50) S 5 s( 40.72%)p 0.45( 18.19%)d 0.75( 30.63%) f 0.22( 8.95%)g 0.04( 1.51%) 442. (0.00000) RY (51) S 5 s( 28.79%)p 0.07( 2.04%)d 1.92( 55.19%) f 0.30( 8.69%)g 0.18( 5.30%) 443. (0.00000) RY (52) S 5 s( 10.23%)p 6.39( 65.33%)d 1.52( 15.52%) f 0.23( 2.37%)g 0.64( 6.56%) 444. (0.00000) RY (53) S 5 s( 9.24%)p 3.20( 29.52%)d 1.54( 14.20%) f 1.95( 18.03%)g 3.14( 29.01%) 445. (0.00000) RY (54) S 5 s( 2.52%)p 8.13( 20.51%)d10.04( 25.35%) f 7.08( 17.88%)g13.36( 33.73%) 446. (0.00000) RY (55) S 5 s( 0.27%)p99.99( 37.64%)d41.11( 10.99%) f99.99( 44.58%)g24.42( 6.53%) 447. (0.00000) RY (56) S 5 s( 4.43%)p 1.49( 6.62%)d 4.27( 18.91%) f 7.32( 32.45%)g 8.48( 37.59%) 448. (0.00000) RY (57) S 5 s( 7.14%)p 1.48( 10.55%)d 4.81( 34.36%) f 2.96( 21.18%)g 3.75( 26.77%) 449. (0.00000) RY (58) S 5 s( 2.53%)p 4.00( 10.13%)d11.59( 29.31%) f11.78( 29.80%)g11.16( 28.23%) 450. (0.00000) RY (59) S 5 s( 1.76%)p 3.57( 6.28%)d34.81( 61.19%) f11.42( 20.07%)g 6.09( 10.70%) 451. (0.00000) RY (60) S 5 s( 0.71%)p 2.71( 1.92%)d37.76( 26.77%) f42.27( 29.97%)g57.29( 40.63%) 452. (0.00000) RY (61) S 5 s( 1.66%)p 1.51( 2.51%)d18.39( 30.48%) f11.73( 19.44%)g27.69( 45.91%) 453. (0.00732) RY ( 1) S 6 s( 4.49%)p 1.35( 6.05%)d19.24( 86.42%) f 0.63( 2.82%)g 0.05( 0.21%) 0.0000 0.0000 -0.0107 0.2112 0.0146 0.0013 -0.0003 0.0001 0.0000 0.0000 -0.0092 0.0938 -0.0048 0.0038 -0.0001 0.0000 -0.0119 -0.2120 0.0408 0.0072 0.0002 0.0000 0.0166 0.0620 -0.0261 -0.0034 -0.0005 0.5437 0.1492 -0.0003 -0.0009 -0.5688 -0.1694 -0.0068 0.0003 -0.0435 0.1044 -0.0134 0.0018 0.3760 0.1820 -0.0022 0.0008 -0.0669 -0.0453 0.0037 -0.0004 -0.0240 -0.0210 0.0572 0.0200 0.0550 0.0052 0.0665 0.0075 -0.0596 -0.0313 -0.0880 -0.0472 -0.0127 -0.0369 -0.0010 0.0216 -0.0068 -0.0059 0.0091 -0.0058 0.0007 0.0346 0.0150 454. (0.00350) RY ( 2) S 6 s( 0.38%)p63.98( 24.33%)d99.99( 72.56%) f 6.84( 2.60%)g 0.35( 0.13%) 0.0000 0.0000 0.0112 0.0453 -0.0402 -0.0018 -0.0023 -0.0001 -0.0001 0.0000 -0.0924 0.0139 0.0013 0.0049 0.0007 0.0000 -0.0004 -0.1215 0.0532 -0.0106 0.0001 0.0000 0.0091 -0.4649 -0.0140 0.0207 0.0009 0.3645 0.1248 -0.0060 -0.0006 -0.1091 0.3162 -0.0248 0.0049 -0.0531 -0.1925 0.0001 0.0027 -0.4138 -0.1156 -0.0360 0.0056 0.4193 0.2504 0.0135 -0.0036 0.0302 -0.0333 -0.0219 -0.0090 -0.0181 0.0674 -0.0114 0.0434 -0.0312 0.0036 0.0805 -0.0457 -0.0145 -0.0824 -0.0110 -0.0167 -0.0111 -0.0043 -0.0055 0.0170 0.0025 0.0108 0.0184 455. (0.00309) RY ( 3) S 6 s( 9.28%)p 6.07( 56.32%)d 3.48( 32.24%) f 0.22( 2.00%)g 0.02( 0.16%) 0.0000 0.0000 -0.0124 0.2989 -0.0574 0.0015 0.0027 0.0002 -0.0002 0.0000 0.0784 -0.5203 0.0106 0.0373 -0.0006 0.0000 -0.0091 -0.4848 0.0267 0.0049 0.0007 0.0000 -0.0150 -0.2046 0.0817 0.0121 0.0007 -0.1121 0.0649 -0.0253 0.0009 0.2857 0.2526 -0.0130 0.0018 0.0703 0.1384 0.0138 -0.0024 0.2862 0.2278 -0.0018 0.0001 0.0302 -0.0198 0.0004 -0.0028 0.0180 0.0279 -0.0448 0.0173 -0.0136 -0.0121 0.0233 -0.1064 0.0176 0.0485 -0.0086 -0.0137 0.0372 -0.0099 0.0149 -0.0198 0.0027 -0.0045 -0.0178 0.0051 -0.0120 0.0206 -0.0071 456. (0.00228) RY ( 4) S 6 s( 2.97%)p 6.05( 17.99%)d25.05( 74.48%) f 1.50( 4.45%)g 0.04( 0.10%) 0.0000 0.0000 0.0013 0.1724 -0.0009 -0.0013 -0.0005 0.0000 -0.0001 0.0000 0.0033 0.1813 0.0685 -0.0257 -0.0007 0.0000 -0.0163 -0.1224 -0.0344 -0.0170 0.0008 0.0000 -0.0165 -0.3292 -0.1280 0.0025 0.0007 -0.5299 -0.1811 -0.0076 0.0019 -0.3534 -0.2702 -0.0020 0.0030 0.0588 0.1343 0.0018 0.0000 0.0350 0.0675 0.0105 -0.0008 0.0517 0.4508 0.0030 -0.0037 0.0978 -0.1000 -0.0989 0.0795 0.0022 0.0152 0.0437 -0.0136 -0.0109 0.0078 -0.0054 0.0598 0.0446 0.0267 0.0028 -0.0045 -0.0192 0.0062 0.0073 -0.0194 0.0030 -0.0019 -0.0128 457. (0.00127) RY ( 5) S 6 s( 10.20%)p 2.12( 21.66%)d 5.74( 58.56%) f 0.93( 9.46%)g 0.01( 0.13%) 0.0000 0.0000 -0.0041 0.3158 0.0468 -0.0063 0.0023 -0.0001 -0.0003 0.0000 0.0286 0.0710 0.2145 0.0113 -0.0008 0.0000 0.0001 0.2885 0.2119 0.0032 -0.0003 0.0000 0.0031 -0.1908 0.0011 0.0095 -0.0006 -0.3247 0.3230 0.0050 -0.0037 -0.1701 0.0826 -0.0213 0.0040 -0.1502 -0.1749 -0.0179 0.0054 0.2020 -0.1235 -0.0128 0.0055 0.2345 -0.4181 0.0042 0.0008 -0.1977 0.1212 0.0632 -0.0080 0.0559 -0.0158 -0.0778 0.0031 0.0899 -0.0610 0.0895 -0.0434 0.0670 0.0331 0.0019 -0.0118 0.0138 -0.0133 0.0016 0.0139 -0.0195 0.0026 -0.0142 458. (0.00105) RY ( 6) S 6 s( 5.29%)p 4.91( 25.94%)d12.24( 64.69%) f 0.76( 4.01%)g 0.01( 0.08%) 0.0000 0.0000 0.0062 0.1593 0.1654 -0.0065 -0.0054 -0.0004 -0.0003 0.0000 0.0368 0.0883 -0.0085 0.0022 0.0012 0.0000 0.0213 0.2548 0.1236 -0.0420 0.0002 0.0000 -0.0122 -0.3310 -0.2409 -0.0005 -0.0004 0.2412 0.1707 -0.0031 0.0010 0.4545 -0.3034 0.0104 -0.0024 0.1092 -0.2731 0.0110 0.0014 0.2563 0.0309 0.0184 -0.0064 -0.2306 0.2320 0.0112 0.0013 0.1393 0.0012 -0.0317 0.0420 -0.0328 0.0568 -0.0836 -0.0143 -0.0193 -0.0514 -0.0523 -0.0268 0.0036 -0.0006 -0.0156 0.0046 -0.0035 0.0086 0.0122 0.0049 -0.0093 -0.0089 0.0087 459. (0.00068) RY ( 7) S 6 s( 4.73%)p 6.03( 28.55%)d12.49( 59.11%) f 1.59( 7.50%)g 0.02( 0.11%) 0.0000 0.0000 -0.0124 0.2159 -0.0231 0.0015 0.0000 0.0003 0.0001 0.0000 0.0234 -0.3950 -0.1515 0.0002 0.0001 0.0000 -0.0061 0.3059 -0.0849 0.0162 -0.0007 0.0000 -0.0148 -0.0520 -0.0403 0.0181 -0.0016 0.0426 -0.4171 0.0086 -0.0004 -0.3164 0.2721 0.0171 -0.0054 0.0137 -0.2618 0.0145 -0.0049 0.0858 -0.2289 -0.0158 0.0065 -0.3302 0.0521 -0.0010 -0.0011 0.0115 -0.0034 -0.0311 0.0174 -0.1514 0.0491 -0.1236 0.0766 -0.0843 0.0491 0.0062 -0.0072 0.1306 -0.0212 0.0027 -0.0082 0.0067 -0.0118 0.0182 0.0015 -0.0041 0.0009 -0.0225 460. (0.00060) RY ( 8) S 6 s( 2.83%)p 3.04( 8.60%)d27.56( 78.04%) f 3.63( 10.28%)g 0.09( 0.24%) 0.0000 0.0000 0.0069 0.0802 0.1476 -0.0075 0.0023 0.0007 0.0002 0.0000 -0.0098 0.0441 0.1223 0.0209 -0.0003 0.0000 -0.0122 0.0918 -0.1399 0.0218 0.0006 0.0000 -0.0213 -0.1670 -0.1069 0.0129 -0.0005 -0.0295 0.0992 -0.0261 -0.0025 -0.1234 0.1507 -0.0692 0.0063 0.0749 -0.0411 0.0163 -0.0048 -0.4212 0.5585 -0.0013 0.0111 -0.4246 -0.2210 0.0060 -0.0059 0.0068 0.0804 -0.1159 0.0540 0.0063 -0.0372 0.1337 -0.1074 0.0021 -0.0200 0.1065 -0.0526 -0.1544 0.1040 0.0060 -0.0070 0.0169 -0.0104 0.0174 0.0165 -0.0261 0.0061 -0.0259 461. (0.00045) RY ( 9) S 6 s( 3.12%)p 1.78( 5.55%)d27.12( 84.57%) f 2.06( 6.42%)g 0.11( 0.34%) 0.0000 0.0000 0.0106 -0.1095 0.1366 0.0209 0.0018 0.0007 0.0003 0.0000 -0.0151 0.0139 -0.0919 -0.0599 0.0028 0.0000 0.0238 0.0853 0.0847 -0.0130 0.0021 0.0000 -0.0160 -0.0422 0.1582 -0.0287 0.0038 0.0709 -0.3601 0.0031 -0.0048 -0.0369 -0.1073 0.0154 -0.0036 0.5916 -0.1882 0.0105 -0.0026 0.1332 0.3045 0.0285 0.0022 0.4102 -0.1803 -0.0136 -0.0027 -0.1039 0.0250 -0.0774 0.0482 -0.0471 -0.0104 -0.0594 -0.0272 -0.0336 -0.0185 0.1820 -0.0191 -0.0052 0.0540 0.0085 0.0339 -0.0046 0.0143 0.0021 -0.0306 0.0134 -0.0279 -0.0030 462. (0.00024) RY (10) S 6 s( 5.52%)p 2.72( 15.05%)d12.16( 67.17%) f 2.18( 12.03%)g 0.04( 0.23%) 0.0000 0.0000 -0.0052 0.1917 0.1353 0.0093 0.0087 0.0009 -0.0001 0.0000 -0.0011 -0.0037 0.0427 -0.0570 0.0005 0.0000 -0.0111 0.2311 -0.2035 0.0552 -0.0010 0.0000 0.0347 -0.1480 0.1488 -0.0467 0.0017 0.1886 -0.3865 0.0062 -0.0051 0.1780 -0.1275 0.0029 0.0013 -0.5293 0.2844 -0.0582 0.0115 0.0335 0.0981 0.0644 -0.0049 0.2197 -0.1042 -0.0097 -0.0032 -0.0273 0.0044 -0.3048 0.0897 0.0526 -0.0012 0.0448 -0.0246 0.0053 -0.0077 0.0097 0.0195 -0.1021 0.0467 0.0066 0.0242 0.0032 0.0108 0.0112 -0.0311 0.0041 -0.0127 -0.0166 463. (0.00019) RY (11) S 6 s( 33.49%)p 0.97( 32.33%)d 0.79( 26.38%) f 0.23( 7.62%)g 0.01( 0.18%) 0.0000 0.0000 0.0082 0.5435 -0.1979 0.0095 -0.0110 0.0005 0.0001 0.0000 0.0072 0.5016 -0.0210 0.0011 -0.0026 0.0000 0.0082 -0.2451 0.0397 0.0225 -0.0021 0.0000 -0.0170 0.0905 -0.0210 0.0045 0.0016 0.0746 -0.2708 0.0085 -0.0044 0.2074 0.0599 -0.0314 0.0117 0.1662 0.0318 0.0123 0.0004 -0.1831 -0.1539 -0.0086 -0.0026 -0.1193 -0.1907 0.0217 -0.0020 -0.0411 0.0688 0.0102 -0.0388 -0.0056 -0.0490 -0.0827 -0.0109 -0.0933 0.0645 0.0075 0.0141 0.2044 -0.0625 -0.0035 -0.0179 0.0206 0.0117 -0.0052 0.0117 0.0034 -0.0271 0.0046 464. (0.00013) RY (12) S 6 s( 8.19%)p 2.05( 16.80%)d 3.84( 31.44%) f 5.26( 43.06%)g 0.06( 0.51%) 0.0000 0.0000 0.0029 0.2142 0.1895 0.0058 0.0077 0.0002 -0.0006 0.0000 -0.0052 -0.0545 0.0440 -0.0408 0.0005 0.0000 0.0082 0.1670 0.0636 0.0320 -0.0011 0.0000 -0.0097 0.0942 0.3452 0.0160 0.0030 0.0506 0.1855 -0.0297 0.0010 -0.0330 0.0548 0.0623 -0.0089 0.2436 0.3579 -0.0094 0.0001 -0.0713 -0.1697 0.0025 0.0076 -0.1020 0.1529 -0.1144 0.0134 0.2744 -0.1530 -0.0516 0.0161 0.2256 -0.1269 -0.2400 0.1066 0.1040 -0.0506 0.3790 -0.1603 -0.0991 0.0236 0.0145 0.0307 -0.0101 0.0463 -0.0077 -0.0326 0.0147 -0.0178 0.0030 465. (0.00010) RY (13) S 6 s( 1.21%)p23.58( 28.55%)d22.61( 27.38%) f34.76( 42.09%)g 0.63( 0.77%) 466. (0.00007) RY (14) S 6 s( 11.21%)p 1.38( 15.42%)d 1.31( 14.69%) f 5.22( 58.56%)g 0.01( 0.13%) 467. (0.00005) RY (15) S 6 s( 9.52%)p 4.22( 40.21%)d 3.41( 32.43%) f 1.82( 17.35%)g 0.05( 0.49%) 468. (0.00004) RY (16) S 6 s( 4.84%)p 4.51( 21.85%)d 5.91( 28.61%) f 9.11( 44.10%)g 0.12( 0.60%) 469. (0.00004) RY (17) S 6 s( 7.08%)p 7.88( 55.79%)d 2.23( 15.81%) f 2.86( 20.22%)g 0.16( 1.10%) 470. (0.00003) RY (18) S 6 s( 9.63%)p 2.13( 20.48%)d 0.63( 6.10%) f 6.39( 61.51%)g 0.24( 2.27%) 471. (0.00002) RY (19) S 6 s( 33.12%)p 1.00( 33.15%)d 0.19( 6.18%) f 0.74( 24.65%)g 0.09( 2.90%) 472. (0.00001) RY (20) S 6 s( 2.99%)p 9.79( 29.24%)d10.95( 32.70%) f11.11( 33.18%)g 0.63( 1.89%) 473. (0.00001) RY (21) S 6 s( 4.27%)p 4.14( 17.69%)d 2.71( 11.60%) f14.91( 63.73%)g 0.63( 2.70%) 474. (0.00001) RY (22) S 6 s( 1.39%)p34.69( 48.24%)d17.62( 24.51%) f15.32( 21.30%)g 3.28( 4.56%) 475. (0.00001) RY (23) S 6 s( 4.95%)p 4.31( 21.33%)d 3.41( 16.88%) f10.76( 53.32%)g 0.71( 3.51%) 476. (0.00001) RY (24) S 6 s( 9.17%)p 0.68( 6.21%)d 2.06( 18.89%) f 7.10( 65.16%)g 0.06( 0.56%) 477. (0.00000) RY (25) S 6 s( 1.76%)p10.40( 18.29%)d17.33( 30.46%) f26.63( 46.80%)g 1.53( 2.69%) 478. (0.00000) RY (26) S 6 s( 2.23%)p10.49( 23.41%)d 8.20( 18.30%) f20.40( 45.55%)g 4.70( 10.50%) 479. (0.00000) RY (27) S 6 s( 4.31%)p 2.35( 10.11%)d 8.41( 36.22%) f 4.11( 17.71%)g 7.35( 31.66%) 480. (0.00000) RY (28) S 6 s( 13.93%)p 0.22( 3.10%)d 2.51( 34.99%) f 1.10( 15.29%)g 2.35( 32.69%) 481. (0.00000) RY (29) S 6 s( 0.74%)p 6.10( 4.54%)d31.78( 23.65%) f65.89( 49.04%)g29.58( 22.02%) 482. (0.00000) RY (30) S 6 s( 7.92%)p 0.59( 4.71%)d 3.35( 26.52%) f 3.38( 26.77%)g 4.30( 34.07%) 483. (0.00000) RY (31) S 6 s( 5.28%)p 1.10( 5.80%)d 2.76( 14.60%) f 2.37( 12.54%)g11.70( 61.78%) 484. (0.00000) RY (32) S 6 s( 2.52%)p 1.33( 3.36%)d12.62( 31.80%) f18.01( 45.39%)g 6.72( 16.93%) 485. (0.00000) RY (33) S 6 s( 7.50%)p 0.85( 6.36%)d 3.72( 27.92%) f 4.45( 33.41%)g 3.31( 24.82%) 486. (0.00000) RY (34) S 6 s( 3.95%)p 2.22( 8.78%)d 7.95( 31.44%) f10.21( 40.38%)g 3.91( 15.45%) 487. (0.00000) RY (35) S 6 s( 0.50%)p41.89( 20.79%)d34.93( 17.33%) f62.89( 31.21%)g60.81( 30.18%) 488. (0.00000) RY (36) S 6 s( 1.36%)p29.55( 40.16%)d19.00( 25.83%) f14.51( 19.73%)g 9.51( 12.92%) 489. (0.00000) RY (37) S 6 s( 1.99%)p11.05( 21.97%)d23.29( 46.32%) f 7.29( 14.50%)g 7.65( 15.22%) 490. (0.00000) RY (38) S 6 s( 0.99%)p29.55( 29.32%)d37.75( 37.46%) f13.81( 13.70%)g18.67( 18.53%) 491. (0.00000) RY (39) S 6 s( 0.36%)p76.99( 28.06%)d97.50( 35.53%) f73.37( 26.74%)g25.55( 9.31%) 492. (0.00000) RY (40) S 6 s( 0.67%)p24.87( 16.64%)d99.99( 71.99%) f15.50( 10.37%)g 0.49( 0.33%) 493. (0.00000) RY (41) S 6 s( 3.81%)p 1.20( 4.55%)d18.60( 70.78%) f 4.92( 18.72%)g 0.56( 2.14%) 494. (0.00000) RY (42) S 6 s( 99.13%)p 0.00( 0.47%)d 0.00( 0.21%) f 0.00( 0.05%)g 0.00( 0.14%) 495. (0.00000) RY (43) S 6 s( 88.79%)p 0.11( 9.60%)d 0.01( 0.85%) f 0.00( 0.22%)g 0.01( 0.54%) 496. (0.00000) RY (44) S 6 s( 7.12%)p11.81( 84.10%)d 0.72( 5.11%) f 0.24( 1.68%)g 0.28( 1.99%) 497. (0.00000) RY (45) S 6 s( 3.60%)p21.70( 78.14%)d 3.84( 13.84%) f 0.49( 1.76%)g 0.74( 2.66%) 498. (0.00000) RY (46) S 6 s( 45.37%)p 0.49( 22.17%)d 0.23( 10.41%) f 0.34( 15.28%)g 0.15( 6.76%) 499. (0.00000) RY (47) S 6 s( 7.11%)p 1.56( 11.07%)d 5.49( 39.02%) f 1.82( 12.97%)g 4.19( 29.83%) 500. (0.00000) RY (48) S 6 s( 14.06%)p 2.42( 34.01%)d 2.07( 29.13%) f 0.47( 6.58%)g 1.15( 16.23%) 501. (0.00000) RY (49) S 6 s( 4.66%)p 3.38( 15.76%)d 5.28( 24.63%) f 2.72( 12.68%)g 9.06( 42.26%) 502. (0.00000) RY (50) S 6 s( 6.96%)p 1.96( 13.64%)d 1.99( 13.83%) f 3.91( 27.23%)g 5.50( 38.33%) 503. (0.00000) RY (51) S 6 s( 14.78%)p 1.05( 15.49%)d 1.68( 24.79%) f 0.62( 9.16%)g 2.42( 35.79%) 504. (0.00000) RY (52) S 6 s( 1.14%)p13.18( 15.08%)d24.13( 27.60%) f29.68( 33.95%)g19.43( 22.22%) 505. (0.00000) RY (53) S 6 s( 14.10%)p 0.55( 7.72%)d 1.14( 16.08%) f 2.24( 31.58%)g 2.17( 30.53%) 506. (0.00000) RY (54) S 6 s( 1.43%)p 6.91( 9.88%)d19.93( 28.49%) f17.04( 24.37%)g25.06( 35.83%) 507. (0.00000) RY (55) S 6 s( 8.38%)p 0.90( 7.53%)d 6.39( 53.56%) f 0.79( 6.58%)g 2.86( 23.95%) 508. (0.00000) RY (56) S 6 s( 1.95%)p 2.84( 5.53%)d14.66( 28.56%) f 5.80( 11.31%)g27.02( 52.65%) 509. (0.00000) RY (57) S 6 s( 1.39%)p 2.72( 3.79%)d16.66( 23.17%) f24.84( 34.55%)g26.67( 37.10%) 510. (0.00000) RY (58) S 6 s( 11.23%)p 0.25( 2.85%)d 1.67( 18.77%) f 2.56( 28.71%)g 3.42( 38.44%) 511. (0.00000) RY (59) S 6 s( 3.07%)p 0.69( 2.10%)d10.87( 33.32%) f 3.20( 9.82%)g16.86( 51.69%) 512. (0.00000) RY (60) S 6 s( 3.05%)p 4.15( 12.66%)d10.20( 31.10%) f 7.69( 23.46%)g 9.75( 29.74%) 513. (0.00000) RY (61) S 6 s( 12.76%)p 0.28( 3.53%)d 1.81( 23.03%) f 1.76( 22.51%)g 2.99( 38.16%) 514. (0.00237) RY ( 1) C 7 s( 17.86%)p 3.80( 67.77%)d 0.72( 12.78%) f 0.08( 1.50%)g 0.00( 0.09%) 0.0000 0.0067 0.4219 -0.0220 0.0028 -0.0066 0.0000 0.0003 -0.2286 0.0566 -0.0102 -0.0058 0.6322 -0.0808 0.0030 -0.0133 0.4638 -0.0214 -0.0130 0.0840 0.0409 0.0124 -0.0105 -0.0379 0.0005 -0.2209 0.1954 -0.0114 0.0525 -0.0467 0.0027 -0.1009 0.1231 0.0010 0.0490 -0.0283 0.0252 -0.0064 0.0796 -0.0251 -0.0269 0.0117 0.0417 -0.0326 -0.0045 -0.0004 0.0141 -0.0170 -0.0006 -0.0203 -0.0056 -0.0173 0.0064 -0.0009 0.0079 -0.0039 0.0053 515. (0.00090) RY ( 2) C 7 s( 34.49%)p 0.75( 25.81%)d 1.05( 36.28%) f 0.09( 3.04%)g 0.01( 0.39%) 0.0000 0.0165 0.5791 -0.0895 -0.0346 0.0061 0.0016 -0.0274 0.3626 -0.1170 0.0050 0.0059 -0.2560 0.0166 -0.0036 -0.0380 0.1729 -0.1208 -0.0183 0.0304 -0.0312 -0.0001 -0.4281 0.1257 0.0329 0.2633 -0.1064 0.0035 -0.1861 0.0682 0.0058 -0.1999 0.0153 0.0235 -0.0212 0.0152 0.1000 -0.0044 -0.0490 0.0126 0.0409 -0.0144 -0.0965 0.0214 0.0727 0.0007 -0.0007 0.0135 -0.0008 -0.0422 0.0140 -0.0402 0.0031 -0.0147 0.0047 0.0038 0.0010 516. (0.00080) RY ( 3) C 7 s( 0.01%)p99.99( 80.95%)d99.99( 17.41%) f99.99( 1.60%)g 2.27( 0.03%) 0.0000 -0.0006 0.0035 0.0058 0.0095 0.0006 0.0001 -0.0043 0.6610 -0.0083 0.0050 -0.0117 0.4790 -0.0923 0.0226 0.0089 -0.3646 0.0291 0.0009 0.1095 0.0331 0.0154 0.1681 -0.0182 0.0232 -0.0302 0.1507 0.0021 -0.2423 0.1942 -0.0308 0.0528 -0.0874 -0.0151 0.0119 0.0227 -0.0372 -0.0036 0.0422 -0.0305 0.0823 -0.0294 0.0165 -0.0260 0.0427 -0.0169 -0.0203 -0.0099 0.0093 0.0026 -0.0093 -0.0029 -0.0037 -0.0075 -0.0052 -0.0049 0.0002 517. (0.00043) RY ( 4) C 7 s( 12.10%)p 2.05( 24.82%)d 4.87( 58.99%) f 0.33( 3.94%)g 0.01( 0.16%) 0.0000 -0.0045 0.3369 -0.0683 0.0529 -0.0034 0.0005 0.0271 0.1552 0.2424 -0.0413 -0.0151 -0.3681 -0.1347 0.0457 0.0037 -0.0661 -0.0476 0.0184 0.3793 0.0225 0.0201 0.1018 -0.1646 -0.0181 -0.3010 0.1755 -0.0177 0.1754 -0.1680 0.0215 0.4730 0.0478 0.0046 -0.0197 -0.0353 -0.0026 -0.0047 0.1322 -0.0179 -0.0703 0.0287 0.0164 -0.0196 -0.1081 0.0025 -0.0371 -0.0204 -0.0003 0.0047 -0.0258 0.0223 0.0009 0.0140 0.0105 -0.0058 0.0052 518. (0.00022) RY ( 5) C 7 s( 1.33%)p10.61( 14.12%)d59.85( 79.65%) f 3.32( 4.42%)g 0.36( 0.48%) 0.0000 -0.0040 0.1135 -0.0194 0.0065 0.0005 0.0003 -0.0002 -0.0483 -0.2237 0.0119 -0.0115 -0.0897 -0.2622 0.0363 0.0054 -0.0209 0.0997 -0.0025 0.3799 0.0493 0.0217 0.4676 -0.0445 0.0178 0.4411 0.0580 0.0188 0.3092 -0.0212 -0.0104 -0.3655 0.0106 -0.0158 0.1182 0.0047 -0.1306 0.0088 0.0234 -0.0263 0.0468 -0.0217 -0.0560 -0.0222 0.0579 -0.0143 -0.0425 -0.0134 -0.0021 0.0408 -0.0300 -0.0117 -0.0258 -0.0285 0.0109 -0.0231 0.0021 519. (0.00015) RY ( 6) C 7 s( 2.52%)p14.97( 37.75%)d22.22( 56.05%) f 1.39( 3.52%)g 0.06( 0.16%) 0.0000 -0.0114 0.1294 -0.0880 0.0223 -0.0107 -0.0008 -0.0131 -0.4324 0.2423 -0.0002 -0.0036 0.1515 -0.1026 0.0277 -0.0013 -0.3103 -0.0275 0.0198 0.1407 0.1306 0.0076 -0.1361 -0.1291 0.0104 0.4589 -0.0410 0.0182 -0.4345 -0.0488 0.0114 0.2860 0.0505 -0.0035 0.1117 -0.0476 -0.0639 0.0186 -0.0142 0.0049 0.0434 0.0137 -0.0936 -0.0142 0.0658 0.0097 -0.0089 -0.0151 -0.0189 0.0005 -0.0281 0.0059 -0.0093 0.0126 0.0075 -0.0004 0.0118 520. (0.00011) RY ( 7) C 7 s( 3.59%)p13.08( 46.94%)d13.52( 48.54%) f 0.18( 0.64%)g 0.08( 0.28%) 0.0000 -0.0127 0.1836 0.0311 -0.0251 -0.0199 -0.0042 -0.0069 -0.2079 0.0771 0.0009 -0.0079 -0.0232 0.0709 0.0237 -0.0297 -0.5734 0.2761 0.0898 0.1550 -0.0449 0.0144 -0.2341 0.1482 -0.0466 -0.3630 0.0309 -0.0084 0.0474 0.0172 0.0005 -0.4636 0.1704 -0.0299 -0.0277 0.0108 -0.0106 0.0000 0.0390 0.0188 -0.0550 -0.0033 -0.0075 -0.0007 -0.0068 0.0119 -0.0117 0.0110 0.0103 0.0274 0.0264 0.0089 -0.0054 0.0123 -0.0297 0.0017 -0.0120 521. (0.00007) RY ( 8) C 7 s( 8.71%)p 2.42( 21.11%)d 6.02( 52.47%) f 2.01( 17.49%)g 0.03( 0.22%) 522. (0.00005) RY ( 9) C 7 s( 5.59%)p 3.32( 18.54%)d 4.30( 24.05%) f 8.47( 47.35%)g 0.80( 4.47%) 523. (0.00004) RY (10) C 7 s( 7.68%)p 2.38( 18.27%)d 7.38( 56.66%) f 2.22( 17.08%)g 0.04( 0.30%) 524. (0.00002) RY (11) C 7 s( 0.49%)p99.99( 67.23%)d46.41( 22.61%) f17.46( 8.50%)g 2.41( 1.17%) 525. (0.00001) RY (12) C 7 s( 1.74%)p17.75( 30.79%)d25.72( 44.63%) f11.97( 20.78%)g 1.19( 2.07%) 526. (0.00001) RY (13) C 7 s( 7.60%)p 3.39( 25.78%)d 7.10( 53.99%) f 1.62( 12.34%)g 0.04( 0.28%) 527. (0.00001) RY (14) C 7 s( 7.34%)p 4.48( 32.86%)d 4.03( 29.54%) f 3.89( 28.55%)g 0.23( 1.72%) 528. (0.00001) RY (15) C 7 s( 3.41%)p14.04( 47.90%)d 7.04( 24.02%) f 5.98( 20.39%)g 1.25( 4.28%) 529. (0.00001) RY (16) C 7 s( 11.27%)p 0.95( 10.74%)d 3.88( 43.80%) f 2.96( 33.35%)g 0.07( 0.83%) 530. (0.00001) RY (17) C 7 s( 21.21%)p 0.26( 5.42%)d 0.86( 18.32%) f 2.47( 52.41%)g 0.12( 2.64%) 531. (0.00000) RY (18) C 7 s( 2.91%)p 1.11( 3.22%)d 6.54( 19.06%) f 6.10( 17.76%)g19.58( 57.04%) 532. (0.00000) RY (19) C 7 s( 9.15%)p 1.51( 13.86%)d 3.87( 35.43%) f 1.64( 14.99%)g 2.90( 26.57%) 533. (0.00000) RY (20) C 7 s( 1.34%)p21.09( 28.31%)d 9.04( 12.13%) f22.78( 30.58%)g20.58( 27.63%) 534. (0.00000) RY (21) C 7 s( 21.86%)p 0.33( 7.25%)d 1.73( 37.82%) f 0.54( 11.75%)g 0.98( 21.32%) 535. (0.00000) RY (22) C 7 s( 16.60%)p 1.44( 23.98%)d 0.71( 11.71%) f 1.36( 22.58%)g 1.51( 25.13%) 536. (0.00000) RY (23) C 7 s( 16.40%)p 0.55( 9.06%)d 1.28( 21.04%) f 2.25( 36.87%)g 1.01( 16.63%) 537. (0.00000) RY (24) C 7 s( 3.40%)p 0.60( 2.04%)d11.34( 38.55%) f 7.11( 24.16%)g 9.37( 31.85%) 538. (0.00000) RY (25) C 7 s( 19.69%)p 0.22( 4.40%)d 0.49( 9.64%) f 0.59( 11.58%)g 2.78( 54.68%) 539. (0.00000) RY (26) C 7 s( 12.46%)p 0.63( 7.87%)d 1.98( 24.68%) f 1.62( 20.14%)g 2.80( 34.85%) 540. (0.00000) RY (27) C 7 s( 19.59%)p 0.62( 12.24%)d 1.03( 20.27%) f 1.40( 27.42%)g 1.04( 20.47%) 541. (0.00000) RY (28) C 7 s( 24.17%)p 0.30( 7.26%)d 0.92( 22.21%) f 0.84( 20.33%)g 1.08( 26.04%) 542. (0.00000) RY (29) C 7 s( 9.62%)p 3.27( 31.46%)d 1.92( 18.50%) f 1.38( 13.31%)g 2.82( 27.11%) 543. (0.00000) RY (30) C 7 s( 12.09%)p 2.07( 24.99%)d 1.94( 23.51%) f 2.29( 27.65%)g 0.97( 11.77%) 544. (0.00000) RY (31) C 7 s( 20.47%)p 2.10( 42.89%)d 0.82( 16.72%) f 0.33( 6.72%)g 0.65( 13.20%) 545. (0.00000) RY (32) C 7 s( 2.11%)p 7.43( 15.71%)d18.10( 38.25%) f10.46( 22.11%)g10.33( 21.82%) 546. (0.00000) RY (33) C 7 s( 3.01%)p 2.36( 7.09%)d 2.55( 7.67%) f24.36( 73.21%)g 3.00( 9.02%) 547. (0.00000) RY (34) C 7 s( 3.28%)p 3.33( 10.92%)d11.72( 38.46%) f11.39( 37.36%)g 3.04( 9.98%) 548. (0.00000) RY (35) C 7 s( 2.30%)p 3.07( 7.06%)d19.82( 45.55%) f15.61( 35.87%)g 4.02( 9.23%) 549. (0.00000) RY (36) C 7 s( 1.42%)p 4.29( 6.08%)d43.60( 61.82%) f15.30( 21.70%)g 6.34( 8.99%) 550. (0.00000) RY (37) C 7 s( 4.68%)p 1.28( 5.98%)d 5.39( 25.23%) f12.11( 56.70%)g 1.58( 7.41%) 551. (0.00000) RY (38) C 7 s( 2.32%)p 2.46( 5.72%)d 9.78( 22.72%) f20.22( 46.96%)g 9.59( 22.28%) 552. (0.00000) RY (39) C 7 s( 5.25%)p 2.37( 12.47%)d 8.74( 45.89%) f 5.85( 30.72%)g 1.08( 5.67%) 553. (0.00000) RY (40) C 7 s( 77.70%)p 0.02( 1.48%)d 0.02( 1.93%) f 0.19( 15.12%)g 0.05( 3.76%) 554. (0.00000) RY (41) C 7 s( 13.16%)p 0.12( 1.57%)d 0.78( 10.24%) f 5.13( 67.44%)g 0.58( 7.59%) 555. (0.00000) RY (42) C 7 s( 2.46%)p 1.06( 2.60%)d 9.53( 23.41%) f19.29( 47.39%)g 9.83( 24.15%) 556. (0.00000) RY (43) C 7 s( 1.74%)p 0.77( 1.33%)d 3.74( 6.51%) f36.55( 63.57%)g15.44( 26.85%) 557. (0.00000) RY (44) C 7 s( 1.56%)p 0.19( 0.29%)d16.57( 25.83%) f29.27( 45.63%)g17.12( 26.69%) 558. (0.00000) RY (45) C 7 s( 1.55%)p 1.89( 2.93%)d14.72( 22.86%) f 6.68( 10.38%)g40.10( 62.28%) 559. (0.00000) RY (46) C 7 s( 2.44%)p 0.93( 2.26%)d 3.08( 7.49%) f20.54( 50.01%)g15.52( 37.80%) 560. (0.00000) RY (47) C 7 s( 5.02%)p 0.14( 0.68%)d 1.86( 9.31%) f 9.96( 49.98%)g 6.98( 35.01%) 561. (0.00000) RY (48) C 7 s( 4.76%)p 0.25( 1.21%)d 4.39( 20.93%) f10.92( 52.01%)g 4.42( 21.08%) 562. (0.00000) RY (49) C 7 s( 0.41%)p 2.48( 1.01%)d99.99( 50.01%) f55.07( 22.38%)g64.48( 26.20%) 563. (0.00000) RY (50) C 7 s( 1.53%)p 1.01( 1.54%)d17.03( 25.98%) f23.20( 35.38%)g23.32( 35.58%) 564. (0.00000) RY (51) C 7 s( 21.74%)p 0.40( 8.61%)d 0.45( 9.85%) f 1.19( 25.88%)g 1.56( 33.91%) 565. (0.00000) RY (52) C 7 s( 5.04%)p 1.71( 8.63%)d 1.64( 8.24%) f 5.42( 27.31%)g10.08( 50.78%) 566. (0.00330) RY ( 1) C 8 s( 21.81%)p 3.09( 67.45%)d 0.44( 9.57%) f 0.05( 1.11%)g 0.00( 0.06%) 0.0000 0.0102 0.4665 -0.0183 -0.0001 -0.0037 0.0009 0.0137 -0.8133 0.0646 0.0010 0.0117 0.0277 -0.0743 0.0174 0.0013 -0.0434 -0.0103 0.0007 -0.1103 0.1389 0.0039 -0.0977 0.0592 -0.0061 -0.0264 -0.0011 0.0009 -0.0885 0.1315 -0.0034 0.1483 -0.0566 0.0109 0.0172 -0.0013 0.0424 -0.0132 0.0085 0.0083 -0.0153 0.0056 -0.0253 0.0060 0.0300 -0.0218 -0.0704 0.0382 -0.0078 0.0010 0.0060 -0.0140 0.0077 0.0119 -0.0008 -0.0044 0.0067 567. (0.00106) RY ( 2) C 8 s( 43.56%)p 0.87( 37.76%)d 0.39( 16.79%) f 0.04( 1.61%)g 0.01( 0.28%) 0.0000 0.0128 0.6553 -0.0766 -0.0100 0.0043 -0.0005 0.0113 0.3281 -0.0616 0.0060 0.0341 -0.4842 0.1089 0.0077 0.0072 -0.1345 0.0176 0.0008 -0.1036 -0.0198 0.0240 0.0350 -0.0246 0.0087 -0.0727 0.0373 0.0084 0.3452 -0.0996 -0.0271 0.1307 -0.0188 -0.0189 0.0362 -0.0047 0.0345 0.0048 0.0369 -0.0087 0.0237 -0.0092 0.0078 0.0012 0.0427 0.0039 0.0957 -0.0205 -0.0131 0.0094 0.0160 -0.0143 0.0166 0.0113 0.0090 -0.0048 0.0392 568. (0.00094) RY ( 3) C 8 s( 0.36%)p99.99( 84.96%)d36.54( 13.14%) f 4.10( 1.47%)g 0.19( 0.07%) 0.0000 0.0005 0.0597 -0.0042 -0.0039 0.0014 -0.0001 0.0091 -0.0284 0.0228 -0.0001 0.0033 -0.1557 0.0152 -0.0007 -0.0131 0.9065 -0.0382 0.0188 0.0247 -0.0134 0.0104 -0.2332 0.0459 -0.0352 0.0408 -0.2220 0.0036 0.1104 -0.0757 0.0080 -0.0564 -0.0197 -0.0151 -0.0284 0.0295 -0.0198 -0.0031 0.0205 -0.0242 -0.0829 0.0356 -0.0409 -0.0208 0.0076 -0.0047 0.0360 -0.0056 -0.0014 0.0033 -0.0157 -0.0001 0.0060 -0.0057 -0.0051 0.0049 0.0172 569. (0.00027) RY ( 4) C 8 s( 8.39%)p 2.20( 18.45%)d 7.96( 66.80%) f 0.68( 5.69%)g 0.08( 0.66%) 0.0000 -0.0112 0.2818 0.0464 0.0415 -0.0224 0.0045 0.0054 0.1633 0.1460 -0.0468 -0.0347 -0.0458 -0.3455 0.0272 0.0010 -0.0032 -0.1031 -0.0157 0.7346 0.0528 -0.0195 -0.0511 -0.0013 -0.0079 -0.1274 0.0136 -0.0075 -0.2067 0.2033 0.0017 -0.0970 0.1122 0.0009 -0.0714 -0.0049 -0.0404 -0.0270 -0.0211 0.0291 0.0000 0.0188 -0.0270 -0.0080 -0.1181 -0.0237 -0.1750 0.0429 0.0068 0.0144 -0.0044 0.0319 0.0195 -0.0182 -0.0520 0.0142 -0.0417 570. (0.00023) RY ( 5) C 8 s( 1.69%)p16.71( 28.24%)d39.79( 67.25%) f 1.43( 2.41%)g 0.24( 0.40%) 0.0000 0.0032 -0.0146 0.1280 0.0170 -0.0004 0.0008 0.0160 0.1501 -0.3309 -0.0456 -0.0224 -0.3693 0.0025 0.0316 0.0049 0.0058 0.0988 -0.0185 -0.1600 0.1309 -0.0338 -0.2243 0.0202 0.0123 0.3207 0.0709 -0.0264 -0.6352 0.0883 0.0009 0.2296 -0.0715 0.0058 -0.0557 -0.0247 -0.0324 -0.0267 -0.0308 0.0113 -0.0132 0.0009 -0.0439 0.0009 0.0076 -0.0142 -0.1233 -0.0054 0.0339 0.0324 0.0172 0.0243 0.0135 -0.0208 0.0115 -0.0113 -0.0068 571. (0.00018) RY ( 6) C 8 s( 0.15%)p99.99( 21.53%)d99.99( 76.78%) f 7.07( 1.07%)g 3.17( 0.48%) 0.0000 0.0033 0.0049 0.0377 -0.0070 0.0024 0.0005 -0.0111 -0.0167 -0.2264 0.0389 -0.0016 -0.1079 0.1514 -0.0109 -0.0020 -0.0007 -0.3560 0.0264 -0.1742 -0.0650 -0.0082 -0.0914 -0.0349 -0.0083 -0.7218 0.0269 -0.0078 -0.2929 -0.0287 0.0075 -0.3371 -0.0345 -0.0133 0.0257 0.0043 -0.0357 -0.0035 -0.0590 -0.0161 0.0209 0.0101 -0.0406 -0.0052 0.0512 -0.0018 -0.0022 -0.0110 -0.0201 -0.0140 -0.0281 0.0075 -0.0026 -0.0223 -0.0408 -0.0212 0.0269 572. (0.00011) RY ( 7) C 8 s( 1.98%)p 3.55( 7.04%)d32.24( 64.00%) f13.50( 26.80%)g 0.09( 0.18%) 0.0000 -0.0012 0.1334 -0.0380 0.0186 -0.0158 0.0037 -0.0278 -0.0514 -0.1415 0.0856 -0.0100 -0.0522 0.0441 -0.0151 0.0132 0.1797 0.0189 -0.0428 -0.0269 -0.1236 -0.0030 0.6991 -0.0168 0.0123 0.1165 -0.1750 0.0421 -0.2089 0.1015 -0.0239 -0.1826 0.0294 -0.0035 -0.1469 0.0315 0.1306 -0.0216 0.0791 -0.0195 0.2486 -0.0134 0.3731 -0.0357 0.0713 -0.0003 -0.1160 0.0156 -0.0203 -0.0140 0.0236 0.0173 -0.0043 -0.0059 0.0090 -0.0091 -0.0084 573. (0.00009) RY ( 8) C 8 s( 11.00%)p 5.12( 56.31%)d 2.20( 24.18%) f 0.70( 7.69%)g 0.07( 0.82%) 574. (0.00007) RY ( 9) C 8 s( 4.21%)p 4.90( 20.65%)d14.84( 62.54%) f 2.79( 11.77%)g 0.20( 0.82%) 575. (0.00005) RY (10) C 8 s( 10.75%)p 2.63( 28.27%)d 2.92( 31.34%) f 2.56( 27.47%)g 0.20( 2.19%) 576. (0.00003) RY (11) C 8 s( 0.80%)p46.68( 37.27%)d64.67( 51.64%) f 9.57( 7.64%)g 3.32( 2.65%) 577. (0.00002) RY (12) C 8 s( 0.26%)p99.99( 36.66%)d99.99( 41.65%) f78.28( 20.54%)g 3.40( 0.89%) 578. (0.00002) RY (13) C 8 s( 0.11%)p99.99( 35.30%)d99.99( 53.50%) f97.25( 10.71%)g 3.50( 0.39%) 579. (0.00001) RY (14) C 8 s( 3.58%)p 3.09( 11.06%)d 9.65( 34.51%) f13.42( 48.00%)g 0.80( 2.86%) 580. (0.00001) RY (15) C 8 s( 3.07%)p 9.08( 27.87%)d13.18( 40.46%) f 8.68( 26.64%)g 0.64( 1.96%) 581. (0.00001) RY (16) C 8 s( 20.58%)p 0.54( 11.07%)d 1.55( 32.00%) f 1.72( 35.33%)g 0.05( 1.03%) 582. (0.00000) RY (17) C 8 s( 6.57%)p 7.30( 47.95%)d 2.23( 14.65%) f 4.09( 26.87%)g 0.60( 3.96%) 583. (0.00000) RY (18) C 8 s( 8.66%)p 1.01( 8.77%)d 4.84( 41.91%) f 2.06( 17.81%)g 2.64( 22.85%) 584. (0.00000) RY (19) C 8 s( 11.24%)p 1.37( 15.34%)d 1.78( 20.01%) f 2.06( 23.18%)g 2.69( 30.23%) 585. (0.00000) RY (20) C 8 s( 3.94%)p 4.47( 17.62%)d 7.65( 30.10%) f 3.59( 14.13%)g 8.69( 34.21%) 586. (0.00000) RY (21) C 8 s( 27.37%)p 0.04( 1.09%)d 1.20( 32.79%) f 0.86( 23.54%)g 0.56( 15.22%) 587. (0.00000) RY (22) C 8 s( 24.90%)p 0.49( 12.21%)d 0.30( 7.37%) f 0.27( 6.74%)g 1.96( 48.79%) 588. (0.00000) RY (23) C 8 s( 2.38%)p 7.18( 17.07%)d16.81( 39.99%) f10.94( 26.02%)g 6.11( 14.54%) 589. (0.00000) RY (24) C 8 s( 13.59%)p 3.04( 41.34%)d 0.94( 12.76%) f 1.47( 20.01%)g 0.90( 12.30%) 590. (0.00000) RY (25) C 8 s( 7.92%)p 2.69( 21.29%)d 2.87( 22.77%) f 2.37( 18.79%)g 3.69( 29.22%) 591. (0.00000) RY (26) C 8 s( 4.66%)p 1.57( 7.32%)d 7.50( 34.95%) f 5.59( 26.02%)g 5.81( 27.06%) 592. (0.00000) RY (27) C 8 s( 10.41%)p 2.27( 23.60%)d 2.58( 26.82%) f 1.60( 16.65%)g 2.17( 22.53%) 593. (0.00000) RY (28) C 8 s( 28.12%)p 0.26( 7.44%)d 0.91( 25.70%) f 1.03( 28.96%)g 0.35( 9.78%) 594. (0.00000) RY (29) C 8 s( 10.53%)p 0.88( 9.28%)d 2.30( 24.23%) f 2.85( 30.02%)g 2.46( 25.95%) 595. (0.00000) RY (30) C 8 s( 20.24%)p 0.08( 1.54%)d 1.38( 28.01%) f 1.50( 30.28%)g 0.98( 19.93%) 596. (0.00000) RY (31) C 8 s( 21.95%)p 0.27( 6.02%)d 1.62( 35.61%) f 0.99( 21.74%)g 0.67( 14.68%) 597. (0.00000) RY (32) C 8 s( 12.41%)p 4.63( 57.41%)d 0.70( 8.73%) f 0.84( 10.39%)g 0.89( 11.06%) 598. (0.00000) RY (33) C 8 s( 0.99%)p 5.21( 5.15%)d51.17( 50.58%) f18.00( 17.79%)g25.80( 25.50%) 599. (0.00000) RY (34) C 8 s( 8.88%)p 1.04( 9.21%)d 1.25( 11.06%) f 6.34( 56.31%)g 1.64( 14.54%) 600. (0.00000) RY (35) C 8 s( 4.07%)p 1.17( 4.75%)d 6.75( 27.50%) f10.24( 41.70%)g 5.40( 21.98%) 601. (0.00000) RY (36) C 8 s( 3.81%)p 3.03( 11.55%)d 8.12( 30.91%) f10.24( 38.99%)g 3.87( 14.74%) 602. (0.00000) RY (37) C 8 s( 1.61%)p 0.87( 1.40%)d35.49( 57.05%) f14.53( 23.35%)g10.32( 16.59%) 603. (0.00000) RY (38) C 8 s( 5.23%)p 0.64( 3.36%)d 3.77( 19.68%) f12.70( 66.35%)g 1.03( 5.38%) 604. (0.00000) RY (39) C 8 s( 3.22%)p 1.88( 6.04%)d 8.69( 27.97%) f17.70( 56.96%)g 1.81( 5.81%) 605. (0.00000) RY (40) C 8 s( 85.29%)p 0.01( 0.80%)d 0.02( 2.07%) f 0.09( 7.43%)g 0.05( 4.41%) 606. (0.00000) RY (41) C 8 s( 0.74%)p 3.06( 2.27%)d12.99( 9.60%) f90.82( 67.14%)g27.39( 20.25%) 607. (0.00000) RY (42) C 8 s( 0.38%)p 6.91( 2.66%)d37.47( 14.40%) f99.99( 69.75%)g33.33( 12.81%) 608. (0.00000) RY (43) C 8 s( 2.31%)p 0.79( 1.84%)d 3.22( 7.44%) f16.98( 39.22%)g21.29( 49.19%) 609. (0.00000) RY (44) C 8 s( 1.04%)p 0.94( 0.98%)d 1.45( 1.51%) f69.82( 72.77%)g22.74( 23.70%) 610. (0.00000) RY (45) C 8 s( 1.71%)p 2.73( 4.68%)d15.94( 27.32%) f11.19( 19.17%)g27.49( 47.11%) 611. (0.00000) RY (46) C 8 s( 4.54%)p 1.47( 6.66%)d 1.38( 6.29%) f10.23( 46.50%)g 7.92( 36.01%) 612. (0.00000) RY (47) C 8 s( 10.13%)p 0.33( 3.36%)d 0.98( 9.94%) f 2.90( 29.34%)g 4.66( 47.23%) 613. (0.00000) RY (48) C 8 s( 0.75%)p 2.45( 1.84%)d21.02( 15.75%) f62.11( 46.53%)g46.91( 35.14%) 614. (0.00000) RY (49) C 8 s( 6.19%)p 0.69( 4.29%)d 2.43( 15.07%) f 2.53( 15.66%)g 9.50( 58.79%) 615. (0.00000) RY (50) C 8 s( 3.19%)p 0.84( 2.67%)d 7.02( 22.41%) f14.29( 45.60%)g 8.19( 26.14%) 616. (0.00000) RY (51) C 8 s( 4.22%)p 0.14( 0.57%)d 6.32( 26.68%) f 9.21( 38.88%)g 7.02( 29.65%) 617. (0.00000) RY (52) C 8 s( 4.71%)p 0.34( 1.61%)d 4.97( 23.43%) f 4.95( 23.31%)g 9.96( 46.94%) 618. (0.00228) RY ( 1) C 9 s( 18.09%)p 3.80( 68.82%)d 0.64( 11.53%) f 0.08( 1.46%)g 0.01( 0.09%) 0.0000 0.0065 0.4248 -0.0190 0.0000 -0.0077 0.0000 -0.0033 -0.1598 0.0645 -0.0108 -0.0098 0.7175 -0.0862 0.0004 0.0112 -0.3683 0.0096 0.0130 0.0481 0.0749 0.0118 0.0704 -0.0055 0.0047 0.2013 -0.1940 0.0098 0.1017 -0.0962 0.0053 -0.0053 0.0664 0.0004 -0.0011 0.0137 0.0276 -0.0086 0.0672 -0.0206 0.0450 -0.0203 -0.0576 0.0364 -0.0263 0.0118 0.0175 -0.0209 0.0179 0.0048 0.0109 -0.0178 -0.0062 0.0060 0.0033 -0.0048 0.0050 619. (0.00091) RY ( 2) C 9 s( 31.05%)p 0.95( 29.49%)d 1.17( 36.47%) f 0.09( 2.69%)g 0.01( 0.30%) 0.0000 0.0155 0.5501 -0.0804 -0.0326 0.0081 0.0015 -0.0340 0.5055 -0.1318 0.0028 0.0003 -0.1065 -0.0135 -0.0067 0.0297 -0.0204 0.0876 0.0174 -0.0084 -0.0096 0.0089 0.3854 -0.1140 -0.0364 -0.1656 0.0684 -0.0103 -0.3491 0.1455 0.0045 -0.1608 -0.0209 0.0043 0.0414 -0.0206 0.0650 0.0080 -0.0348 0.0076 -0.0661 0.0238 0.0385 -0.0142 0.1104 -0.0105 -0.0142 0.0114 0.0126 0.0153 0.0033 -0.0395 -0.0119 0.0251 0.0126 0.0002 -0.0087 620. (0.00078) RY ( 3) C 9 s( 2.92%)p26.79( 78.31%)d 5.82( 17.00%) f 0.58( 1.69%)g 0.02( 0.07%) 0.0000 0.0038 0.1694 -0.0175 -0.0144 0.0009 0.0002 -0.0014 -0.4442 0.0387 -0.0159 0.0026 -0.5009 0.0441 -0.0028 0.0190 -0.5700 0.0756 -0.0078 -0.0744 -0.0550 -0.0090 0.2693 -0.1146 0.0193 -0.0713 0.1277 -0.0154 0.1349 -0.1386 0.0254 0.0465 0.1129 0.0275 0.0274 0.0294 0.0759 -0.0266 -0.0533 0.0113 0.0451 -0.0123 0.0241 -0.0261 -0.0391 0.0161 -0.0137 0.0219 -0.0083 0.0176 -0.0010 -0.0152 -0.0031 -0.0032 0.0012 0.0053 -0.0072 621. (0.00042) RY ( 4) C 9 s( 9.21%)p 2.56( 23.57%)d 6.89( 63.46%) f 0.39( 3.59%)g 0.02( 0.17%) 0.0000 -0.0023 0.2903 -0.0711 0.0526 -0.0053 0.0009 0.0227 0.2472 0.2103 -0.0324 -0.0202 -0.2933 -0.1930 0.0554 -0.0078 0.0242 0.0370 -0.0034 0.4412 0.0232 0.0261 -0.1890 0.1378 0.0123 0.1292 -0.1711 0.0129 0.1144 -0.1450 0.0079 0.5502 -0.0268 0.0130 0.0471 0.0140 -0.0410 -0.0112 0.1152 -0.0211 0.0526 -0.0291 -0.0124 0.0320 -0.0915 0.0082 -0.0669 -0.0155 0.0159 -0.0011 0.0126 0.0189 -0.0011 -0.0223 -0.0117 -0.0013 0.0169 622. (0.00020) RY ( 5) C 9 s( 0.11%)p99.99( 15.27%)d99.99( 80.44%) f33.78( 3.81%)g 3.23( 0.36%) 0.0000 0.0007 0.0309 0.0113 -0.0005 0.0066 0.0007 0.0028 0.1086 -0.2147 0.0012 -0.0101 -0.1341 -0.1794 0.0436 -0.0097 -0.1364 -0.1526 0.0266 0.4470 0.0227 0.0225 -0.1655 -0.0017 -0.0064 -0.1059 -0.0666 0.0080 0.4078 -0.0344 -0.0037 -0.6242 -0.0535 -0.0193 -0.1234 -0.0225 -0.0597 0.0249 0.0939 -0.0100 0.0160 0.0054 0.0140 0.0228 0.0677 -0.0168 -0.0567 -0.0115 -0.0137 -0.0353 0.0180 0.0236 -0.0225 0.0080 0.0068 -0.0251 -0.0084 623. (0.00013) RY ( 6) C 9 s( 4.35%)p10.73( 46.72%)d 9.82( 42.75%) f 1.38( 5.99%)g 0.04( 0.19%) 0.0000 -0.0153 0.1785 -0.1044 0.0090 -0.0213 -0.0019 -0.0150 -0.5340 0.1896 0.0224 -0.0059 0.0382 -0.1169 0.0453 0.0007 0.3409 -0.1048 -0.0308 0.3357 0.0730 0.0123 0.0344 0.0604 0.0090 -0.3524 0.0417 -0.0132 -0.4021 -0.0616 0.0073 -0.0796 0.0770 -0.0225 -0.1677 0.0435 -0.0284 0.0088 0.0869 -0.0060 0.0033 -0.0094 0.0604 0.0079 0.1146 0.0165 -0.0649 -0.0024 -0.0059 -0.0037 0.0244 0.0255 -0.0140 -0.0143 0.0099 0.0096 0.0019 624. (0.00011) RY ( 7) C 9 s( 2.72%)p 5.66( 15.38%)d29.04( 78.95%) f 0.98( 2.66%)g 0.11( 0.29%) 0.0000 -0.0031 0.0317 0.1541 -0.0482 -0.0108 -0.0026 -0.0165 -0.1463 0.1282 0.0364 -0.0256 -0.1712 0.1056 0.0467 0.0157 0.2538 -0.0775 -0.0191 0.1547 -0.0842 0.0322 0.2812 -0.2237 0.0403 0.7380 -0.1527 0.0290 -0.0572 0.1272 -0.0145 -0.1875 0.0498 -0.0254 0.0228 -0.0135 -0.0151 0.0056 0.0635 0.0099 0.0112 0.0257 0.0154 -0.0153 0.0999 -0.0209 -0.0983 0.0124 -0.0049 0.0015 -0.0326 -0.0080 0.0156 0.0136 0.0206 -0.0177 -0.0249 625. (0.00006) RY ( 8) C 9 s( 14.13%)p 2.45( 34.57%)d 2.88( 40.72%) f 0.72( 10.16%)g 0.03( 0.41%) 626. (0.00005) RY ( 9) C 9 s( 6.18%)p 3.57( 22.07%)d 3.47( 21.45%) f 7.36( 45.45%)g 0.79( 4.86%) 627. (0.00004) RY (10) C 9 s( 10.00%)p 0.77( 7.72%)d 5.78( 57.84%) f 2.35( 23.53%)g 0.09( 0.90%) 628. (0.00002) RY (11) C 9 s( 0.86%)p80.47( 68.83%)d20.31( 17.37%) f14.31( 12.24%)g 0.83( 0.71%) 629. (0.00002) RY (12) C 9 s( 4.16%)p 5.34( 22.18%)d14.57( 60.55%) f 2.88( 11.97%)g 0.27( 1.14%) 630. (0.00001) RY (13) C 9 s( 1.74%)p14.32( 24.85%)d25.78( 44.75%) f15.47( 26.85%)g 1.05( 1.82%) 631. (0.00001) RY (14) C 9 s( 6.78%)p 4.81( 32.60%)d 6.13( 41.60%) f 2.40( 16.28%)g 0.40( 2.74%) 632. (0.00001) RY (15) C 9 s( 10.63%)p 5.41( 57.52%)d 1.21( 12.89%) f 1.52( 16.20%)g 0.26( 2.76%) 633. (0.00001) RY (16) C 9 s( 25.11%)p 0.71( 17.72%)d 0.91( 22.90%) f 1.33( 33.30%)g 0.04( 0.98%) 634. (0.00000) RY (17) C 9 s( 2.94%)p 2.87( 8.45%)d 7.99( 23.49%) f21.55( 63.38%)g 0.59( 1.73%) 635. (0.00000) RY (18) C 9 s( 2.22%)p 3.26( 7.23%)d12.53( 27.76%) f26.56( 58.85%)g 1.78( 3.94%) 636. (0.00000) RY (19) C 9 s( 9.07%)p 0.48( 4.39%)d 2.63( 23.88%) f 2.87( 26.06%)g 4.04( 36.60%) 637. (0.00000) RY (20) C 9 s( 3.20%)p 0.92( 2.94%)d10.01( 32.00%) f 9.77( 31.24%)g 9.58( 30.62%) 638. (0.00000) RY (21) C 9 s( 41.07%)p 0.20( 8.10%)d 0.28( 11.42%) f 0.22( 9.20%)g 0.74( 30.22%) 639. (0.00000) RY (22) C 9 s( 11.23%)p 0.11( 1.22%)d 1.42( 16.00%) f 2.18( 24.48%)g 4.19( 47.06%) 640. (0.00000) RY (23) C 9 s( 2.79%)p 2.47( 6.91%)d15.74( 43.98%) f11.21( 31.33%)g 5.36( 14.99%) 641. (0.00000) RY (24) C 9 s( 5.02%)p 0.87( 4.38%)d 8.18( 41.09%) f 5.05( 25.35%)g 4.81( 24.16%) 642. (0.00000) RY (25) C 9 s( 2.13%)p20.86( 44.45%)d 7.26( 15.47%) f 6.18( 13.17%)g11.63( 24.78%) 643. (0.00000) RY (26) C 9 s( 13.34%)p 0.82( 10.92%)d 1.84( 24.60%) f 1.78( 23.80%)g 2.05( 27.33%) 644. (0.00000) RY (27) C 9 s( 15.11%)p 0.68( 10.34%)d 1.65( 24.97%) f 2.51( 37.98%)g 0.77( 11.61%) 645. (0.00000) RY (28) C 9 s( 9.41%)p 1.05( 9.90%)d 2.12( 19.96%) f 2.05( 19.26%)g 4.40( 41.46%) 646. (0.00000) RY (29) C 9 s( 10.19%)p 2.94( 29.97%)d 1.44( 14.65%) f 0.98( 9.95%)g 3.46( 35.24%) 647. (0.00000) RY (30) C 9 s( 25.49%)p 0.40( 10.14%)d 0.83( 21.26%) f 0.57( 14.42%)g 1.13( 28.70%) 648. (0.00000) RY (31) C 9 s( 20.48%)p 1.64( 33.52%)d 0.85( 17.32%) f 0.86( 17.53%)g 0.54( 11.14%) 649. (0.00000) RY (32) C 9 s( 10.65%)p 2.55( 27.14%)d 2.46( 26.25%) f 2.22( 23.69%)g 1.15( 12.26%) 650. (0.00000) RY (33) C 9 s( 6.88%)p 1.58( 10.89%)d 5.51( 37.96%) f 3.24( 22.34%)g 3.18( 21.92%) 651. (0.00000) RY (34) C 9 s( 9.07%)p 0.98( 8.87%)d 2.48( 22.51%) f 4.59( 41.62%)g 1.98( 17.94%) 652. (0.00000) RY (35) C 9 s( 6.95%)p 2.54( 17.64%)d 4.64( 32.26%) f 5.41( 37.56%)g 0.81( 5.60%) 653. (0.00000) RY (36) C 9 s( 3.29%)p 4.74( 15.61%)d15.48( 50.95%) f 5.91( 19.46%)g 3.25( 10.69%) 654. (0.00000) RY (37) C 9 s( 0.26%)p 9.60( 2.48%)d99.99( 46.63%) f99.99( 39.36%)g43.58( 11.27%) 655. (0.00000) RY (38) C 9 s( 3.53%)p 1.47( 5.17%)d 5.75( 20.30%) f14.19( 50.09%)g 5.92( 20.91%) 656. (0.00000) RY (39) C 9 s( 4.39%)p 2.06( 9.04%)d 8.16( 35.86%) f10.18( 44.70%)g 1.37( 6.02%) 657. (0.00000) RY (40) C 9 s( 70.29%)p 0.03( 2.26%)d 0.05( 3.84%) f 0.25( 17.53%)g 0.09( 6.09%) 658. (0.00000) RY (41) C 9 s( 3.27%)p 0.05( 0.16%)d 5.50( 17.97%) f20.13( 65.80%)g 3.92( 12.80%) 659. (0.00000) RY (42) C 9 s( 22.07%)p 0.08( 1.73%)d 0.31( 6.79%) f 1.81( 39.94%)g 1.34( 29.47%) 660. (0.00000) RY (43) C 9 s( 0.34%)p 0.77( 0.26%)d93.15( 31.82%) f85.73( 29.29%)g99.99( 38.28%) 661. (0.00000) RY (44) C 9 s( 0.46%)p 7.05( 3.25%)d55.83( 25.76%) f99.99( 47.67%)g49.55( 22.86%) 662. (0.00000) RY (45) C 9 s( 1.31%)p 6.46( 8.45%)d 6.94( 9.07%) f23.68( 30.95%)g38.42( 50.22%) 663. (0.00000) RY (46) C 9 s( 0.88%)p 2.82( 2.48%)d31.09( 27.36%) f31.26( 27.51%)g47.46( 41.77%) 664. (0.00000) RY (47) C 9 s( 3.71%)p 0.15( 0.57%)d 3.14( 11.64%) f15.41( 57.13%)g 7.27( 26.95%) 665. (0.00000) RY (48) C 9 s( 6.23%)p 0.69( 4.31%)d 2.45( 15.26%) f 7.75( 48.29%)g 4.16( 25.92%) 666. (0.00000) RY (49) C 9 s( 2.03%)p 1.04( 2.11%)d 6.01( 12.20%) f33.13( 67.26%)g 8.08( 16.40%) 667. (0.00000) RY (50) C 9 s( 0.96%)p 1.20( 1.16%)d 4.20( 4.03%) f40.36( 38.76%)g57.35( 55.09%) 668. (0.00000) RY (51) C 9 s( 9.48%)p 1.71( 16.25%)d 2.75( 26.04%) f 1.39( 13.16%)g 3.70( 35.06%) 669. (0.00000) RY (52) C 9 s( 12.39%)p 0.20( 2.52%)d 2.11( 26.17%) f 1.12( 13.85%)g 3.64( 45.06%) 670. (0.00787) RY ( 1) P 10 s( 8.40%)p 1.46( 12.29%)d 9.20( 77.26%) f 0.23( 1.90%)g 0.02( 0.14%) 0.0000 0.0000 0.0110 0.2893 -0.0137 0.0006 -0.0001 0.0003 0.0000 0.0000 -0.0819 0.2695 -0.0148 0.0430 0.0007 0.0000 0.0022 -0.1973 -0.0050 0.0133 -0.0015 0.0000 -0.0176 -0.0419 -0.0165 0.0063 -0.0003 -0.1154 0.1453 -0.0219 -0.0036 -0.1279 0.0605 -0.0085 -0.0009 0.0850 -0.0338 -0.0027 -0.0008 -0.7459 -0.1792 -0.0227 -0.0001 -0.1918 0.2885 0.0168 0.0002 -0.0258 0.0100 -0.1069 0.0148 -0.0002 0.0094 0.0242 0.0062 0.0266 -0.0018 0.0609 -0.0144 0.0320 0.0156 -0.0086 -0.0027 0.0082 -0.0183 -0.0057 -0.0046 -0.0017 -0.0001 -0.0301 671. (0.00716) RY ( 2) P 10 s( 0.55%)p12.93( 7.10%)d99.99( 91.28%) f 1.55( 0.85%)g 0.42( 0.23%) 0.0000 0.0000 0.0016 0.0739 -0.0051 0.0003 0.0001 0.0001 0.0000 0.0000 -0.0217 0.0378 -0.0067 0.0071 -0.0001 0.0000 -0.0038 -0.0596 -0.0076 0.0011 -0.0002 0.0000 0.0971 0.2280 0.0519 -0.0350 0.0017 -0.0696 0.0525 0.0006 -0.0003 0.8456 -0.0102 -0.0125 -0.0007 -0.3999 -0.1050 -0.0284 -0.0007 -0.1295 -0.0097 -0.0029 0.0005 -0.0063 -0.0339 -0.0127 -0.0005 0.0057 -0.0192 0.0057 -0.0025 -0.0238 0.0086 0.0686 -0.0419 0.0148 -0.0254 -0.0038 0.0010 -0.0079 0.0045 -0.0050 0.0138 -0.0296 -0.0040 -0.0040 0.0328 0.0063 -0.0014 -0.0063 672. (0.00625) RY ( 3) P 10 s( 0.16%)p42.47( 6.90%)d99.99( 91.70%) f 7.50( 1.22%)g 0.14( 0.02%) 0.0000 0.0000 0.0001 0.0400 -0.0046 0.0001 0.0004 0.0000 0.0000 0.0000 -0.0144 -0.0106 -0.0070 -0.0012 -0.0002 0.0000 -0.0081 -0.0546 0.0086 0.0040 -0.0009 0.0000 0.0449 0.2516 0.0105 0.0062 0.0026 -0.0968 -0.0452 -0.0018 -0.0001 0.3292 0.0662 -0.0205 -0.0003 0.7870 0.3886 0.0511 0.0032 0.0009 0.0582 0.0154 0.0006 0.1242 0.0204 -0.0001 0.0008 0.0401 -0.0099 0.0142 0.0008 -0.0036 0.0057 0.0862 -0.0286 0.0396 -0.0129 -0.0082 -0.0017 -0.0105 0.0075 0.0056 -0.0009 0.0071 0.0000 -0.0057 0.0058 -0.0083 -0.0017 0.0008 673. (0.00582) RY ( 4) P 10 s( 2.99%)p 2.52( 7.54%)d29.02( 86.84%) f 0.86( 2.57%)g 0.02( 0.07%) 0.0000 0.0000 0.0034 0.1712 -0.0241 -0.0032 0.0047 0.0002 0.0001 0.0000 -0.0633 -0.0952 -0.0479 -0.0027 -0.0015 0.0000 0.0003 -0.2298 0.0182 0.0017 -0.0038 0.0000 -0.0181 -0.0780 -0.0209 0.0007 -0.0017 0.0454 0.1159 -0.0101 -0.0017 0.0693 -0.0717 0.0104 -0.0002 0.1093 -0.0270 -0.0100 0.0012 0.2368 0.3248 0.0466 0.0028 -0.8101 -0.0983 -0.0165 -0.0051 -0.0352 0.0103 -0.1048 0.0260 -0.0099 0.0041 0.0215 -0.0017 0.0117 -0.0002 0.0894 -0.0320 0.0537 -0.0067 0.0052 -0.0085 -0.0009 -0.0108 -0.0123 -0.0015 0.0009 0.0172 0.0024 674. (0.00509) RY ( 5) P 10 s( 0.41%)p 9.73( 3.98%)d99.99( 88.89%) f16.13( 6.60%)g 0.29( 0.12%) 0.0000 0.0000 0.0102 0.0533 -0.0304 -0.0147 0.0035 -0.0003 0.0002 0.0000 0.0023 0.1519 -0.0241 -0.0157 -0.0007 0.0000 0.0839 -0.0613 0.0650 -0.0148 0.0030 0.0000 0.0070 0.0149 0.0197 0.0031 0.0009 -0.8078 0.3076 -0.0060 -0.0061 -0.0932 0.0096 -0.0026 -0.0001 -0.0895 0.0447 0.0036 -0.0009 0.3143 0.0091 -0.0092 0.0005 0.0691 0.1375 -0.0166 -0.0017 -0.0648 0.0133 -0.0345 -0.0146 -0.1943 0.0428 -0.0256 0.0080 0.0669 -0.0157 -0.1084 0.0128 0.0494 -0.0290 -0.0133 0.0001 0.0032 -0.0055 -0.0191 0.0028 0.0020 0.0186 0.0160 675. (0.00331) RY ( 6) P 10 s( 1.56%)p40.66( 63.34%)d18.34( 28.58%) f 4.11( 6.40%)g 0.08( 0.13%) 0.0000 0.0000 -0.0079 0.1199 -0.0334 0.0044 0.0032 0.0000 -0.0001 0.0000 -0.0246 -0.6773 0.0053 -0.0264 0.0031 0.0000 -0.0127 -0.3886 0.0667 0.0029 0.0005 0.0000 0.0001 0.1329 -0.0005 0.0058 0.0006 -0.2135 -0.1655 -0.0251 0.0003 -0.1430 0.0456 -0.0131 0.0023 -0.1066 0.0267 -0.0007 0.0005 -0.2726 0.1841 -0.0353 -0.0032 0.1375 -0.2214 -0.0035 0.0006 -0.0189 0.0056 0.1227 -0.0113 -0.0111 0.0225 -0.0061 0.0188 -0.0191 0.0004 -0.1480 0.0092 0.1579 -0.0081 -0.0166 0.0008 0.0069 -0.0055 -0.0108 -0.0038 -0.0040 0.0244 0.0133 676. (0.00300) RY ( 7) P 10 s( 0.14%)p99.99( 70.20%)d99.99( 22.70%) f47.96( 6.90%)g 0.36( 0.05%) 0.0000 0.0000 0.0028 -0.0227 0.0303 0.0005 -0.0004 0.0000 0.0000 0.0000 0.0028 0.0829 -0.0129 0.0044 -0.0007 0.0000 0.0033 0.0012 -0.0089 -0.0079 0.0006 0.0000 0.0058 0.8297 -0.0744 0.0284 -0.0035 0.1402 0.0583 0.0031 -0.0008 -0.2460 0.0820 0.0082 0.0058 -0.2085 0.2355 -0.0070 -0.0017 0.0712 -0.0216 0.0020 0.0004 -0.1324 0.1204 -0.0006 0.0002 -0.1197 0.0089 -0.0512 0.0068 0.0218 -0.0215 -0.1422 0.0450 -0.1606 0.0062 0.0539 -0.0013 -0.0029 -0.0050 0.0014 -0.0103 0.0073 -0.0010 0.0087 -0.0158 -0.0040 -0.0025 -0.0026 677. (0.00208) RY ( 8) P 10 s( 7.81%)p 7.58( 59.25%)d 3.89( 30.42%) f 0.27( 2.15%)g 0.05( 0.37%) 0.0000 0.0000 0.0171 0.2559 0.1101 0.0156 0.0009 0.0004 -0.0001 0.0000 -0.0113 0.2480 -0.1120 -0.0118 0.0015 0.0000 0.0328 -0.7081 -0.0875 -0.0444 0.0073 0.0000 -0.0001 -0.0774 -0.0035 -0.0029 0.0005 0.3087 0.1312 -0.0007 0.0094 -0.0153 -0.0426 0.0074 -0.0003 -0.0348 0.0078 0.0016 0.0011 0.2625 0.0267 0.0158 -0.0007 0.3417 0.0385 -0.0097 0.0030 0.0072 -0.0053 0.0541 0.0110 -0.0652 -0.0287 -0.0484 0.0084 -0.0113 -0.0010 0.0323 0.0706 -0.0411 0.0548 0.0169 0.0013 -0.0010 0.0140 0.0181 -0.0019 0.0072 -0.0434 0.0307 678. (0.00132) RY ( 9) P 10 s( 2.88%)p 3.46( 9.99%)d20.04( 57.80%) f10.12( 29.19%)g 0.05( 0.13%) 0.0000 0.0000 -0.0084 0.1694 -0.0075 0.0053 0.0021 0.0004 -0.0001 0.0000 0.0024 0.0515 0.0079 -0.0010 0.0012 0.0000 0.0066 0.0801 0.0940 0.0059 -0.0017 0.0000 -0.0091 -0.2211 -0.1805 -0.0190 0.0016 -0.0442 -0.1949 -0.0174 0.0018 0.0920 -0.4239 0.0992 -0.0098 -0.1604 0.5549 -0.0071 -0.0088 -0.0555 0.0249 -0.0450 0.0024 -0.0022 0.0113 -0.0053 0.0013 -0.0296 -0.0416 0.0061 0.0068 0.0550 0.0172 -0.5213 0.0173 -0.0276 -0.0622 0.0478 -0.0166 0.0785 0.0230 0.0035 0.0173 -0.0017 -0.0099 -0.0160 0.0167 0.0153 0.0044 -0.0109 679. (0.00106) RY (10) P 10 s( 30.23%)p 0.82( 24.72%)d 1.30( 39.16%) f 0.19( 5.78%)g 0.00( 0.11%) 0.0000 0.0000 -0.0209 0.5464 -0.0539 0.0209 0.0021 0.0008 -0.0003 0.0000 0.0121 0.3901 0.0484 -0.0143 -0.0059 0.0000 0.0289 0.1872 0.1742 0.0026 -0.0020 0.0000 0.0007 0.1144 0.1140 0.0016 -0.0023 -0.0763 -0.3727 -0.0221 0.0083 -0.1092 0.0985 -0.0384 0.0009 -0.0116 -0.1040 0.0083 -0.0019 0.0461 0.1204 -0.0618 0.0120 0.0331 -0.4298 -0.0729 0.0206 0.0645 -0.0016 0.1276 0.0230 0.0022 0.0267 0.1370 -0.0183 -0.0514 0.0276 -0.0067 0.0052 0.1133 0.0262 -0.0024 -0.0027 -0.0152 -0.0193 -0.0154 -0.0117 -0.0076 -0.0028 -0.0083 680. (0.00043) RY (11) P 10 s( 4.89%)p 2.82( 13.82%)d 6.75( 32.99%) f 9.65( 47.21%)g 0.22( 1.09%) 0.0000 0.0000 -0.0058 0.0809 0.2054 -0.0111 0.0062 0.0002 0.0000 0.0000 0.0071 -0.0713 -0.2998 -0.0140 0.0041 0.0000 0.0069 0.0371 0.2004 0.0117 0.0063 0.0000 0.0020 -0.0192 0.0184 -0.0219 -0.0015 -0.0177 -0.2740 -0.0595 0.0185 0.0200 0.1804 -0.0178 -0.0008 -0.0722 -0.0250 -0.0414 0.0028 0.1365 0.0917 0.0851 -0.0028 0.0773 0.4058 0.0695 -0.0091 0.0632 -0.0615 -0.2674 0.0676 0.3221 -0.1247 0.0980 -0.0260 0.2297 -0.0959 0.1607 0.0755 0.3935 -0.1016 0.0328 0.0404 0.0133 0.0059 0.0461 0.0336 -0.0047 0.0680 0.0069 681. (0.00032) RY (12) P 10 s( 2.90%)p 2.85( 8.26%)d 4.28( 12.39%) f25.88( 74.95%)g 0.52( 1.50%) 0.0000 0.0000 0.0046 -0.1024 0.1352 -0.0130 0.0008 0.0001 0.0000 0.0000 0.0019 0.0985 -0.0998 -0.0211 -0.0019 0.0000 -0.0014 0.0324 0.0791 -0.0328 0.0017 0.0000 -0.0074 -0.2147 -0.0320 0.0815 0.0182 0.0505 0.1004 0.0027 0.0026 0.0548 0.1474 -0.0071 -0.0077 -0.0648 0.2587 0.0261 -0.0001 -0.0567 0.1035 0.0100 0.0030 0.0022 -0.0224 -0.0042 -0.0009 -0.4453 0.1130 0.0521 0.0112 0.0685 -0.0403 0.2830 -0.1215 -0.5377 0.1227 -0.2317 0.1094 0.2456 -0.0649 -0.0297 -0.0492 -0.0555 0.0010 0.0293 0.0772 -0.0411 -0.0027 0.0113 682. (0.00029) RY (13) P 10 s( 5.13%)p 2.59( 13.26%)d 6.87( 35.23%) f 8.94( 45.85%)g 0.10( 0.53%) 0.0000 0.0000 -0.0156 0.2249 -0.0054 0.0190 0.0060 -0.0004 -0.0001 0.0000 0.0027 -0.2306 -0.2489 0.0078 0.0031 0.0000 0.0006 -0.0192 -0.0578 0.0748 0.0091 0.0000 0.0013 -0.0422 -0.0671 0.0410 0.0075 -0.1503 -0.3348 -0.0620 0.0194 0.0427 -0.0194 0.0306 -0.0014 0.0282 -0.0756 0.0149 0.0032 0.1576 -0.3947 0.0386 -0.0060 -0.0425 0.1376 0.0252 -0.0020 -0.1883 0.0792 -0.0759 -0.0168 -0.0841 0.0767 0.0945 0.0033 -0.3454 0.1218 0.3180 -0.0488 -0.3801 0.0823 -0.0367 -0.0364 -0.0172 0.0003 -0.0403 -0.0188 -0.0097 -0.0125 0.0107 683. (0.00022) RY (14) P 10 s( 6.40%)p 1.10( 7.05%)d 0.97( 6.19%) f11.43( 73.16%)g 1.13( 7.20%) 0.0000 0.0000 -0.0074 0.2503 -0.0334 0.0072 -0.0098 0.0011 -0.0001 0.0000 -0.0073 -0.1232 0.1445 0.0249 0.0060 0.0000 0.0145 0.1544 0.0448 -0.0363 -0.0037 0.0000 0.0020 0.0050 -0.0780 0.0147 -0.0025 0.1039 0.1662 -0.0016 -0.0036 0.0008 -0.0234 -0.0213 -0.0021 0.0016 -0.0146 0.0283 0.0029 0.0387 0.0616 -0.0487 0.0020 0.0926 0.0718 0.0001 0.0086 -0.5858 0.2595 0.2197 -0.1240 0.0953 -0.0785 0.0884 0.0119 0.4142 -0.1516 0.1536 -0.0701 -0.0757 0.0736 -0.0239 -0.1269 0.1209 0.0974 -0.0387 0.1063 0.1221 0.0084 -0.0587 684. (0.00020) RY (15) P 10 s( 18.44%)p 2.63( 48.56%)d 0.90( 16.58%) f 0.83( 15.26%)g 0.06( 1.16%) 0.0000 0.0000 -0.0030 -0.0093 0.4279 -0.0347 0.0042 0.0018 0.0006 0.0000 0.0004 -0.0476 -0.5546 -0.0217 0.0077 0.0000 -0.0067 0.1717 0.3723 0.0051 -0.0044 0.0000 0.0033 0.0824 -0.0114 -0.0079 -0.0029 0.0753 0.1990 0.0353 -0.0113 -0.0108 -0.2006 0.0113 0.0023 0.0845 -0.1427 0.0568 -0.0064 -0.1257 0.0839 -0.0629 0.0037 0.0266 -0.1117 -0.0844 0.0274 0.0191 0.0535 0.0553 0.0646 -0.2604 0.0470 -0.0900 0.0668 0.0747 0.0437 -0.0817 0.0805 -0.1016 0.1691 -0.0282 -0.0429 0.0130 -0.0514 -0.0609 -0.0355 0.0078 -0.0299 -0.0161 685. (0.00019) RY (16) P 10 s( 0.14%)p99.99( 21.17%)d99.99( 50.66%) f99.99( 26.21%)g13.53( 1.83%) 0.0000 0.0000 0.0017 0.0269 -0.0250 -0.0006 0.0010 -0.0003 0.0000 0.0000 -0.0023 0.0173 0.1954 -0.0059 -0.0043 0.0000 0.0072 -0.0162 0.0404 -0.0334 -0.0023 0.0000 0.0118 0.1553 -0.3806 0.0302 0.0067 -0.0417 0.0210 -0.0143 -0.0047 0.0514 -0.4948 0.1212 0.0049 0.1911 -0.4284 0.0763 0.0109 0.0379 -0.0327 -0.0202 0.0051 0.0999 0.0476 0.0285 -0.0018 -0.0196 0.1448 -0.1026 0.0122 0.1593 -0.0782 0.0103 0.1182 -0.1725 0.2231 -0.0467 0.0228 0.3002 -0.1104 -0.0130 -0.0813 0.0381 0.0166 0.0358 -0.0653 -0.0622 0.0192 -0.0006 686. (0.00015) RY (17) P 10 s( 3.75%)p 7.53( 28.22%)d 9.25( 34.67%) f 8.30( 31.10%)g 0.61( 2.27%) 0.0000 0.0000 0.0009 0.1832 -0.0470 -0.0373 -0.0168 0.0022 0.0004 0.0000 -0.0110 -0.1371 0.3015 0.1209 0.0352 0.0000 0.0205 0.1266 0.2708 -0.0255 -0.0132 0.0000 0.0003 -0.0265 0.2541 0.0252 0.0041 0.0855 0.1903 0.0441 -0.0214 -0.0080 -0.0523 -0.0188 -0.0067 -0.0215 -0.0157 -0.0424 0.0050 -0.0013 0.4120 -0.0125 -0.0073 0.2057 0.2680 0.1034 -0.0147 0.1024 -0.0663 -0.2634 0.0311 -0.0189 0.1116 0.0229 -0.0430 -0.2815 0.0915 0.1324 -0.1892 -0.1518 0.2158 -0.0278 0.0185 -0.0677 -0.0275 -0.0976 -0.0461 -0.0036 -0.0546 -0.0400 687. (0.00012) RY (18) P 10 s( 25.16%)p 0.68( 17.19%)d 1.41( 35.57%) f 0.79( 19.98%)g 0.08( 2.09%) 0.0000 0.0000 -0.0125 0.5002 -0.0012 0.0107 -0.0347 0.0018 0.0003 0.0000 -0.0243 -0.3035 0.0320 -0.0159 0.0097 0.0000 0.0257 0.2552 -0.0738 -0.0562 -0.0071 0.0000 -0.0020 -0.0424 -0.0389 -0.0074 0.0043 0.1920 0.3696 0.0291 0.0038 0.0242 0.1243 0.0220 0.0009 0.0078 0.0880 0.0093 -0.0024 0.1294 -0.3599 0.0317 -0.0013 -0.0072 0.0204 -0.0958 -0.0060 0.1921 -0.1337 -0.0581 -0.0486 -0.0709 -0.0929 -0.0290 0.0027 -0.0378 0.0298 -0.2479 0.1250 0.1247 -0.1727 -0.0226 0.0613 -0.0396 0.0048 0.0244 -0.0064 -0.0575 0.0899 0.0549 688. (0.00007) RY (19) P 10 s( 9.90%)p 4.90( 48.56%)d 3.01( 29.77%) f 1.03( 10.20%)g 0.16( 1.57%) 689. (0.00006) RY (20) P 10 s( 0.88%)p55.17( 48.79%)d34.60( 30.60%) f18.28( 16.17%)g 4.02( 3.55%) 690. (0.00003) RY (21) P 10 s( 5.39%)p 2.43( 13.08%)d 5.08( 27.39%) f 8.23( 44.37%)g 1.81( 9.78%) 691. (0.00002) RY (22) P 10 s( 21.10%)p 0.79( 16.71%)d 1.51( 31.92%) f 1.25( 26.43%)g 0.18( 3.84%) 692. (0.00002) RY (23) P 10 s( 0.56%)p 9.42( 5.31%)d48.13( 27.10%) f99.99( 63.14%)g 6.90( 3.89%) 693. (0.00002) RY (24) P 10 s( 0.68%)p43.94( 29.92%)d70.86( 48.24%) f22.65( 15.42%)g 8.43( 5.74%) 694. (0.00001) RY (25) P 10 s( 1.80%)p14.91( 26.80%)d21.96( 39.48%) f13.28( 23.89%)g 4.46( 8.03%) 695. (0.00001) RY (26) P 10 s( 0.91%)p15.14( 13.76%)d16.20( 14.72%) f59.68( 54.23%)g18.04( 16.39%) 696. (0.00001) RY (27) P 10 s( 6.56%)p 2.93( 19.21%)d 2.81( 18.42%) f 7.35( 48.23%)g 1.15( 7.58%) 697. (0.00001) RY (28) P 10 s( 7.64%)p 0.79( 6.05%)d 3.78( 28.88%) f 6.19( 47.30%)g 1.33( 10.13%) 698. (0.00000) RY (29) P 10 s( 2.53%)p 7.17( 18.17%)d20.78( 52.62%) f 9.49( 24.03%)g 1.04( 2.64%) 699. (0.00000) RY (30) P 10 s( 3.76%)p 3.44( 12.93%)d16.97( 63.87%) f 2.98( 11.21%)g 2.19( 8.23%) 700. (0.00000) RY (31) P 10 s( 3.97%)p 3.08( 12.23%)d 6.10( 24.21%) f10.68( 42.41%)g 4.33( 17.18%) 701. (0.00000) RY (32) P 10 s( 11.20%)p 1.51( 16.95%)d 2.59( 29.03%) f 3.05( 34.14%)g 0.78( 8.68%) 702. (0.00000) RY (33) P 10 s( 0.23%)p81.75( 18.44%)d60.29( 13.60%) f99.99( 38.16%)g99.99( 29.57%) 703. (0.00000) RY (34) P 10 s( 1.97%)p 1.71( 3.36%)d13.45( 26.47%) f21.98( 43.25%)g12.68( 24.95%) 704. (0.00000) RY (35) P 10 s( 22.27%)p 0.53( 11.69%)d 0.74( 16.50%) f 0.96( 21.47%)g 1.26( 28.06%) 705. (0.00000) RY (36) P 10 s( 19.83%)p 0.15( 2.95%)d 3.28( 65.00%) f 0.18( 3.57%)g 0.44( 8.65%) 706. (0.00000) RY (37) P 10 s( 98.09%)p 0.01( 1.42%)d 0.00( 0.24%) f 0.00( 0.15%)g 0.00( 0.11%) 707. (0.00000) RY (38) P 10 s( 98.08%)p 0.01( 1.18%)d 0.00( 0.25%) f 0.00( 0.16%)g 0.00( 0.34%) 708. (0.00000) RY (39) P 10 s( 1.99%)p19.01( 37.89%)d 4.16( 8.28%) f 7.72( 15.38%)g18.29( 36.45%) 709. (0.00000) RY (40) P 10 s( 4.09%)p 1.90( 7.78%)d 3.88( 15.86%) f 1.89( 7.73%)g15.80( 64.55%) 710. (0.00000) RY (41) P 10 s( 4.55%)p12.87( 58.52%)d 1.83( 8.32%) f 1.02( 4.63%)g 5.27( 23.98%) 711. (0.00000) RY (42) P 10 s( 7.59%)p 1.08( 8.20%)d 4.66( 35.41%) f 2.01( 15.24%)g 4.42( 33.55%) 712. (0.00000) RY (43) P 10 s( 2.73%)p 7.25( 19.82%)d 7.67( 20.96%) f 5.23( 14.28%)g15.44( 42.20%) 713. (0.00000) RY (44) P 10 s( 4.00%)p 8.45( 33.78%)d 4.61( 18.41%) f 6.09( 24.33%)g 4.88( 19.49%) 714. (0.00000) RY (45) P 10 s( 2.96%)p11.67( 34.55%)d 6.12( 18.11%) f 6.17( 18.26%)g 8.82( 26.12%) 715. (0.00000) RY (46) P 10 s( 13.19%)p 0.87( 11.50%)d 2.36( 31.12%) f 1.03( 13.58%)g 2.32( 30.61%) 716. (0.00000) RY (47) P 10 s( 2.03%)p 8.54( 17.31%)d15.82( 32.06%) f 1.91( 3.87%)g22.07( 44.74%) 717. (0.00000) RY (48) P 10 s( 3.23%)p 2.20( 7.08%)d10.63( 34.30%) f 4.46( 14.38%)g12.71( 41.01%) 718. (0.00000) RY (49) P 10 s( 1.03%)p33.74( 34.77%)d23.68( 24.41%) f17.43( 17.96%)g21.18( 21.83%) 719. (0.00000) RY (50) P 10 s( 3.54%)p 5.24( 18.54%)d 3.57( 12.63%) f 5.26( 18.61%)g13.18( 46.68%) 720. (0.00000) RY (51) P 10 s( 23.45%)p 0.50( 11.84%)d 1.39( 32.51%) f 0.62( 14.55%)g 0.75( 17.66%) 721. (0.00000) RY (52) P 10 s( 1.35%)p11.73( 15.84%)d13.48( 18.22%) f32.55( 43.97%)g15.27( 20.63%) 722. (0.00000) RY (53) P 10 s( 16.77%)p 0.83( 13.98%)d 1.38( 23.19%) f 0.87( 14.68%)g 1.87( 31.38%) 723. (0.00000) RY (54) P 10 s( 11.96%)p 2.09( 24.97%)d 1.17( 14.03%) f 3.00( 35.92%)g 1.10( 13.12%) 724. (0.00000) RY (55) P 10 s( 16.04%)p 1.22( 19.52%)d 1.25( 20.07%) f 0.80( 12.89%)g 1.96( 31.49%) 725. (0.00000) RY (56) P 10 s( 2.18%)p 1.89( 4.12%)d12.77( 27.87%) f13.48( 29.42%)g16.68( 36.40%) 726. (0.00000) RY (57) P 10 s( 6.48%)p 2.62( 16.96%)d 5.33( 34.51%) f 2.78( 18.02%)g 3.71( 24.04%) 727. (0.00000) RY (58) P 10 s( 7.02%)p 1.80( 12.62%)d 5.11( 35.84%) f 2.97( 20.86%)g 3.37( 23.66%) 728. (0.00000) RY (59) P 10 s( 7.52%)p 3.21( 24.17%)d 3.54( 26.64%) f 3.67( 27.62%)g 1.87( 14.05%) 729. (0.00000) RY (60) P 10 s( 8.39%)p 0.68( 5.66%)d 7.22( 60.54%) f 0.94( 7.90%)g 2.09( 17.52%) 730. (0.00000) RY (61) P 10 s( 8.26%)p 1.62( 13.40%)d 2.04( 16.87%) f 4.91( 40.59%)g 2.53( 20.89%) 731. (0.00543) RY ( 1) C 11 s( 17.29%)p 3.96( 68.55%)d 0.77( 13.23%) f 0.05( 0.86%)g 0.00( 0.06%) 0.0000 -0.0007 0.4150 0.0220 -0.0118 -0.0111 0.0003 -0.0111 0.3724 -0.0012 -0.0068 -0.0253 0.7253 0.0293 0.0300 -0.0008 -0.1315 -0.0292 0.0037 -0.1854 0.0567 0.0028 -0.0430 0.0547 -0.0024 0.0291 0.0201 -0.0073 0.2220 -0.1331 0.0119 0.1326 -0.0607 0.0113 0.0165 -0.0135 -0.0267 0.0035 -0.0003 0.0061 0.0329 0.0142 0.0142 -0.0007 -0.0725 0.0024 -0.0217 0.0135 0.0100 -0.0085 0.0038 -0.0013 0.0044 -0.0021 -0.0190 0.0018 0.0062 732. (0.00397) RY ( 2) C 11 s( 3.17%)p22.74( 72.01%)d 7.39( 23.39%) f 0.42( 1.33%)g 0.03( 0.11%) 0.0000 0.0178 0.1618 0.0701 -0.0065 0.0137 -0.0010 0.0101 -0.7775 0.1559 0.0007 -0.0247 0.2182 0.0661 0.0079 -0.0225 0.1810 -0.0723 -0.0025 -0.1326 0.0163 -0.0012 0.1941 -0.2483 -0.0111 -0.0227 0.1102 -0.0023 0.1395 -0.0016 0.0182 0.2151 -0.1942 0.0126 0.0256 0.0089 -0.0283 0.0084 0.0038 -0.0029 -0.0137 -0.0115 0.0773 -0.0041 -0.0289 0.0195 -0.0640 0.0042 -0.0078 0.0286 -0.0084 0.0056 -0.0038 -0.0012 0.0022 -0.0056 0.0066 733. (0.00332) RY ( 3) C 11 s( 2.89%)p31.51( 91.14%)d 0.89( 2.57%) f 1.16( 3.35%)g 0.02( 0.05%) 0.0000 0.0063 0.1697 0.0041 -0.0058 0.0050 -0.0003 0.0227 0.2770 0.0628 0.0125 -0.0340 -0.1066 0.0230 0.0033 0.0347 0.8928 0.1339 0.0280 -0.0027 0.0318 -0.0123 -0.0071 -0.0336 0.0094 -0.0730 0.0252 -0.0221 0.0527 0.0037 0.0158 0.0854 -0.0787 -0.0175 0.0472 -0.0148 0.1527 -0.0330 -0.0674 0.0216 0.0164 -0.0145 -0.0330 0.0072 -0.0047 0.0024 -0.0009 0.0038 -0.0138 0.0020 0.0090 0.0060 -0.0094 -0.0048 -0.0045 0.0036 -0.0009 734. (0.00207) RY ( 4) C 11 s( 11.84%)p 3.78( 44.78%)d 3.24( 38.35%) f 0.40( 4.71%)g 0.03( 0.33%) 0.0000 0.0037 0.3281 -0.1024 -0.0008 -0.0148 0.0012 -0.0137 0.0051 0.3149 0.0160 -0.0511 -0.3224 0.4476 0.0277 -0.0129 -0.1889 0.0618 0.0307 0.2400 0.0257 0.0259 -0.0591 0.0301 0.0071 -0.2856 -0.1507 -0.0515 0.4085 -0.2102 0.0444 -0.0125 0.0017 0.0007 -0.0073 0.0023 -0.0422 0.0143 -0.0716 0.0442 -0.1525 0.0229 -0.1056 -0.0163 0.0499 -0.0002 0.0091 0.0132 0.0016 0.0057 0.0296 0.0092 0.0090 -0.0321 -0.0187 0.0281 0.0045 735. (0.00099) RY ( 5) C 11 s( 1.40%)p 7.16( 10.00%)d61.20( 85.50%) f 2.12( 2.96%)g 0.11( 0.15%) 0.0000 -0.0046 0.1173 0.0004 0.0074 -0.0115 0.0008 -0.0003 0.0087 -0.0946 -0.0386 0.0073 -0.1259 0.1262 0.0072 0.0013 -0.0546 -0.2250 -0.0631 0.0988 0.3590 0.0322 -0.0768 0.2886 -0.0176 -0.0413 0.7379 0.0245 0.0276 0.2455 -0.0043 0.1263 -0.0007 0.0457 0.0039 0.0012 0.0519 -0.0233 -0.0950 -0.0631 0.0376 0.0267 0.0239 0.0485 0.0468 0.0430 0.0503 0.0410 -0.0122 0.0039 -0.0194 -0.0187 -0.0131 -0.0105 -0.0130 0.0094 -0.0110 736. (0.00072) RY ( 6) C 11 s( 26.01%)p 1.81( 46.97%)d 0.82( 21.24%) f 0.20( 5.27%)g 0.02( 0.51%) 0.0000 0.0011 0.4848 -0.1581 0.0014 0.0098 0.0001 0.0063 -0.0305 -0.6314 -0.0440 -0.0188 -0.1993 -0.1216 0.0365 -0.0062 -0.0730 0.0805 -0.0019 0.0126 0.2188 -0.0257 0.1303 -0.2617 0.0103 -0.0805 -0.1648 0.0132 -0.1673 0.0346 -0.0104 0.0780 -0.0942 0.0113 -0.0222 0.0159 -0.1316 0.0354 -0.0061 0.0188 -0.0646 -0.0063 -0.0911 -0.0001 0.0336 0.0205 0.1374 -0.0041 -0.0147 0.0458 0.0041 0.0063 0.0014 -0.0443 0.0210 0.0170 0.0002 737. (0.00049) RY ( 7) C 11 s( 0.85%)p13.12( 11.15%)d30.37( 25.82%) f70.72( 60.13%)g 2.41( 2.04%) 0.0000 -0.0017 0.0916 -0.0042 0.0075 -0.0057 0.0009 -0.0054 -0.0833 -0.0768 0.1235 0.0023 -0.0496 0.0315 -0.0239 -0.0082 -0.1485 -0.1183 0.2080 0.0102 -0.1106 -0.0003 -0.1526 0.1669 0.0687 0.0831 -0.1807 0.0274 -0.0899 0.1105 0.0428 0.1603 -0.3151 -0.0505 0.1715 -0.0539 0.6735 -0.2091 -0.0182 0.0389 0.0182 -0.0245 -0.2038 0.0460 -0.1513 0.0316 -0.0371 0.0080 -0.0780 -0.0621 -0.0052 0.0881 -0.0227 -0.0177 -0.0163 -0.0349 0.0200 738. (0.00035) RY ( 8) C 11 s( 11.83%)p 0.73( 8.58%)d 5.74( 67.95%) f 0.91( 10.78%)g 0.07( 0.86%) 0.0000 -0.0081 0.3332 -0.0575 0.0389 0.0492 0.0004 -0.0088 -0.1955 -0.0025 0.0396 0.0069 -0.1313 -0.0675 -0.0748 0.0049 0.0857 -0.1038 -0.0194 -0.4212 -0.1127 0.0176 -0.5145 0.1674 0.0332 0.2049 -0.0365 -0.0439 0.0007 0.0479 -0.0376 -0.3082 0.2262 0.0128 0.1316 -0.0299 -0.0716 0.0170 -0.0411 0.0041 -0.2166 0.0668 0.1586 -0.0274 0.0496 -0.0419 -0.0234 -0.0213 0.0103 -0.0587 0.0445 -0.0335 0.0119 -0.0040 0.0185 -0.0030 -0.0373 739. (0.00024) RY ( 9) C 11 s( 3.22%)p 9.45( 30.44%)d15.50( 49.93%) f 4.90( 15.78%)g 0.19( 0.63%) 0.0000 -0.0089 0.1706 -0.0367 0.0412 0.0014 0.0012 -0.0055 0.0145 0.2214 -0.0498 0.0168 -0.1665 -0.0784 0.0581 0.0012 -0.0884 0.4302 -0.1492 0.0077 0.1149 0.0326 0.2028 0.1035 0.0181 0.6277 0.0230 0.0887 0.0919 0.0636 -0.0078 0.0197 -0.1035 0.0826 0.2484 -0.0560 -0.0603 0.0240 0.1327 -0.0592 0.1650 -0.0341 -0.1433 0.0400 0.0735 0.0046 -0.0955 0.0503 0.0180 0.0169 -0.0581 -0.0350 0.0165 -0.0206 0.0041 0.0183 0.0022 740. (0.00019) RY (10) C 11 s( 2.53%)p15.67( 39.68%)d 8.97( 22.73%) f13.33( 33.76%)g 0.51( 1.30%) 0.0000 -0.0013 -0.0766 0.1360 0.0037 -0.0306 0.0015 0.0062 0.0610 -0.1309 -0.0635 0.0039 -0.0913 0.1767 0.0349 0.0127 0.1186 -0.5444 -0.1433 0.1174 -0.0296 0.0541 -0.2097 0.0070 -0.0469 0.1758 -0.2052 0.0313 0.0037 -0.0736 -0.0180 0.2316 -0.1674 0.0452 0.1894 -0.0438 -0.3660 0.0837 0.1420 0.0001 0.1378 -0.0242 -0.1773 0.0501 -0.0429 -0.0063 -0.2742 0.0899 0.0763 0.0234 -0.0257 -0.0285 0.0362 -0.0519 -0.0172 -0.0274 0.0101 741. (0.00013) RY (11) C 11 s( 17.11%)p 2.48( 42.41%)d 1.43( 24.45%) f 0.90( 15.47%)g 0.03( 0.56%) 0.0000 0.0079 0.0838 0.3926 0.0918 -0.0385 0.0037 0.0156 -0.0334 -0.0642 -0.0035 0.0260 0.0678 0.6185 0.0591 -0.0074 0.0233 0.1633 -0.0051 -0.1247 -0.1132 0.0405 0.0448 0.0080 -0.0002 0.0557 0.0561 -0.0361 -0.3893 0.0155 -0.0022 -0.2293 0.0118 -0.0193 -0.0340 -0.0336 -0.0640 0.0088 0.0208 0.0207 0.1692 0.0206 -0.1455 0.0020 -0.1645 0.0088 0.2636 -0.0229 -0.0006 0.0253 0.0016 0.0196 -0.0020 -0.0514 0.0267 0.0174 -0.0293 742. (0.00006) RY (12) C 11 s( 8.50%)p 1.90( 16.16%)d 6.84( 58.14%) f 1.45( 12.34%)g 0.57( 4.86%) 743. (0.00006) RY (13) C 11 s( 12.38%)p 1.47( 18.23%)d 2.62( 32.37%) f 2.48( 30.75%)g 0.51( 6.26%) 744. (0.00005) RY (14) C 11 s( 3.67%)p 4.38( 16.08%)d15.77( 57.85%) f 5.58( 20.48%)g 0.53( 1.93%) 745. (0.00003) RY (15) C 11 s( 3.89%)p 4.47( 17.39%)d 7.36( 28.64%) f12.21( 47.51%)g 0.66( 2.57%) 746. (0.00003) RY (16) C 11 s( 0.84%)p18.39( 15.52%)d42.22( 35.63%) f54.68( 46.15%)g 2.19( 1.85%) 747. (0.00003) RY (17) C 11 s( 4.77%)p 6.47( 30.86%)d 7.70( 36.73%) f 5.27( 25.13%)g 0.53( 2.51%) 748. (0.00002) RY (18) C 11 s( 7.01%)p 2.92( 20.44%)d 7.60( 53.26%) f 2.44( 17.07%)g 0.32( 2.22%) 749. (0.00001) RY (19) C 11 s( 22.73%)p 0.21( 4.68%)d 1.38( 31.39%) f 1.67( 37.98%)g 0.14( 3.21%) 750. (0.00001) RY (20) C 11 s( 8.21%)p 1.37( 11.20%)d 2.75( 22.57%) f 4.55( 37.37%)g 2.52( 20.65%) 751. (0.00001) RY (21) C 11 s( 3.68%)p 3.56( 13.09%)d 5.43( 19.97%) f14.47( 53.22%)g 2.73( 10.04%) 752. (0.00001) RY (22) C 11 s( 13.37%)p 2.14( 28.65%)d 2.80( 37.49%) f 1.15( 15.37%)g 0.38( 5.12%) 753. (0.00000) RY (23) C 11 s( 1.95%)p 5.72( 11.15%)d10.11( 19.73%) f18.20( 35.51%)g16.23( 31.66%) 754. (0.00000) RY (24) C 11 s( 4.81%)p 4.36( 20.94%)d 4.93( 23.70%) f 4.20( 20.20%)g 6.31( 30.35%) 755. (0.00000) RY (25) C 11 s( 12.67%)p 0.25( 3.19%)d 3.45( 43.67%) f 2.17( 27.47%)g 1.03( 13.00%) 756. (0.00000) RY (26) C 11 s( 5.30%)p 3.37( 17.90%)d 7.53( 39.96%) f 3.73( 19.78%)g 3.21( 17.05%) 757. (0.00000) RY (27) C 11 s( 11.70%)p 1.63( 19.11%)d 3.84( 44.94%) f 1.29( 15.06%)g 0.79( 9.20%) 758. (0.00000) RY (28) C 11 s( 0.45%)p44.23( 19.98%)d73.68( 33.29%) f46.30( 20.92%)g56.10( 25.35%) 759. (0.00000) RY (29) C 11 s( 1.75%)p 5.09( 8.89%)d24.57( 42.96%) f10.88( 19.02%)g15.66( 27.38%) 760. (0.00000) RY (30) C 11 s( 9.85%)p 2.74( 27.02%)d 1.82( 17.92%) f 3.84( 37.87%)g 0.74( 7.33%) 761. (0.00000) RY (31) C 11 s( 3.14%)p16.78( 52.75%)d 4.53( 14.23%) f 7.84( 24.65%)g 1.66( 5.23%) 762. (0.00000) RY (32) C 11 s( 2.66%)p 7.60( 20.19%)d13.90( 36.94%) f13.36( 35.51%)g 1.77( 4.70%) 763. (0.00000) RY (33) C 11 s( 10.63%)p 0.79( 8.38%)d 4.73( 50.26%) f 2.55( 27.16%)g 0.34( 3.57%) 764. (0.00000) RY (34) C 11 s( 83.62%)p 0.00( 0.02%)d 0.01( 1.23%) f 0.10( 8.27%)g 0.08( 6.85%) 765. (0.00000) RY (35) C 11 s( 5.58%)p 0.10( 0.58%)d 1.87( 10.41%) f 9.35( 52.22%)g 5.59( 31.21%) 766. (0.00000) RY (36) C 11 s( 4.20%)p 0.11( 0.45%)d 2.52( 10.56%) f 6.45( 27.05%)g13.76( 57.74%) 767. (0.00000) RY (37) C 11 s( 6.34%)p 0.07( 0.47%)d 1.91( 12.08%) f 9.97( 63.21%)g 2.82( 17.90%) 768. (0.00000) RY (38) C 11 s( 2.21%)p 0.17( 0.38%)d 3.68( 8.11%) f20.92( 46.17%)g19.55( 43.14%) 769. (0.00000) RY (39) C 11 s( 8.37%)p 0.17( 1.43%)d 1.62( 13.53%) f 5.64( 47.21%)g 3.52( 29.46%) 770. (0.00000) RY (40) C 11 s( 4.60%)p 0.23( 1.07%)d 2.55( 11.74%) f 6.97( 32.04%)g11.00( 50.55%) 771. (0.00000) RY (41) C 11 s( 5.53%)p 0.14( 0.75%)d 2.69( 14.88%) f 6.35( 35.16%)g 7.89( 43.68%) 772. (0.00000) RY (42) C 11 s( 1.25%)p 0.63( 0.79%)d 6.86( 8.60%) f40.08( 50.23%)g31.22( 39.12%) 773. (0.00000) RY (43) C 11 s( 4.32%)p 0.18( 0.77%)d 5.90( 25.48%) f 6.91( 29.84%)g 9.16( 39.58%) 774. (0.00000) RY (44) C 11 s( 0.81%)p 4.33( 3.51%)d11.47( 9.29%) f60.07( 48.63%)g46.66( 37.77%) 775. (0.00000) RY (45) C 11 s( 1.29%)p 0.29( 0.38%)d24.50( 31.59%) f16.24( 20.94%)g35.52( 45.80%) 776. (0.00000) RY (46) C 11 s( 27.98%)p 0.09( 2.45%)d 0.58( 16.16%) f 0.28( 7.95%)g 1.62( 45.46%) 777. (0.00000) RY (47) C 11 s( 5.10%)p 0.31( 1.57%)d 4.73( 24.12%) f 7.60( 38.76%)g 5.97( 30.45%) 778. (0.00000) RY (48) C 11 s( 23.55%)p 0.07( 1.53%)d 0.44( 10.28%) f 0.97( 22.84%)g 1.78( 41.80%) 779. (0.00000) RY (49) C 11 s( 4.67%)p 0.43( 2.00%)d 7.64( 35.68%) f 4.17( 19.50%)g 8.17( 38.15%) 780. (0.00000) RY (50) C 11 s( 10.22%)p 0.67( 6.84%)d 2.71( 27.66%) f 3.56( 36.37%)g 1.85( 18.91%) 781. (0.00000) RY (51) C 11 s( 2.60%)p 0.78( 2.03%)d18.19( 47.35%) f 5.15( 13.42%)g13.29( 34.60%) 782. (0.00000) RY (52) C 11 s( 45.74%)p 0.14( 6.60%)d 0.51( 23.45%) f 0.42( 19.05%)g 0.11( 5.16%) 783. (0.00504) RY ( 1) C 12 s( 17.40%)p 3.78( 65.71%)d 0.90( 15.70%) f 0.07( 1.15%)g 0.00( 0.05%) 0.0000 0.0052 0.4156 0.0315 -0.0137 -0.0089 0.0003 -0.0090 0.2089 0.0323 0.0130 -0.0378 0.7760 0.0530 0.0240 -0.0046 -0.0123 -0.0697 0.0131 -0.1102 0.0819 -0.0047 0.0209 0.0221 -0.0051 0.0467 0.0497 -0.0157 0.2685 -0.1314 0.0162 0.1875 -0.0862 0.0098 0.0253 0.0127 -0.0334 0.0124 -0.0774 0.0056 0.0162 -0.0042 -0.0500 0.0014 -0.0025 0.0064 -0.0218 0.0075 -0.0128 -0.0106 -0.0103 -0.0016 -0.0025 -0.0035 0.0041 0.0049 -0.0026 784. (0.00358) RY ( 2) C 12 s( 0.56%)p99.99( 76.43%)d38.93( 21.75%) f 1.98( 1.11%)g 0.28( 0.15%) 0.0000 0.0174 0.0304 0.0642 -0.0006 0.0153 -0.0011 -0.0006 0.3244 -0.0118 -0.0018 -0.0154 -0.1929 -0.0071 -0.0069 -0.0271 0.7807 -0.1056 0.0062 -0.0713 0.0907 -0.0011 -0.0458 0.1238 -0.0022 0.1386 -0.0578 0.0057 0.2205 -0.1911 0.0069 -0.1036 0.2609 0.0129 -0.0208 -0.0257 -0.0659 -0.0024 -0.0600 0.0153 -0.0212 0.0023 -0.0219 0.0050 0.0273 -0.0081 -0.0055 0.0012 0.0115 0.0275 0.0023 -0.0163 0.0138 -0.0092 0.0103 0.0022 -0.0023 785. (0.00302) RY ( 3) C 12 s( 0.22%)p99.99( 94.39%)d 5.54( 1.23%) f18.56( 4.11%)g 0.20( 0.04%) 0.0000 0.0041 0.0401 0.0240 0.0006 0.0037 0.0000 -0.0475 -0.8678 -0.1486 -0.0218 0.0003 0.1923 0.0185 0.0029 0.0093 0.3584 -0.0125 -0.0066 0.0013 -0.0097 0.0064 -0.0201 0.0550 0.0262 0.0375 -0.0112 -0.0040 0.0540 -0.0438 0.0165 0.0215 0.0295 -0.0065 -0.0940 0.0115 0.1033 -0.0260 -0.0516 0.0112 0.0595 -0.0186 -0.0323 0.0043 -0.0803 0.0224 0.0746 -0.0240 0.0095 -0.0048 0.0085 -0.0128 0.0015 0.0070 -0.0050 0.0011 -0.0037 786. (0.00158) RY ( 4) C 12 s( 28.23%)p 1.19( 33.70%)d 1.19( 33.53%) f 0.14( 4.07%)g 0.02( 0.47%) 0.0000 0.0039 0.5134 -0.1369 -0.0027 0.0015 0.0002 -0.0138 -0.0979 0.0852 0.0048 -0.0454 -0.3552 0.4226 0.0479 -0.0116 -0.0501 0.0863 0.0270 -0.1653 0.1133 -0.0186 -0.1110 -0.0213 -0.0096 -0.4669 -0.0735 -0.0484 0.1790 -0.1446 0.0266 0.0092 -0.0497 -0.0015 -0.0334 0.0065 0.0048 0.0108 0.1293 0.0233 0.0224 -0.0005 0.0562 -0.0130 -0.0536 0.0204 -0.1173 0.0361 0.0257 0.0131 -0.0535 -0.0156 -0.0247 0.0040 0.0105 -0.0026 -0.0036 787. (0.00075) RY ( 5) C 12 s( 1.43%)p 3.54( 5.06%)d60.99( 87.15%) f 4.31( 6.16%)g 0.14( 0.20%) 0.0000 -0.0063 0.1190 0.0019 -0.0044 0.0083 -0.0004 -0.0011 -0.0610 -0.1809 -0.0363 -0.0015 -0.0685 -0.0722 0.0228 0.0064 -0.0335 0.0325 -0.0132 0.1793 0.7457 0.0289 0.1517 -0.1736 0.0530 0.1792 -0.2421 0.0154 0.1120 0.3491 0.0284 0.0194 -0.0041 -0.0032 0.0669 -0.0162 -0.1252 0.0337 0.0422 0.0247 -0.1114 -0.0351 -0.0128 -0.0979 0.0810 -0.0338 -0.0803 -0.0100 -0.0087 0.0044 0.0073 0.0227 -0.0013 -0.0098 0.0214 -0.0267 -0.0074 788. (0.00046) RY ( 6) C 12 s( 0.09%)p99.99( 9.53%)d99.99( 25.69%) f99.99( 62.51%)g24.45( 2.18%) 0.0000 0.0014 0.0246 0.0133 -0.0044 -0.0095 0.0004 0.0105 0.1435 0.0815 -0.2126 0.0000 -0.0233 -0.0275 0.0860 -0.0057 -0.0572 0.0826 0.0629 -0.0042 0.1925 -0.0498 -0.1694 0.3498 0.0835 0.0645 -0.1763 -0.0091 -0.0516 0.1069 -0.0016 -0.0375 -0.0878 -0.0285 -0.2159 0.0740 0.5080 -0.1486 -0.0003 0.0322 0.1214 -0.0644 -0.3549 0.0632 -0.3151 0.1046 0.1686 -0.0659 0.0858 -0.0929 -0.0044 -0.0400 0.0608 0.0042 0.0031 0.0178 0.0133 789. (0.00036) RY ( 7) C 12 s( 6.29%)p 1.79( 11.29%)d10.39( 65.39%) f 2.58( 16.23%)g 0.13( 0.80%) 0.0000 -0.0087 0.2435 -0.0316 0.0352 0.0365 0.0005 0.0072 0.0525 0.0270 -0.1141 -0.0006 -0.2237 0.0131 -0.0668 0.0112 0.1176 -0.1561 -0.0578 0.3119 -0.2196 0.0147 0.2849 -0.0079 -0.0147 0.1345 0.1049 -0.0198 -0.0423 0.1616 0.0198 0.5897 -0.1375 -0.0480 -0.3642 0.0837 -0.0275 -0.0187 -0.0600 -0.0225 0.1057 -0.0242 -0.0260 0.0003 0.0262 -0.0153 -0.0631 0.0051 0.0106 -0.0577 0.0280 0.0167 -0.0150 0.0522 -0.0037 -0.0143 0.0193 790. (0.00025) RY ( 8) C 12 s( 10.26%)p 1.08( 11.07%)d 5.12( 52.51%) f 2.47( 25.29%)g 0.09( 0.88%) 0.0000 0.0008 0.3165 0.0249 0.0416 -0.0048 0.0046 -0.0026 -0.0452 0.0910 0.1724 0.0130 -0.0862 -0.0961 -0.0310 0.0003 0.0587 0.2198 -0.0327 -0.3742 -0.0252 -0.0712 0.0472 0.0554 -0.0760 0.3660 -0.1126 0.0263 -0.4563 -0.0135 -0.0429 0.0822 -0.0636 0.0009 0.1521 -0.0161 -0.3135 0.0903 0.1570 -0.0443 0.0391 0.0155 -0.1374 0.0520 -0.2418 0.0817 0.0888 0.0077 -0.0193 0.0363 -0.0236 0.0518 -0.0146 0.0015 0.0011 0.0086 0.0595 791. (0.00020) RY ( 9) C 12 s( 14.41%)p 2.29( 32.96%)d 2.56( 36.93%) f 1.04( 14.95%)g 0.05( 0.74%) 0.0000 -0.0005 0.3758 -0.0443 0.0297 -0.0099 0.0031 -0.0026 -0.0103 -0.0663 -0.0249 -0.0025 -0.0834 -0.4324 0.1157 -0.0009 -0.0879 0.3296 -0.0296 0.2745 -0.1871 0.0020 -0.0251 -0.1480 0.0292 0.1824 -0.1757 0.0719 0.0958 -0.3007 0.0597 -0.2510 0.0035 0.0035 -0.0382 0.0071 0.1767 -0.0242 0.0087 0.0233 0.1747 -0.0381 0.0870 0.0260 0.2676 -0.0482 -0.0050 0.0370 0.0441 0.0050 0.0233 -0.0067 0.0006 -0.0017 -0.0574 -0.0398 0.0011 792. (0.00012) RY (10) C 12 s( 2.72%)p17.34( 47.16%)d14.57( 39.61%) f 3.62( 9.86%)g 0.24( 0.65%) 0.0000 0.0000 0.0330 0.1469 0.0669 -0.0069 -0.0001 0.0170 0.0338 -0.0589 -0.0435 0.0133 0.0247 0.4300 -0.0050 -0.0095 0.0505 0.4871 0.1980 0.0588 -0.1094 0.0296 0.3532 0.1128 -0.0190 0.1482 0.3149 -0.0489 0.0888 0.2491 0.0227 -0.1779 0.1072 -0.0703 0.1617 0.0255 0.0873 0.0088 0.0248 -0.0293 0.1128 -0.0493 -0.1004 -0.0075 0.1512 -0.0793 0.0794 -0.0431 0.0434 0.0324 -0.0058 0.0301 0.0004 -0.0179 -0.0213 -0.0170 -0.0399 793. (0.00009) RY (11) C 12 s( 3.47%)p19.26( 66.91%)d 4.25( 14.77%) f 4.07( 14.13%)g 0.21( 0.72%) 794. (0.00007) RY (12) C 12 s( 2.85%)p 8.28( 23.61%)d 9.44( 26.90%) f15.32( 43.67%)g 1.04( 2.97%) 795. (0.00005) RY (13) C 12 s( 4.52%)p 6.15( 27.80%)d 7.80( 35.26%) f 6.78( 30.62%)g 0.40( 1.80%) 796. (0.00004) RY (14) C 12 s( 9.34%)p 1.31( 12.22%)d 5.40( 50.45%) f 2.48( 23.15%)g 0.52( 4.83%) 797. (0.00003) RY (15) C 12 s( 3.49%)p 7.85( 27.44%)d14.17( 49.49%) f 3.97( 13.86%)g 1.64( 5.72%) 798. (0.00002) RY (16) C 12 s( 4.15%)p 5.51( 22.86%)d10.38( 43.10%) f 6.76( 28.07%)g 0.44( 1.82%) 799. (0.00002) RY (17) C 12 s( 4.87%)p 0.55( 2.68%)d11.52( 56.17%) f 6.42( 31.30%)g 1.02( 4.98%) 800. (0.00002) RY (18) C 12 s( 8.96%)p 1.61( 14.39%)d 2.69( 24.12%) f 4.45( 39.91%)g 1.41( 12.63%) 801. (0.00001) RY (19) C 12 s( 7.47%)p 2.89( 21.59%)d 2.67( 19.91%) f 5.54( 41.42%)g 1.29( 9.60%) 802. (0.00000) RY (20) C 12 s( 36.30%)p 0.81( 29.31%)d 0.39( 14.33%) f 0.43( 15.68%)g 0.12( 4.37%) 803. (0.00001) RY (21) C 12 s( 1.29%)p22.51( 28.94%)d21.14( 27.17%) f26.24( 33.73%)g 6.90( 8.87%) 804. (0.00001) RY (22) C 12 s( 2.28%)p10.55( 24.10%)d11.67( 26.66%) f18.03( 41.18%)g 2.53( 5.77%) 805. (0.00000) RY (23) C 12 s( 6.69%)p 0.88( 5.87%)d 1.55( 10.38%) f 4.78( 31.94%)g 6.75( 45.13%) 806. (0.00000) RY (24) C 12 s( 6.77%)p 0.82( 5.52%)d 3.31( 22.37%) f 2.56( 17.31%)g 7.09( 48.02%) 807. (0.00000) RY (25) C 12 s( 23.24%)p 0.54( 12.67%)d 1.14( 26.54%) f 0.83( 19.26%)g 0.79( 18.30%) 808. (0.00000) RY (26) C 12 s( 14.09%)p 1.45( 20.46%)d 2.08( 29.32%) f 1.25( 17.59%)g 1.32( 18.54%) 809. (0.00000) RY (27) C 12 s( 1.37%)p13.78( 18.81%)d29.03( 39.63%) f25.04( 34.19%)g 4.40( 6.01%) 810. (0.00000) RY (28) C 12 s( 3.05%)p 2.45( 7.49%)d12.39( 37.82%) f 9.91( 30.26%)g 7.00( 21.37%) 811. (0.00000) RY (29) C 12 s( 15.25%)p 1.04( 15.80%)d 1.93( 29.44%) f 1.92( 29.29%)g 0.67( 10.22%) 812. (0.00000) RY (30) C 12 s( 7.13%)p 2.02( 14.39%)d 5.56( 39.66%) f 3.83( 27.31%)g 1.61( 11.51%) 813. (0.00000) RY (31) C 12 s( 2.78%)p 9.03( 25.09%)d13.57( 37.72%) f 8.11( 22.54%)g 4.27( 11.87%) 814. (0.00000) RY (32) C 12 s( 16.47%)p 0.92( 15.23%)d 1.74( 28.69%) f 1.85( 30.53%)g 0.55( 9.08%) 815. (0.00000) RY (33) C 12 s( 8.13%)p 2.31( 18.75%)d 4.38( 35.59%) f 4.09( 33.28%)g 0.52( 4.26%) 816. (0.00000) RY (34) C 12 s( 26.27%)p 0.23( 6.00%)d 1.72( 45.13%) f 0.48( 12.69%)g 0.38( 9.91%) 817. (0.00000) RY (35) C 12 s( 59.80%)p 0.00( 0.29%)d 0.05( 3.27%) f 0.28( 16.71%)g 0.33( 19.94%) 818. (0.00000) RY (36) C 12 s( 32.50%)p 0.01( 0.20%)d 0.11( 3.53%) f 0.89( 28.92%)g 1.07( 34.86%) 819. (0.00000) RY (37) C 12 s( 2.90%)p 0.36( 1.06%)d 6.41( 18.60%) f21.98( 63.77%)g 4.71( 13.67%) 820. (0.00000) RY (38) C 12 s( 5.60%)p 0.12( 0.68%)d 0.85( 4.74%) f 6.71( 37.59%)g 9.17( 51.39%) 821. (0.00000) RY (39) C 12 s( 1.92%)p 0.18( 0.35%)d 2.34( 4.50%) f22.59( 43.43%)g25.89( 49.79%) 822. (0.00000) RY (40) C 12 s( 5.56%)p 0.23( 1.28%)d 3.06( 17.04%) f 9.61( 53.44%)g 4.08( 22.68%) 823. (0.00000) RY (41) C 12 s( 3.18%)p 0.71( 2.26%)d 9.91( 31.50%) f10.85( 34.50%)g 8.99( 28.57%) 824. (0.00000) RY (42) C 12 s( 12.95%)p 0.18( 2.27%)d 2.75( 35.67%) f 2.27( 29.45%)g 1.52( 19.66%) 825. (0.00000) RY (43) C 12 s( 3.72%)p 0.49( 1.80%)d10.31( 38.35%) f11.22( 41.75%)g 3.86( 14.38%) 826. (0.00000) RY (44) C 12 s( 3.12%)p 0.32( 0.99%)d 7.96( 24.86%) f 7.26( 22.68%)g15.47( 48.34%) 827. (0.00000) RY (45) C 12 s( 0.76%)p 1.59( 1.22%)d16.41( 12.54%) f65.20( 49.83%)g46.64( 35.65%) 828. (0.00000) RY (46) C 12 s( 0.56%)p 7.47( 4.19%)d12.33( 6.91%) f65.21( 36.55%)g92.40( 51.79%) 829. (0.00000) RY (47) C 12 s( 2.05%)p 0.83( 1.71%)d15.50( 31.83%) f 5.87( 12.05%)g25.49( 52.35%) 830. (0.00000) RY (48) C 12 s( 25.91%)p 0.02( 0.48%)d 0.94( 24.23%) f 0.72( 18.78%)g 1.18( 30.61%) 831. (0.00000) RY (49) C 12 s( 0.41%)p 3.55( 1.44%)d71.40( 28.94%) f53.28( 21.60%)g99.99( 47.62%) 832. (0.00000) RY (50) C 12 s( 7.12%)p 1.13( 8.05%)d 1.82( 12.94%) f 2.74( 19.52%)g 7.35( 52.35%) 833. (0.00000) RY (51) C 12 s( 6.49%)p 2.31( 14.96%)d 3.46( 22.44%) f 5.51( 35.78%)g 3.13( 20.33%) 834. (0.00000) RY (52) C 12 s( 23.67%)p 0.11( 2.54%)d 1.15( 27.24%) f 1.06( 25.08%)g 0.91( 21.48%) 835. (0.00433) RY ( 1) C 13 s( 1.15%)p77.15( 88.82%)d 7.64( 8.80%) f 0.96( 1.11%)g 0.11( 0.12%) 0.0000 -0.0045 0.0966 0.0432 -0.0130 -0.0115 0.0006 0.0165 -0.3178 -0.0177 0.0049 -0.0088 0.8821 -0.0865 0.0069 0.0014 -0.0306 -0.0019 0.0018 0.0939 0.0813 0.0033 0.0362 -0.0378 0.0018 0.0172 0.0172 0.0005 0.1958 -0.1246 0.0003 -0.0612 0.1073 -0.0082 0.0030 -0.0050 -0.0080 -0.0122 0.0352 0.0069 0.0047 0.0046 -0.0247 -0.0029 0.0202 0.0085 -0.0912 -0.0099 -0.0183 0.0126 -0.0023 0.0191 -0.0094 -0.0069 0.0055 -0.0112 0.0095 836. (0.00332) RY ( 2) C 13 s( 6.96%)p 9.42( 65.56%)d 3.58( 24.95%) f 0.35( 2.44%)g 0.01( 0.09%) 0.0000 0.0189 0.2439 0.0976 -0.0059 0.0145 -0.0007 -0.0252 0.7679 -0.0841 0.0092 -0.0280 0.2360 -0.0278 -0.0002 -0.0071 0.0166 -0.0233 -0.0020 0.1259 -0.0187 -0.0096 -0.0237 0.0771 0.0020 0.0274 -0.0162 0.0019 0.2291 0.0367 0.0129 0.2372 -0.3396 0.0100 0.0094 0.0026 0.0616 -0.0019 0.0459 -0.0034 -0.0199 0.0008 -0.0265 0.0041 -0.0755 0.0008 -0.1059 0.0194 0.0210 -0.0101 0.0022 -0.0093 0.0055 0.0009 0.0009 -0.0073 0.0117 837. (0.00283) RY ( 3) C 13 s( 0.11%)p99.99( 95.26%)d 5.43( 0.62%) f34.52( 3.97%)g 0.28( 0.03%) 0.0000 -0.0022 0.0286 -0.0181 0.0002 -0.0008 0.0001 0.0057 0.0496 0.0292 0.0074 -0.0033 -0.0159 0.0126 0.0041 -0.0459 -0.9591 -0.1595 -0.0378 -0.0321 0.0132 -0.0030 -0.0124 0.0310 0.0305 -0.0048 -0.0115 0.0073 -0.0124 -0.0188 -0.0047 -0.0211 0.0416 0.0084 -0.1804 0.0484 0.0559 -0.0159 -0.0145 0.0012 0.0201 0.0018 -0.0225 -0.0035 0.0051 0.0008 0.0161 -0.0011 0.0037 0.0166 0.0024 -0.0025 -0.0004 -0.0008 -0.0022 0.0002 -0.0033 838. (0.00117) RY ( 4) C 13 s( 52.85%)p 0.21( 11.34%)d 0.61( 32.07%) f 0.06( 3.21%)g 0.01( 0.53%) 0.0000 0.0034 0.7055 -0.1748 -0.0156 -0.0025 0.0010 -0.0273 -0.0961 0.1340 0.0572 -0.0590 -0.0336 0.2735 0.0351 -0.0004 0.0365 0.0128 0.0070 -0.5108 0.0952 -0.0587 0.0096 -0.0518 -0.0053 -0.0297 -0.0163 0.0037 0.0053 -0.1872 -0.0210 0.0707 -0.0469 0.0249 0.0518 -0.0147 0.0199 -0.0015 -0.1377 0.0372 0.0206 0.0008 0.0504 -0.0065 0.0272 0.0335 0.0591 0.0119 0.0079 -0.0054 0.0086 -0.0002 0.0377 -0.0060 -0.0211 -0.0345 -0.0449 839. (0.00087) RY ( 5) C 13 s( 0.14%)p59.10( 8.48%)d99.99( 87.07%) f29.09( 4.18%)g 0.90( 0.13%) 0.0000 -0.0042 0.0340 0.0153 0.0040 -0.0031 0.0000 0.0071 -0.0094 -0.0216 -0.0218 0.0128 -0.0154 0.0073 -0.0100 -0.0024 -0.0101 0.2656 0.1120 0.0781 0.0953 0.0073 -0.1781 -0.0844 -0.0575 -0.2759 -0.8545 -0.0160 0.0571 0.0194 0.0074 -0.0452 0.0287 -0.0112 -0.1421 0.0230 0.0491 -0.0011 0.0266 0.0170 0.0400 0.0430 0.0583 0.1012 -0.0005 -0.0098 -0.0114 -0.0174 -0.0013 0.0146 0.0244 -0.0002 -0.0164 0.0122 -0.0064 0.0021 0.0036 840. (0.00046) RY ( 6) C 13 s( 0.08%)p99.99( 11.24%)d99.99( 19.84%) f99.99( 66.60%)g29.36( 2.23%) 0.0000 0.0007 0.0265 0.0066 -0.0031 -0.0027 0.0002 -0.0033 -0.0290 0.0045 0.0446 -0.0024 0.0017 0.0117 -0.0036 0.0150 0.1893 0.0183 -0.2703 -0.0336 -0.0033 0.0060 -0.0776 0.4038 0.0769 0.0968 0.0214 -0.0592 0.0055 -0.0576 -0.0122 -0.0115 0.0696 0.0214 -0.6465 0.2134 0.2375 -0.0776 -0.0799 0.0162 0.1615 -0.0626 -0.3114 0.0600 -0.0240 0.0135 0.0460 -0.0067 0.0475 0.1056 -0.0228 -0.0409 0.0273 -0.0336 0.0681 0.0014 -0.0149 841. (0.00033) RY ( 7) C 13 s( 5.86%)p 1.38( 8.07%)d12.90( 75.59%) f 1.57( 9.21%)g 0.22( 1.27%) 0.0000 -0.0084 0.2206 -0.0631 0.0715 0.0278 0.0004 0.0146 0.1504 -0.1187 -0.0888 0.0011 -0.1740 0.0094 -0.0445 0.0034 0.0331 -0.0397 -0.0290 0.1753 0.1351 -0.0112 0.1827 -0.0738 -0.0090 0.0580 0.0514 0.0039 0.4719 0.1118 -0.0556 -0.4626 0.4564 0.0346 0.0682 -0.0224 0.1988 -0.0673 -0.0157 -0.0131 -0.0463 0.0052 0.0135 -0.0134 -0.1592 0.0051 0.0932 -0.0767 -0.0813 0.0477 -0.0093 0.0365 -0.0137 -0.0020 0.0037 0.0469 0.0043 842. (0.00028) RY ( 8) C 13 s( 22.55%)p 1.58( 35.68%)d 1.63( 36.71%) f 0.18( 3.99%)g 0.05( 1.06%) 0.0000 -0.0082 0.4718 -0.0322 0.0400 0.0162 0.0004 0.0052 -0.1909 0.2873 -0.0273 0.0033 -0.1501 -0.4565 0.0719 -0.0002 -0.0127 0.0155 0.0244 0.4629 -0.3460 0.1184 -0.0483 0.0358 -0.0103 -0.0278 0.0350 -0.0007 -0.0378 -0.0254 0.0389 0.0646 -0.0606 0.0436 -0.0065 0.0029 0.0381 -0.0026 0.0791 -0.0434 -0.0537 0.0076 -0.0054 0.0063 0.1378 -0.0438 0.0778 0.0168 -0.0065 -0.0303 -0.0045 -0.0793 -0.0391 0.0271 0.0121 0.0310 -0.0026 843. (0.00016) RY ( 9) C 13 s( 0.16%)p20.00( 3.13%)d99.99( 53.51%) f99.99( 41.81%)g 8.90( 1.39%) 0.0000 0.0019 -0.0176 0.0351 -0.0003 -0.0044 0.0014 -0.0013 0.0194 0.0024 -0.0135 0.0008 0.0079 0.0887 -0.0340 0.0004 0.0104 -0.0125 0.1462 -0.0112 -0.0027 -0.0134 -0.1695 0.2897 -0.0914 -0.5768 0.2079 -0.1121 0.0611 -0.0712 -0.0058 -0.1248 0.0197 -0.0221 -0.0790 0.0335 -0.0688 0.0282 -0.0761 0.0296 -0.6045 0.1506 -0.0846 0.0039 0.0447 0.0028 -0.0355 0.0048 -0.0358 -0.0823 0.0465 0.0384 0.0194 0.0151 0.0331 -0.0209 -0.0088 844. (0.00009) RY (10) C 13 s( 17.05%)p 0.90( 15.29%)d 1.65( 28.10%) f 2.20( 37.58%)g 0.12( 1.99%) 845. (0.00007) RY (11) C 13 s( 0.13%)p99.99( 53.71%)d99.99( 32.62%) f94.61( 12.69%)g 6.36( 0.85%) 846. (0.00007) RY (12) C 13 s( 3.99%)p 6.52( 26.02%)d12.33( 49.19%) f 4.94( 19.69%)g 0.28( 1.10%) 847. (0.00005) RY (13) C 13 s( 5.07%)p 3.72( 18.86%)d12.01( 60.94%) f 2.33( 11.81%)g 0.66( 3.33%) 848. (0.00004) RY (14) C 13 s( 12.18%)p 3.59( 43.68%)d 2.26( 27.52%) f 1.22( 14.82%)g 0.15( 1.81%) 849. (0.00003) RY (15) C 13 s( 1.33%)p24.01( 31.97%)d33.71( 44.88%) f13.08( 17.41%)g 3.31( 4.41%) 850. (0.00002) RY (16) C 13 s( 0.44%)p24.56( 10.77%)d99.99( 58.29%) f64.46( 28.26%)g 5.13( 2.25%) 851. (0.00002) RY (17) C 13 s( 0.53%)p27.41( 14.60%)d78.50( 41.83%) f71.36( 38.02%)g 9.42( 5.02%) 852. (0.00002) RY (18) C 13 s( 3.56%)p 4.94( 17.60%)d 8.80( 31.32%) f10.04( 35.73%)g 3.31( 11.79%) 853. (0.00001) RY (19) C 13 s( 0.13%)p99.99( 24.73%)d99.99( 31.22%) f99.99( 41.35%)g19.03( 2.57%) 854. (0.00001) RY (20) C 13 s( 20.55%)p 0.77( 15.74%)d 1.17( 24.07%) f 1.86( 38.17%)g 0.07( 1.48%) 855. (0.00001) RY (21) C 13 s( 21.77%)p 0.82( 17.80%)d 1.61( 35.16%) f 0.77( 16.67%)g 0.39( 8.59%) 856. (0.00000) RY (22) C 13 s( 32.52%)p 0.70( 22.71%)d 0.97( 31.61%) f 0.21( 6.91%)g 0.19( 6.25%) 857. (0.00000) RY (23) C 13 s( 11.96%)p 1.73( 20.64%)d 1.67( 19.93%) f 1.07( 12.79%)g 2.90( 34.67%) 858. (0.00000) RY (24) C 13 s( 19.09%)p 0.77( 14.65%)d 1.05( 19.95%) f 1.16( 22.20%)g 1.26( 24.11%) 859. (0.00000) RY (25) C 13 s( 6.45%)p 1.69( 10.90%)d 5.60( 36.09%) f 4.02( 25.96%)g 3.19( 20.60%) 860. (0.00000) RY (26) C 13 s( 3.30%)p 8.60( 28.40%)d 6.42( 21.21%) f11.06( 36.53%)g 3.20( 10.56%) 861. (0.00000) RY (27) C 13 s( 3.38%)p 7.35( 24.87%)d 7.51( 25.43%) f 8.53( 28.87%)g 5.15( 17.44%) 862. (0.00000) RY (28) C 13 s( 1.22%)p 3.03( 3.70%)d11.33( 13.83%) f45.48( 55.50%)g21.10( 25.75%) 863. (0.00000) RY (29) C 13 s( 4.38%)p 8.37( 36.64%)d10.29( 45.04%) f 2.50( 10.94%)g 0.69( 3.01%) 864. (0.00000) RY (30) C 13 s( 3.97%)p 3.60( 14.27%)d15.33( 60.81%) f 4.72( 18.74%)g 0.56( 2.22%) 865. (0.00000) RY (31) C 13 s( 27.45%)p 0.25( 6.81%)d 1.07( 29.46%) f 0.98( 26.97%)g 0.34( 9.31%) 866. (0.00000) RY (32) C 13 s( 1.45%)p16.72( 24.23%)d26.59( 38.52%) f22.53( 32.64%)g 2.18( 3.16%) 867. (0.00000) RY (33) C 13 s( 3.83%)p 8.26( 31.64%)d 6.28( 24.06%) f 9.13( 34.97%)g 1.44( 5.50%) 868. (0.00000) RY (34) C 13 s( 75.42%)p 0.01( 0.58%)d 0.04( 3.38%) f 0.05( 4.10%)g 0.22( 16.52%) 869. (0.00000) RY (35) C 13 s( 11.42%)p 0.03( 0.38%)d 0.68( 7.77%) f 3.18( 36.34%)g 3.86( 44.09%) 870. (0.00000) RY (36) C 13 s( 3.95%)p 0.33( 1.30%)d 2.74( 10.83%) f 2.05( 8.11%)g19.19( 75.82%) 871. (0.00000) RY (37) C 13 s( 2.48%)p 0.85( 2.10%)d 4.44( 11.00%) f10.47( 25.91%)g23.63( 58.51%) 872. (0.00000) RY (38) C 13 s( 5.51%)p 0.51( 2.80%)d 2.48( 13.65%) f 6.86( 37.85%)g 7.29( 40.18%) 873. (0.00000) RY (39) C 13 s( 1.69%)p 0.42( 0.71%)d 7.95( 13.47%) f28.23( 47.80%)g21.45( 36.32%) 874. (0.00000) RY (40) C 13 s( 6.00%)p 0.14( 0.84%)d 1.84( 11.03%) f 4.92( 29.51%)g 8.78( 52.63%) 875. (0.00000) RY (41) C 13 s( 7.17%)p 0.06( 0.43%)d 2.77( 19.86%) f 5.16( 37.04%)g 4.95( 35.50%) 876. (0.00000) RY (42) C 13 s( 3.99%)p 0.19( 0.75%)d 6.98( 27.86%) f 9.71( 38.78%)g 7.17( 28.61%) 877. (0.00000) RY (43) C 13 s( 1.68%)p 1.74( 2.91%)d21.73( 36.42%) f12.47( 20.90%)g22.72( 38.09%) 878. (0.00000) RY (44) C 13 s( 32.34%)p 0.02( 0.63%)d 0.31( 10.15%) f 1.19( 38.62%)g 0.56( 18.25%) 879. (0.00000) RY (45) C 13 s( 1.00%)p 0.23( 0.23%)d23.08( 23.06%) f43.59( 43.54%)g32.20( 32.17%) 880. (0.00000) RY (46) C 13 s( 0.37%)p 8.79( 3.25%)d42.95( 15.86%) f99.18( 36.61%)g99.99( 43.92%) 881. (0.00000) RY (47) C 13 s( 5.68%)p 0.54( 3.09%)d 1.54( 8.76%) f 8.90( 50.59%)g 5.61( 31.88%) 882. (0.00000) RY (48) C 13 s( 12.93%)p 0.34( 4.36%)d 0.61( 7.85%) f 4.68( 60.49%)g 1.11( 14.36%) 883. (0.00000) RY (49) C 13 s( 14.74%)p 0.45( 6.66%)d 0.55( 8.12%) f 2.94( 43.40%)g 1.84( 27.09%) 884. (0.00000) RY (50) C 13 s( 14.40%)p 0.25( 3.62%)d 1.54( 22.23%) f 2.38( 34.28%)g 1.77( 25.46%) 885. (0.00000) RY (51) C 13 s( 1.64%)p 2.29( 3.75%)d20.40( 33.40%) f17.10( 27.99%)g20.29( 33.22%) 886. (0.00000) RY (52) C 13 s( 2.01%)p 2.39( 4.81%)d22.05( 44.31%) f 8.04( 16.17%)g16.28( 32.71%) 887. (0.00502) RY ( 1) C 14 s( 17.02%)p 3.95( 67.25%)d 0.86( 14.70%) f 0.06( 1.00%)g 0.00( 0.04%) 0.0000 0.0033 0.4108 0.0332 -0.0144 -0.0066 0.0003 -0.0079 0.1511 0.0177 0.0125 -0.0316 0.7959 0.0358 0.0256 -0.0007 0.0923 0.0639 -0.0067 -0.0938 0.1025 -0.0093 -0.0367 -0.0007 0.0029 -0.0677 -0.0216 0.0080 0.2647 -0.1031 0.0164 0.1761 -0.0950 0.0097 -0.0331 -0.0046 -0.0155 0.0169 -0.0562 0.0054 -0.0042 0.0015 0.0667 0.0006 0.0021 0.0027 -0.0262 0.0030 -0.0018 0.0160 0.0044 -0.0059 -0.0057 0.0056 -0.0022 0.0024 -0.0040 888. (0.00353) RY ( 2) C 14 s( 1.33%)p54.86( 73.04%)d17.57( 23.40%) f 1.55( 2.06%)g 0.13( 0.17%) 0.0000 0.0116 -0.0513 0.1016 -0.0013 0.0147 -0.0009 -0.0208 -0.0163 -0.1483 -0.0252 0.0141 0.0526 -0.0799 -0.0028 0.0049 -0.8336 0.0536 -0.0056 0.0630 0.1226 0.0142 0.1026 -0.2254 -0.0220 -0.2349 0.1083 -0.0131 0.2088 -0.0746 0.0233 -0.0709 0.1763 -0.0037 0.0481 0.0068 -0.0203 -0.0217 -0.0778 0.0203 0.0097 0.0175 0.0921 -0.0093 0.0178 -0.0130 0.0310 -0.0209 -0.0067 -0.0280 -0.0078 0.0009 0.0211 0.0098 -0.0156 -0.0066 -0.0042 889. (0.00334) RY ( 3) C 14 s( 1.44%)p61.59( 88.57%)d 4.76( 6.84%) f 2.13( 3.06%)g 0.06( 0.09%) 0.0000 0.0111 0.1192 -0.0037 -0.0008 0.0050 -0.0006 0.0208 0.8754 0.1335 0.0342 -0.0360 -0.2907 0.0662 -0.0042 0.0336 0.0027 0.0924 -0.0034 -0.1156 0.0028 -0.0142 0.0791 -0.1219 0.0225 0.0121 0.0143 0.0032 0.0943 -0.1321 -0.0144 -0.0180 0.0729 0.0260 -0.1008 0.0269 -0.0511 -0.0010 0.0126 -0.0022 0.0969 -0.0258 -0.0383 -0.0025 0.0114 -0.0001 -0.0667 0.0288 -0.0119 -0.0106 0.0136 0.0095 -0.0137 0.0069 -0.0074 0.0049 0.0087 890. (0.00195) RY ( 4) C 14 s( 24.04%)p 1.48( 35.48%)d 1.47( 35.23%) f 0.20( 4.83%)g 0.02( 0.44%) 0.0000 0.0097 0.4743 -0.1238 -0.0037 0.0036 0.0000 -0.0335 -0.2914 0.1083 0.0272 -0.0509 -0.2502 0.3826 0.0274 0.0042 -0.2077 -0.0241 -0.0150 -0.3316 -0.0806 -0.0404 0.1564 -0.1002 0.0237 0.3521 0.0018 0.0432 0.0701 -0.2227 0.0049 0.1119 -0.0780 0.0087 0.0802 -0.0128 -0.0431 0.0095 0.0617 0.0091 -0.1122 0.0099 -0.0706 -0.0161 -0.1146 0.0481 -0.0371 0.0328 0.0091 -0.0262 0.0316 -0.0168 -0.0447 0.0014 0.0104 0.0134 0.0047 891. (0.00092) RY ( 5) C 14 s( 6.64%)p 1.45( 9.64%)d11.69( 77.71%) f 0.87( 5.77%)g 0.04( 0.24%) 0.0000 -0.0101 0.2558 -0.0298 0.0039 0.0007 0.0002 0.0064 -0.0508 -0.1127 -0.0509 0.0075 -0.1835 0.1007 0.0410 -0.0028 0.1061 -0.1433 -0.0334 0.1252 0.6492 0.0183 -0.0086 0.2050 -0.0354 0.0398 0.3892 0.0006 0.2189 0.2759 0.0565 -0.0937 0.0796 -0.0289 -0.0857 0.0266 0.0311 0.0139 0.0596 0.0674 0.1285 0.0125 -0.0464 0.0701 0.0875 -0.0540 -0.0701 -0.0342 0.0010 -0.0130 0.0045 0.0250 -0.0082 -0.0011 -0.0155 -0.0338 -0.0109 892. (0.00044) RY ( 6) C 14 s( 0.01%)p99.99( 10.67%)d99.99( 21.65%) f99.99( 65.24%)g99.99( 2.44%) 0.0000 -0.0002 0.0052 -0.0050 -0.0016 0.0090 0.0000 -0.0121 -0.1463 -0.0979 0.2154 -0.0007 0.0230 0.0230 -0.0821 -0.0080 -0.0833 0.0387 0.1135 -0.0419 -0.1021 0.0428 -0.1175 0.2396 0.0638 0.0360 -0.1615 0.0004 0.0546 -0.1987 -0.0189 -0.0314 0.2294 0.0578 -0.4596 0.1412 -0.2205 0.0499 -0.1392 0.0031 0.3267 -0.1290 -0.3888 0.0925 0.2347 -0.0665 -0.0742 0.0511 -0.1228 0.0107 -0.0329 0.0578 -0.0553 -0.0225 0.0257 -0.0188 -0.0124 893. (0.00036) RY ( 7) C 14 s( 8.70%)p 1.22( 10.59%)d 7.55( 65.68%) f 1.64( 14.25%)g 0.09( 0.77%) 0.0000 -0.0089 0.2879 -0.0345 0.0381 0.0379 0.0002 0.0067 0.0340 -0.0510 -0.0819 0.0022 -0.2219 -0.0157 -0.0653 -0.0119 -0.1287 0.1443 0.0644 0.2532 -0.1034 -0.0020 -0.5400 0.1141 0.0395 -0.2068 -0.0615 0.0076 -0.0446 0.1575 -0.0017 0.4389 -0.0936 -0.0309 0.1735 -0.0475 -0.3149 0.0552 0.0050 -0.0310 -0.0074 0.0093 0.0298 0.0122 -0.0290 0.0031 -0.0695 0.0059 0.0298 0.0393 -0.0305 -0.0178 -0.0036 -0.0540 0.0127 0.0065 0.0303 894. (0.00025) RY ( 8) C 14 s( 0.55%)p11.40( 6.31%)d91.34( 50.56%) f75.10( 41.57%)g 1.81( 1.00%) 0.0000 0.0047 0.0678 0.0173 0.0203 -0.0142 0.0019 -0.0035 -0.0181 0.0673 0.1689 0.0051 0.0448 -0.0247 -0.0433 0.0035 -0.1069 -0.1098 0.0411 -0.3944 0.1520 -0.0546 -0.1072 -0.0378 0.0325 -0.2945 0.0842 -0.0159 -0.4192 0.1648 -0.0731 -0.0307 -0.0740 0.0351 -0.3731 0.0812 -0.0903 0.0443 0.2526 -0.0575 0.0900 -0.0222 0.1599 -0.0273 -0.3708 0.0984 0.1002 -0.0243 -0.0377 0.0276 0.0257 0.0580 -0.0180 -0.0016 -0.0039 0.0302 0.0505 895. (0.00019) RY ( 9) C 14 s( 21.90%)p 1.77( 38.74%)d 1.35( 29.57%) f 0.41( 8.88%)g 0.04( 0.91%) 0.0000 0.0012 0.4653 0.0123 0.0447 -0.0161 0.0044 -0.0039 -0.0422 0.1777 0.0513 0.0000 -0.0938 -0.4260 0.1100 0.0035 0.0360 -0.3840 0.0159 0.1969 -0.2128 -0.0118 0.0764 0.0179 0.0172 -0.2483 0.1227 -0.0754 -0.1079 -0.2421 0.0245 -0.2275 0.0066 0.0028 -0.0257 0.0098 0.0290 0.0150 0.0751 -0.0069 -0.1441 0.0210 -0.0182 -0.0316 0.2274 -0.0337 0.0658 0.0395 0.0209 -0.0412 -0.0012 0.0307 0.0304 -0.0123 0.0576 -0.0410 -0.0008 896. (0.00011) RY (10) C 14 s( 3.02%)p15.34( 46.33%)d14.98( 45.25%) f 1.62( 4.90%)g 0.17( 0.51%) 0.0000 -0.0060 0.0075 0.1587 0.0701 0.0002 0.0010 0.0178 0.0069 0.1492 -0.0034 0.0175 0.0005 0.4798 -0.0523 0.0072 0.0246 -0.4221 -0.1691 -0.0636 -0.1282 0.0102 -0.2967 -0.1186 0.0438 -0.2025 -0.3078 0.0291 0.1961 0.2207 0.0207 -0.2644 0.1756 -0.0537 0.0339 -0.0255 0.0533 0.0047 -0.0668 -0.0257 -0.0023 -0.0022 0.1133 0.0141 0.1136 -0.0858 0.0619 -0.0449 0.0217 -0.0292 -0.0155 0.0310 0.0158 -0.0139 -0.0082 -0.0014 -0.0450 897. (0.00008) RY (11) C 14 s( 0.43%)p89.50( 38.15%)d80.85( 34.46%) f59.75( 25.47%)g 3.48( 1.48%) 898. (0.00006) RY (12) C 14 s( 1.98%)p19.91( 39.42%)d16.06( 31.79%) f12.31( 24.37%)g 1.23( 2.44%) 899. (0.00005) RY (13) C 14 s( 10.38%)p 2.53( 26.29%)d 2.22( 23.10%) f 3.70( 38.44%)g 0.17( 1.79%) 900. (0.00004) RY (14) C 14 s( 7.22%)p 2.02( 14.62%)d 8.64( 62.44%) f 1.54( 11.09%)g 0.64( 4.62%) 901. (0.00003) RY (15) C 14 s( 4.91%)p 6.79( 33.33%)d 5.32( 26.12%) f 5.91( 29.02%)g 1.35( 6.63%) 902. (0.00002) RY (16) C 14 s( 2.24%)p 7.65( 17.15%)d25.76( 57.77%) f 9.65( 21.65%)g 0.53( 1.20%) 903. (0.00002) RY (17) C 14 s( 1.93%)p 4.41( 8.52%)d16.02( 30.93%) f26.05( 50.30%)g 4.31( 8.32%) 904. (0.00001) RY (18) C 14 s( 7.48%)p 2.08( 15.60%)d 4.21( 31.48%) f 5.56( 41.62%)g 0.51( 3.82%) 905. (0.00001) RY (19) C 14 s( 29.49%)p 0.56( 16.40%)d 1.15( 33.80%) f 0.55( 16.35%)g 0.13( 3.96%) 906. (0.00001) RY (20) C 14 s( 4.17%)p 2.43( 10.13%)d 6.81( 28.40%) f 8.75( 36.46%)g 5.00( 20.85%) 907. (0.00000) RY (21) C 14 s( 3.11%)p 2.83( 8.80%)d10.88( 33.79%) f 7.87( 24.46%)g 9.61( 29.84%) 908. (0.00000) RY (22) C 14 s( 8.57%)p 0.39( 3.35%)d 2.21( 18.91%) f 2.52( 21.60%)g 5.55( 47.58%) 909. (0.00000) RY (23) C 14 s( 10.74%)p 0.97( 10.37%)d 3.29( 35.31%) f 2.43( 26.12%)g 1.63( 17.47%) 910. (0.00000) RY (24) C 14 s( 20.80%)p 0.59( 12.30%)d 2.08( 43.27%) f 0.79( 16.43%)g 0.35( 7.19%) 911. (0.00000) RY (25) C 14 s( 19.59%)p 0.73( 14.32%)d 1.06( 20.82%) f 1.65( 32.33%)g 0.66( 12.95%) 912. (0.00000) RY (26) C 14 s( 4.66%)p 6.20( 28.87%)d 5.29( 24.63%) f 5.81( 27.04%)g 3.18( 14.81%) 913. (0.00000) RY (27) C 14 s( 5.74%)p 2.06( 11.82%)d 9.78( 56.11%) f 3.24( 18.59%)g 1.35( 7.74%) 914. (0.00000) RY (28) C 14 s( 8.59%)p 0.94( 8.05%)d 5.42( 46.55%) f 2.66( 22.88%)g 1.62( 13.93%) 915. (0.00000) RY (29) C 14 s( 1.91%)p11.49( 21.93%)d 7.25( 13.83%) f26.59( 50.76%)g 6.06( 11.57%) 916. (0.00000) RY (30) C 14 s( 2.78%)p 3.59( 9.98%)d21.80( 60.60%) f 7.80( 21.68%)g 1.79( 4.97%) 917. (0.00000) RY (31) C 14 s( 34.48%)p 0.87( 30.08%)d 0.53( 18.23%) f 0.46( 15.78%)g 0.04( 1.42%) 918. (0.00000) RY (32) C 14 s( 5.58%)p 3.29( 18.34%)d 7.83( 43.63%) f 5.12( 28.56%)g 0.70( 3.90%) 919. (0.00000) RY (33) C 14 s( 9.95%)p 2.18( 21.72%)d 2.99( 29.76%) f 3.07( 30.53%)g 0.81( 8.04%) 920. (0.00001) RY (34) C 14 s( 1.26%)p35.25( 44.44%)d14.89( 18.77%) f20.52( 25.86%)g 7.67( 9.67%) 921. (0.00000) RY (35) C 14 s( 85.02%)p 0.00( 0.05%)d 0.02( 1.96%) f 0.09( 7.57%)g 0.06( 5.40%) 922. (0.00000) RY (36) C 14 s( 10.50%)p 0.07( 0.69%)d 0.72( 7.53%) f 4.11( 43.21%)g 3.62( 38.06%) 923. (0.00000) RY (37) C 14 s( 1.12%)p 0.24( 0.27%)d 1.65( 1.85%) f42.65( 47.87%)g43.56( 48.90%) 924. (0.00000) RY (38) C 14 s( 2.31%)p 0.21( 0.49%)d 2.99( 6.91%) f25.06( 57.90%)g14.02( 32.39%) 925. (0.00000) RY (39) C 14 s( 7.17%)p 0.18( 1.30%)d 0.82( 5.85%) f 8.19( 58.70%)g 3.76( 26.98%) 926. (0.00000) RY (40) C 14 s( 4.65%)p 0.85( 3.96%)d 3.91( 18.19%) f 7.27( 33.78%)g 8.48( 39.42%) 927. (0.00000) RY (41) C 14 s( 2.67%)p 0.39( 1.04%)d 2.52( 6.73%) f28.44( 76.06%)g 5.05( 13.49%) 928. (0.00000) RY (42) C 14 s( 2.34%)p 0.55( 1.29%)d16.54( 38.68%) f 4.66( 10.89%)g20.01( 46.80%) 929. (0.00000) RY (43) C 14 s( 7.62%)p 0.04( 0.29%)d 2.53( 19.25%) f 2.28( 17.35%)g 7.28( 55.49%) 930. (0.00000) RY (44) C 14 s( 3.02%)p 0.27( 0.80%)d 1.59( 4.82%) f11.70( 35.36%)g18.52( 56.00%) 931. (0.00000) RY (45) C 14 s( 1.22%)p 1.01( 1.24%)d 6.23( 7.62%) f27.84( 34.05%)g45.69( 55.88%) 932. (0.00000) RY (46) C 14 s( 12.90%)p 0.29( 3.81%)d 2.13( 27.49%) f 2.31( 29.78%)g 2.02( 26.03%) 933. (0.00000) RY (47) C 14 s( 34.78%)p 0.07( 2.31%)d 0.51( 17.71%) f 0.60( 21.01%)g 0.70( 24.20%) 934. (0.00000) RY (48) C 14 s( 2.59%)p 2.43( 6.29%)d 9.30( 24.04%) f 8.61( 22.26%)g17.33( 44.82%) 935. (0.00000) RY (49) C 14 s( 12.86%)p 0.30( 3.81%)d 2.17( 27.85%) f 1.91( 24.55%)g 2.41( 30.93%) 936. (0.00000) RY (50) C 14 s( 4.50%)p 0.62( 2.78%)d 8.76( 39.45%) f 4.24( 19.08%)g 7.60( 34.19%) 937. (0.00000) RY (51) C 14 s( 7.43%)p 0.32( 2.37%)d 3.06( 22.75%) f 3.91( 29.06%)g 5.17( 38.40%) 938. (0.00000) RY (52) C 14 s( 4.74%)p 3.74( 17.73%)d 5.35( 25.36%) f 4.72( 22.39%)g 6.28( 29.77%) 939. (0.00554) RY ( 1) C 15 s( 14.79%)p 4.73( 70.03%)d 0.94( 13.98%) f 0.08( 1.13%)g 0.00( 0.07%) 0.0000 0.0004 0.3832 0.0292 -0.0129 -0.0101 0.0003 -0.0114 0.3361 0.0076 -0.0001 -0.0306 0.7431 0.0167 0.0291 -0.0018 0.1788 0.0275 -0.0082 -0.2073 0.0629 -0.0002 0.0275 -0.0454 0.0031 -0.0806 -0.0072 0.0093 0.1965 -0.1249 0.0120 0.1439 -0.0904 0.0115 -0.0334 0.0118 -0.0269 -0.0096 -0.0110 0.0091 -0.0548 -0.0103 -0.0258 0.0026 -0.0701 0.0080 -0.0122 0.0120 0.0121 -0.0018 0.0006 -0.0031 0.0150 0.0015 0.0177 0.0019 0.0023 940. (0.00404) RY ( 2) C 15 s( 3.69%)p19.82( 73.05%)d 5.99( 22.10%) f 0.28( 1.05%)g 0.03( 0.12%) 0.0000 0.0191 0.1767 0.0708 -0.0046 0.0157 -0.0011 0.0074 -0.6730 0.1301 0.0034 -0.0310 0.2002 0.0545 0.0039 0.0227 -0.4583 0.0773 -0.0043 -0.1408 0.0291 -0.0028 -0.2099 0.2999 0.0085 -0.0025 -0.1048 0.0072 0.1742 -0.0656 0.0170 0.1187 -0.0769 0.0140 -0.0318 -0.0015 0.0112 0.0115 -0.0303 0.0019 0.0027 0.0129 -0.0754 0.0038 -0.0351 0.0148 -0.0310 0.0011 -0.0254 -0.0090 0.0034 0.0166 -0.0079 -0.0052 0.0025 -0.0043 0.0058 941. (0.00323) RY ( 3) C 15 s( 0.93%)p99.99( 93.99%)d 1.80( 1.68%) f 3.60( 3.36%)g 0.03( 0.03%) 0.0000 0.0024 0.0963 0.0002 -0.0028 0.0057 -0.0003 0.0337 0.5534 0.0212 0.0100 -0.0151 -0.1155 -0.0439 0.0017 -0.0327 -0.7768 -0.1086 -0.0134 -0.0019 0.0503 -0.0155 -0.0336 0.0419 -0.0008 0.0106 -0.0470 0.0071 -0.0136 0.0391 0.0077 0.0643 -0.0510 -0.0166 0.0326 -0.0030 0.1288 -0.0294 -0.0359 0.0057 -0.0973 0.0309 0.0489 -0.0154 0.0190 -0.0056 -0.0146 0.0099 -0.0092 0.0109 -0.0060 0.0001 -0.0069 0.0006 0.0050 -0.0003 -0.0023 942. (0.00146) RY ( 4) C 15 s( 20.81%)p 1.75( 36.48%)d 1.80( 37.40%) f 0.24( 4.92%)g 0.02( 0.39%) 0.0000 0.0008 0.4382 -0.1257 -0.0036 -0.0152 0.0013 -0.0106 0.0110 0.2280 -0.0042 -0.0458 -0.3398 0.4257 0.0478 0.0060 0.1050 0.0148 -0.0111 0.1793 0.1821 0.0229 0.1455 -0.1165 -0.0014 0.3148 -0.0481 0.0468 0.3829 -0.0884 0.0422 0.0923 -0.0699 0.0162 -0.0031 -0.0012 0.0543 -0.0075 -0.0509 0.0225 0.1333 -0.0208 0.1517 -0.0042 0.0226 0.0231 0.0003 0.0292 -0.0118 0.0037 -0.0116 0.0269 0.0196 0.0432 0.0155 0.0189 -0.0044 943. (0.00078) RY ( 5) C 15 s( 5.63%)p 6.41( 36.13%)d 9.87( 55.63%) f 0.44( 2.51%)g 0.02( 0.10%) 0.0000 -0.0019 0.2310 -0.0542 0.0045 0.0012 0.0000 0.0013 -0.0488 -0.5601 -0.0661 -0.0020 -0.0892 -0.1086 0.0077 0.0018 0.0653 0.1168 0.0559 -0.0325 0.5090 0.0057 -0.0868 0.0039 -0.0105 0.0000 -0.4093 -0.0378 -0.1681 0.2730 -0.0251 0.1126 -0.0460 0.0350 0.0122 -0.0128 -0.0341 0.0035 -0.0823 -0.0543 0.0240 -0.0079 0.0206 -0.0091 0.0434 0.0484 0.0879 0.0271 -0.0201 -0.0050 0.0005 -0.0051 -0.0147 0.0172 -0.0017 -0.0023 -0.0085 944. (0.00066) RY ( 6) C 15 s( 13.84%)p 1.60( 22.17%)d 4.10( 56.70%) f 0.49( 6.78%)g 0.04( 0.51%) 0.0000 0.0019 0.3311 -0.1689 -0.0020 0.0153 0.0000 0.0051 0.0426 -0.3662 -0.0345 -0.0131 -0.1331 -0.1050 0.0547 0.0035 0.0519 -0.2232 -0.0101 -0.0038 -0.0893 -0.0491 -0.2636 0.3762 -0.0170 0.0909 0.5291 -0.0215 -0.0559 -0.2228 -0.0024 -0.0263 0.0566 0.0026 -0.0910 0.0202 -0.1376 0.0666 0.0918 0.0481 0.1306 0.0043 0.0658 0.0031 0.0033 -0.0117 0.0541 -0.0237 -0.0321 -0.0186 0.0056 0.0461 -0.0035 0.0215 -0.0222 0.0030 0.0241 945. (0.00049) RY ( 7) C 15 s( 1.23%)p 8.77( 10.81%)d20.91( 25.78%) f48.88( 60.25%)g 1.56( 1.93%) 0.0000 -0.0016 0.1072 -0.0267 0.0092 -0.0066 0.0008 -0.0073 -0.1146 -0.1071 0.1696 0.0019 -0.0419 -0.0007 -0.0208 0.0074 0.1394 0.0068 -0.1815 -0.0009 -0.1384 -0.0065 0.0142 0.0317 -0.0323 -0.0396 0.1735 -0.0297 -0.1358 0.1255 0.0544 0.2001 -0.3478 -0.0748 0.2443 -0.0728 0.5942 -0.1761 0.0381 0.0255 -0.3027 0.1110 0.1803 -0.0519 -0.0958 0.0120 -0.0533 0.0102 -0.0020 0.1254 -0.0055 0.0317 -0.0165 -0.0241 0.0273 -0.0256 0.0155 946. (0.00032) RY ( 8) C 15 s( 15.63%)p 0.50( 7.78%)d 4.22( 65.93%) f 0.63( 9.78%)g 0.06( 0.88%) 0.0000 -0.0073 0.3843 -0.0574 0.0632 0.0354 0.0019 -0.0055 -0.1530 -0.0719 0.0141 0.0082 -0.1430 -0.0493 -0.0710 -0.0074 -0.1354 0.0289 0.0420 -0.2867 -0.1838 0.0156 0.5371 -0.2160 -0.0567 -0.3785 0.1092 0.0369 -0.1460 0.0596 -0.0188 -0.0764 0.1308 0.0008 -0.1802 0.0437 0.0877 -0.0324 -0.0355 0.0080 0.1876 -0.0660 -0.1101 0.0176 0.0041 -0.0299 -0.0031 -0.0210 0.0423 0.0130 -0.0262 -0.0417 0.0190 0.0328 -0.0470 -0.0099 -0.0265 947. (0.00020) RY ( 9) C 15 s( 2.18%)p20.95( 45.66%)d18.82( 41.01%) f 4.75( 10.36%)g 0.37( 0.80%) 0.0000 -0.0065 0.1368 0.0285 0.0467 -0.0066 0.0003 -0.0055 -0.0318 0.3185 -0.0845 0.0195 -0.1045 -0.0415 0.0703 0.0034 0.1328 -0.5508 0.0891 0.0365 0.1970 0.0327 -0.2401 -0.0198 -0.0506 -0.4824 -0.0871 -0.0725 0.0340 0.1372 -0.0074 -0.1313 -0.1446 0.0676 -0.1662 0.0502 0.0207 -0.0060 0.1638 -0.0700 -0.1535 0.0276 0.0803 0.0038 0.0967 0.0104 0.0057 0.0317 -0.0103 -0.0400 0.0558 -0.0068 -0.0302 0.0369 -0.0119 0.0262 0.0011 948. (0.00014) RY (10) C 15 s( 2.86%)p 6.95( 19.90%)d12.77( 36.55%) f13.75( 39.35%)g 0.46( 1.33%) 0.0000 -0.0027 -0.0903 0.1361 -0.0128 -0.0422 0.0007 0.0051 0.0398 -0.0860 -0.0826 0.0029 -0.0946 0.0411 0.0624 -0.0100 -0.0348 0.3806 0.1499 0.2495 0.0606 0.0833 0.0710 0.0169 0.0233 -0.2411 0.1976 -0.0664 0.0260 -0.0627 -0.0175 0.3433 -0.2417 0.0632 -0.3659 0.0861 -0.1490 0.0349 0.2102 -0.0348 -0.0971 0.0240 0.0531 -0.0321 -0.0162 0.0074 -0.3881 0.1366 0.0385 -0.0657 0.0458 0.0108 0.0209 0.0418 0.0206 -0.0486 0.0168 949. (0.00012) RY (11) C 15 s( 14.09%)p 2.84( 40.05%)d 1.45( 20.42%) f 1.74( 24.57%)g 0.06( 0.87%) 0.0000 0.0090 0.0641 0.3573 0.0800 -0.0514 0.0033 0.0187 -0.0014 -0.1364 -0.0198 0.0202 0.0466 0.6107 0.0417 0.0077 -0.0550 -0.0163 -0.0237 -0.0287 -0.1665 0.0525 -0.0566 -0.0202 0.0051 -0.0345 -0.0885 0.0680 -0.3722 -0.0473 0.0041 -0.1135 0.0321 -0.0301 -0.0842 0.0440 -0.1881 -0.0209 0.0741 0.0250 -0.1809 -0.0173 0.2618 -0.0221 -0.1771 0.0247 0.2459 -0.0167 -0.0246 0.0078 -0.0057 0.0770 -0.0078 0.0380 -0.0168 0.0045 -0.0159 950. (0.00006) RY (12) C 15 s( 18.69%)p 0.78( 14.53%)d 2.56( 47.93%) f 0.69( 12.86%)g 0.32( 5.99%) 951. (0.00006) RY (13) C 15 s( 2.94%)p 4.98( 14.62%)d13.52( 39.70%) f13.64( 40.04%)g 0.92( 2.70%) 952. (0.00004) RY (14) C 15 s( 2.81%)p 4.35( 12.22%)d19.90( 55.91%) f10.06( 28.26%)g 0.29( 0.80%) 953. (0.00003) RY (15) C 15 s( 4.65%)p 6.88( 31.97%)d 2.85( 13.26%) f 9.11( 42.35%)g 1.67( 7.76%) 954. (0.00003) RY (16) C 15 s( 6.33%)p 4.49( 28.47%)d 7.84( 49.63%) f 2.26( 14.33%)g 0.20( 1.25%) 955. (0.00002) RY (17) C 15 s( 3.62%)p 3.80( 13.77%)d10.63( 38.50%) f10.93( 39.61%)g 1.24( 4.50%) 956. (0.00001) RY (18) C 15 s( 29.86%)p 0.09( 2.61%)d 0.76( 22.71%) f 1.33( 39.79%)g 0.17( 5.03%) 957. (0.00001) RY (19) C 15 s( 0.19%)p88.35( 16.66%)d99.99( 61.63%) f99.99( 19.78%)g 9.25( 1.74%) 958. (0.00001) RY (20) C 15 s( 1.97%)p 7.96( 15.67%)d15.85( 31.17%) f17.73( 34.87%)g 8.30( 16.32%) 959. (0.00001) RY (21) C 15 s( 1.42%)p11.96( 16.98%)d14.06( 19.95%) f40.85( 57.99%)g 2.58( 3.66%) 960. (0.00001) RY (22) C 15 s( 20.62%)p 1.25( 25.81%)d 1.58( 32.63%) f 0.77( 15.97%)g 0.24( 4.97%) 961. (0.00000) RY (23) C 15 s( 12.05%)p 0.76( 9.12%)d 1.11( 13.33%) f 1.60( 19.34%)g 3.83( 46.16%) 962. (0.00000) RY (24) C 15 s( 2.14%)p 3.10( 6.62%)d12.87( 27.51%) f21.01( 44.93%)g 8.80( 18.81%) 963. (0.00000) RY (25) C 15 s( 14.73%)p 1.11( 16.33%)d 1.30( 19.08%) f 2.15( 31.67%)g 1.24( 18.19%) 964. (0.00000) RY (26) C 15 s( 24.17%)p 0.22( 5.42%)d 1.96( 47.40%) f 0.57( 13.75%)g 0.38( 9.26%) 965. (0.00000) RY (27) C 15 s( 2.53%)p 4.73( 11.98%)d17.74( 44.92%) f 7.55( 19.12%)g 8.47( 21.45%) 966. (0.00000) RY (28) C 15 s( 17.51%)p 2.81( 49.21%)d 0.55( 9.66%) f 0.70( 12.29%)g 0.65( 11.33%) 967. (0.00000) RY (29) C 15 s( 6.08%)p 5.99( 36.42%)d 4.62( 28.09%) f 3.30( 20.07%)g 1.53( 9.33%) 968. (0.00000) RY (30) C 15 s( 6.38%)p 4.58( 29.24%)d 6.11( 38.98%) f 1.90( 12.14%)g 2.08( 13.27%) 969. (0.00000) RY (31) C 15 s( 3.86%)p 0.95( 3.67%)d 9.74( 37.56%) f13.52( 52.12%)g 0.73( 2.80%) 970. (0.00000) RY (32) C 15 s( 6.12%)p 4.51( 27.63%)d 7.17( 43.93%) f 2.95( 18.04%)g 0.70( 4.28%) 971. (0.00000) RY (33) C 15 s( 10.19%)p 1.76( 17.92%)d 3.36( 34.26%) f 2.87( 29.26%)g 0.82( 8.37%) 972. (0.00000) RY (34) C 15 s( 89.32%)p 0.00( 0.05%)d 0.03( 2.77%) f 0.05( 4.38%)g 0.04( 3.48%) 973. (0.00000) RY (35) C 15 s( 19.07%)p 0.02( 0.36%)d 0.29( 5.60%) f 2.56( 48.78%)g 1.37( 26.18%) 974. (0.00000) RY (36) C 15 s( 2.09%)p 0.18( 0.38%)d 4.33( 9.08%) f17.53( 36.71%)g24.69( 51.73%) 975. (0.00000) RY (37) C 15 s( 0.82%)p 0.60( 0.49%)d13.40( 10.93%) f58.89( 48.04%)g48.68( 39.72%) 976. (0.00000) RY (38) C 15 s( 4.75%)p 0.07( 0.31%)d 0.67( 3.17%) f10.15( 48.20%)g 9.18( 43.57%) 977. (0.00000) RY (39) C 15 s( 1.62%)p 0.19( 0.31%)d10.84( 17.62%) f24.13( 39.20%)g25.39( 41.25%) 978. (0.00000) RY (40) C 15 s( 4.20%)p 0.08( 0.34%)d 6.42( 26.98%) f 8.45( 35.53%)g 7.84( 32.94%) 979. (0.00000) RY (41) C 15 s( 1.93%)p 2.44( 4.70%)d 5.09( 9.82%) f16.08( 31.03%)g27.23( 52.52%) 980. (0.00000) RY (42) C 15 s( 4.99%)p 0.43( 2.16%)d 3.12( 15.56%) f 8.50( 42.37%)g 7.00( 34.92%) 981. (0.00000) RY (43) C 15 s( 1.34%)p 0.18( 0.24%)d11.18( 14.95%) f32.08( 42.87%)g30.38( 40.60%) 982. (0.00000) RY (44) C 15 s( 1.57%)p 0.22( 0.34%)d 5.36( 8.42%) f28.23( 44.31%)g28.89( 45.36%) 983. (0.00000) RY (45) C 15 s( 25.73%)p 0.05( 1.32%)d 0.47( 12.19%) f 1.31( 33.79%)g 1.05( 26.97%) 984. (0.00000) RY (46) C 15 s( 7.40%)p 0.26( 1.92%)d 2.51( 18.56%) f 4.42( 32.72%)g 5.32( 39.40%) 985. (0.00000) RY (47) C 15 s( 9.61%)p 0.39( 3.74%)d 4.79( 45.99%) f 1.50( 14.36%)g 2.74( 26.29%) 986. (0.00000) RY (48) C 15 s( 14.19%)p 0.35( 4.96%)d 1.45( 20.64%) f 1.02( 14.49%)g 3.22( 45.73%) 987. (0.00000) RY (49) C 15 s( 11.42%)p 0.06( 0.66%)d 4.84( 55.31%) f 0.84( 9.65%)g 2.01( 22.95%) 988. (0.00000) RY (50) C 15 s( 3.94%)p 0.43( 1.69%)d10.54( 41.49%) f 5.31( 20.89%)g 8.12( 31.99%) 989. (0.00000) RY (51) C 15 s( 0.45%)p11.69( 5.22%)d57.80( 25.80%) f72.27( 32.26%)g81.27( 36.28%) 990. (0.00000) RY (52) C 15 s( 1.14%)p 7.86( 8.93%)d17.05( 19.35%) f33.06( 37.52%)g29.13( 33.06%) 991. (0.00118) RY ( 1) H 16 s( 84.48%)p 0.16( 13.90%)d 0.02( 1.56%) f 0.00( 0.06%) -0.0058 0.9191 -0.0053 0.0032 0.0626 0.0285 0.0319 -0.1648 0.0058 -0.0295 -0.3212 0.0353 0.0282 -0.0072 -0.0119 0.0711 -0.0135 -0.0918 0.0156 0.0180 -0.0063 -0.0331 -0.0061 0.0106 0.0006 -0.0073 0.0068 0.0175 -0.0068 0.0039 992. (0.00072) RY ( 2) H 16 s( 0.10%)p99.99( 75.84%)d99.99( 22.78%) f12.46( 1.27%) 0.0002 0.0285 0.0117 0.0085 -0.5916 -0.0723 0.0611 -0.5781 -0.0694 0.0528 0.2371 0.0292 -0.0238 -0.0152 0.0054 -0.0846 0.0092 0.1018 -0.0021 0.4572 -0.0277 -0.0138 -0.0025 -0.0225 0.0213 0.0218 0.0010 -0.0167 -0.0713 0.0769 993. (0.00040) RY ( 3) H 16 s( 10.01%)p 6.10( 61.10%)d 2.62( 26.23%) f 0.27( 2.66%) 0.0016 0.3128 -0.0388 -0.0270 0.2728 -0.0219 -0.0165 0.0258 0.0410 -0.0185 0.7209 0.0098 -0.1159 -0.0065 -0.0277 -0.2785 0.0272 0.3899 -0.0280 -0.1385 0.0074 0.1044 -0.0156 -0.0909 -0.0116 0.0124 -0.0183 -0.1227 0.0369 -0.0358 994. (0.00021) RY ( 4) H 16 s( 84.06%)p 0.07( 6.12%)d 0.11( 9.42%) f 0.00( 0.40%) 0.0042 0.0588 0.9149 -0.0015 -0.0949 -0.0567 0.0449 0.1580 0.0778 -0.0272 0.0998 0.0360 0.0629 -0.2443 0.0160 -0.0008 -0.0113 -0.0349 0.0025 -0.0056 -0.0022 -0.1814 0.0014 -0.0066 0.0143 -0.0325 -0.0041 -0.0006 0.0403 0.0328 995. (0.00005) RY ( 5) H 16 s( 3.52%)p18.30( 64.39%)d 8.45( 29.72%) f 0.67( 2.37%) 996. (0.00001) RY ( 6) H 16 s( 0.37%)p75.52( 27.96%)d99.99( 69.38%) f 6.20( 2.30%) 997. (0.00001) RY ( 7) H 16 s( 6.99%)p10.04( 70.20%)d 2.79( 19.49%) f 0.47( 3.31%) 998. (0.00001) RY ( 8) H 16 s( 0.77%)p64.42( 49.64%)d62.33( 48.03%) f 2.02( 1.56%) 999. (0.00000) RY ( 9) H 16 s( 15.52%)p 1.79( 27.76%)d 2.81( 43.61%) f 0.85( 13.11%) 1000. (0.00000) RY (10) H 16 s( 6.90%)p 5.18( 35.75%)d 8.18( 56.42%) f 0.14( 0.94%) 1001. (0.00000) RY (11) H 16 s( 0.04%)p99.99( 8.48%)d99.99( 25.10%) f99.99( 66.37%) 1002. (0.00000) RY (12) H 16 s( 0.04%)p99.99( 6.77%)d99.99( 26.71%) f99.99( 66.49%) 1003. (0.00000) RY (13) H 16 s( 3.04%)p11.63( 35.33%)d 8.28( 25.15%) f12.01( 36.49%) 1004. (0.00000) RY (14) H 16 s( 0.36%)p72.82( 26.31%)d66.47( 24.02%) f99.99( 49.31%) 1005. (0.00000) RY (15) H 16 s( 2.40%)p 9.12( 21.89%)d 9.55( 22.92%) f22.00( 52.80%) 1006. (0.00000) RY (16) H 16 s( 4.96%)p11.36( 56.34%)d 3.33( 16.53%) f 4.47( 22.16%) 1007. (0.00000) RY (17) H 16 s( 2.31%)p23.36( 53.98%)d 6.98( 16.14%) f11.93( 27.57%) 1008. (0.00000) RY (18) H 16 s( 1.07%)p23.92( 25.69%)d 6.32( 6.79%) f61.86( 66.44%) 1009. (0.00000) RY (19) H 16 s( 46.16%)p 0.52( 23.97%)d 0.36( 16.45%) f 0.29( 13.42%) 1010. (0.00000) RY (20) H 16 s( 1.31%)p49.73( 65.21%)d16.23( 21.28%) f 9.30( 12.20%) 1011. (0.00000) RY (21) H 16 s( 16.39%)p 2.38( 39.03%)d 1.98( 32.48%) f 0.74( 12.09%) 1012. (0.00000) RY (22) H 16 s( 6.72%)p 2.78( 18.68%)d 9.50( 63.82%) f 1.61( 10.79%) 1013. (0.00000) RY (23) H 16 s( 1.53%)p36.45( 55.95%)d26.09( 40.05%) f 1.60( 2.46%) 1014. (0.00000) RY (24) H 16 s( 0.11%)p51.40( 5.69%)d99.99( 76.60%) f99.99( 17.60%) 1015. (0.00000) RY (25) H 16 s( 0.11%)p36.06( 4.02%)d99.99( 72.23%) f99.99( 23.63%) 1016. (0.00000) RY (26) H 16 s( 0.02%)p61.67( 1.31%)d99.99( 56.88%) f99.99( 41.78%) 1017. (0.00000) RY (27) H 16 s( 0.81%)p 4.96( 4.03%)d64.21( 52.16%) f52.94( 43.00%) 1018. (0.00000) RY (28) H 16 s( 0.02%)p99.99( 7.80%)d99.99( 41.99%) f99.99( 50.19%) 1019. (0.00000) RY (29) H 16 s( 0.01%)p99.99( 6.71%)d99.99( 36.06%) f99.99( 57.22%) 1020. (0.00065) RY ( 1) H 17 s( 1.91%)p39.84( 75.97%)d11.02( 21.01%) f 0.58( 1.12%) 0.0023 0.1371 -0.0080 -0.0145 -0.7696 -0.1101 0.0807 0.3539 0.0150 -0.0238 0.1508 0.0026 -0.0053 0.2124 -0.0297 0.0565 -0.0021 -0.1087 0.0038 0.3784 -0.0204 -0.0740 0.0020 -0.0092 0.0176 0.0004 -0.0342 -0.0148 -0.0086 -0.0964 1021. (0.00052) RY ( 2) H 17 s( 19.64%)p 3.05( 59.97%)d 0.97( 19.00%) f 0.07( 1.40%) -0.0031 0.4319 -0.0970 -0.0192 -0.0110 -0.0021 0.0029 0.1902 -0.0048 0.0090 -0.7424 -0.0125 0.1093 -0.0655 -0.0037 0.1556 -0.0238 0.3735 -0.0366 0.0785 -0.0046 0.1170 -0.0131 0.0567 -0.0388 -0.0545 0.0467 -0.0511 -0.0275 -0.0280 1022. (0.00027) RY ( 3) H 17 s( 75.03%)p 0.17( 13.10%)d 0.15( 10.92%) f 0.01( 0.96%) 0.0013 0.8523 0.1525 0.0247 0.0837 -0.0741 0.0180 -0.1717 -0.0882 0.0549 0.2689 -0.0666 -0.0334 0.1125 0.0085 -0.0806 0.0089 -0.1380 0.0189 -0.2106 0.0021 -0.1616 -0.0008 -0.0271 0.0090 0.0626 -0.0108 0.0437 0.0360 0.0393 1023. (0.00012) RY ( 4) H 17 s( 66.13%)p 0.29( 19.34%)d 0.21( 13.73%) f 0.01( 0.80%) 0.0114 -0.1253 0.8033 -0.0143 -0.1745 -0.0360 0.0234 -0.3610 -0.0851 -0.0363 -0.0824 0.0793 0.0954 0.1834 -0.0330 0.1408 -0.0266 0.2840 -0.0221 0.0177 0.0203 0.0032 0.0133 0.0449 -0.0176 -0.0211 0.0262 -0.0606 0.0216 -0.0200 1024. (0.00007) RY ( 5) H 17 s( 8.30%)p 7.68( 63.73%)d 3.07( 25.44%) f 0.30( 2.53%) 1025. (0.00003) RY ( 6) H 17 s( 1.14%)p36.55( 41.52%)d48.14( 54.69%) f 2.34( 2.66%) 1026. (0.00002) RY ( 7) H 17 s( 15.35%)p 5.10( 78.26%)d 0.35( 5.43%) f 0.06( 0.95%) 1027. (0.00001) RY ( 8) H 17 s( 39.28%)p 0.65( 25.48%)d 0.70( 27.49%) f 0.20( 7.75%) 1028. (0.00001) RY ( 9) H 17 s( 13.40%)p 3.82( 51.17%)d 2.54( 34.02%) f 0.11( 1.42%) 1029. (0.00000) RY (10) H 17 s( 1.03%)p40.53( 41.77%)d51.62( 53.19%) f 3.89( 4.01%) 1030. (0.00000) RY (11) H 17 s( 0.20%)p99.99( 27.09%)d99.99( 26.01%) f99.99( 46.71%) 1031. (0.00000) RY (12) H 17 s( 0.43%)p60.19( 26.11%)d44.45( 19.28%) f99.99( 54.17%) 1032. (0.00000) RY (13) H 17 s( 1.83%)p21.79( 39.87%)d19.22( 35.17%) f12.65( 23.14%) 1033. (0.00000) RY (14) H 17 s( 2.21%)p14.11( 31.12%)d10.00( 22.05%) f20.23( 44.62%) 1034. (0.00000) RY (15) H 17 s( 0.61%)p24.69( 14.94%)d39.30( 23.78%) f99.99( 60.68%) 1035. (0.00000) RY (16) H 17 s( 0.28%)p99.99( 66.93%)d42.50( 11.97%) f73.87( 20.81%) 1036. (0.00000) RY (17) H 17 s( 24.21%)p 1.12( 27.01%)d 0.55( 13.25%) f 1.47( 35.53%) 1037. (0.00000) RY (18) H 17 s( 3.38%)p 7.47( 25.25%)d15.54( 52.50%) f 5.58( 18.87%) 1038. (0.00000) RY (19) H 17 s( 0.44%)p99.99( 60.65%)d73.13( 32.53%) f14.32( 6.37%) 1039. (0.00000) RY (20) H 17 s( 8.08%)p 4.10( 33.07%)d 2.10( 16.98%) f 5.19( 41.88%) 1040. (0.00000) RY (21) H 17 s( 1.95%)p12.51( 24.36%)d36.79( 71.65%) f 1.05( 2.05%) 1041. (0.00000) RY (22) H 17 s( 14.59%)p 2.08( 30.38%)d 3.57( 52.08%) f 0.20( 2.96%) 1042. (0.00000) RY (23) H 17 s( 0.02%)p99.99( 3.70%)d99.99( 90.78%) f99.99( 5.50%) 1043. (0.00000) RY (24) H 17 s( 0.00%)p 1.00( 0.58%)d99.99( 76.95%) f39.01( 22.47%) 1044. (0.00000) RY (25) H 17 s( 0.37%)p23.52( 8.60%)d99.99( 75.47%) f42.53( 15.56%) 1045. (0.00000) RY (26) H 17 s( 0.12%)p26.11( 3.02%)d99.99( 57.98%) f99.99( 38.88%) 1046. (0.00000) RY (27) H 17 s( 0.19%)p 9.35( 1.81%)d94.15( 18.19%) f99.99( 79.81%) 1047. (0.00000) RY (28) H 17 s( 0.01%)p99.99( 1.37%)d99.99( 14.76%) f99.99( 83.86%) 1048. (0.00000) RY (29) H 17 s( 0.04%)p99.99( 3.71%)d99.99( 23.69%) f99.99( 72.56%) 1049. (0.00071) RY ( 1) H 18 s( 6.98%)p10.65( 74.28%)d 2.55( 17.79%) f 0.14( 0.95%) 0.0005 0.2628 0.0190 -0.0193 -0.3327 -0.0211 0.0220 0.7837 0.1097 -0.0524 -0.0352 -0.0090 0.0291 0.1689 -0.0200 0.0819 -0.0020 -0.3264 0.0190 -0.1858 0.0107 0.0257 -0.0095 -0.0100 -0.0107 0.0479 0.0486 -0.0566 -0.0378 0.0063 1050. (0.00062) RY ( 2) H 18 s( 45.89%)p 0.94( 43.02%)d 0.23( 10.39%) f 0.02( 0.70%) -0.0034 0.6767 -0.0267 -0.0135 -0.3920 -0.0025 0.0123 -0.3489 -0.0393 0.0282 -0.3828 -0.0328 0.0686 -0.1589 0.0127 -0.0566 -0.0005 0.1010 -0.0030 -0.0797 0.0067 0.2406 -0.0286 -0.0511 0.0414 -0.0013 0.0025 0.0409 -0.0229 -0.0220 1051. (0.00037) RY ( 3) H 18 s( 44.47%)p 0.84( 37.29%)d 0.37( 16.65%) f 0.04( 1.59%) -0.0003 0.6649 0.0325 0.0396 0.4129 0.0270 -0.0771 0.0333 0.0093 -0.0197 0.4362 -0.0545 -0.0301 0.1013 -0.0034 -0.1363 -0.0136 -0.0082 -0.0046 0.2378 -0.0101 -0.2825 0.0314 0.0875 -0.0403 -0.0184 -0.0560 -0.0211 0.0392 0.0341 1052. (0.00012) RY ( 4) H 18 s( 61.21%)p 0.47( 28.68%)d 0.16( 9.80%) f 0.01( 0.31%) 0.0136 0.0033 0.7822 -0.0042 0.3635 0.0835 0.0607 0.0449 0.0530 -0.0248 -0.3420 -0.1414 0.0409 0.0776 -0.0077 -0.1987 0.0306 -0.1077 0.0138 -0.0497 -0.0129 0.1909 -0.0255 -0.0294 0.0318 0.0253 -0.0098 -0.0194 -0.0107 -0.0002 1053. (0.00006) RY ( 5) H 18 s( 5.40%)p11.71( 63.26%)d 5.19( 28.06%) f 0.61( 3.28%) 1054. (0.00003) RY ( 6) H 18 s( 5.07%)p 9.14( 46.39%)d 8.96( 45.44%) f 0.61( 3.10%) 1055. (0.00001) RY ( 7) H 18 s( 33.11%)p 1.32( 43.68%)d 0.58( 19.35%) f 0.12( 3.86%) 1056. (0.00001) RY ( 8) H 18 s( 18.23%)p 2.55( 46.54%)d 1.66( 30.28%) f 0.27( 4.95%) 1057. (0.00001) RY ( 9) H 18 s( 39.40%)p 0.82( 32.28%)d 0.59( 23.31%) f 0.13( 5.00%) 1058. (0.00000) RY (10) H 18 s( 10.50%)p 3.65( 38.33%)d 3.83( 40.24%) f 1.04( 10.94%) 1059. (0.00000) RY (11) H 18 s( 3.66%)p 3.98( 14.59%)d 3.11( 11.39%) f19.22( 70.36%) 1060. (0.00000) RY (12) H 18 s( 3.51%)p 5.56( 19.52%)d 8.74( 30.72%) f13.16( 46.25%) 1061. (0.00000) RY (13) H 18 s( 0.82%)p35.14( 28.85%)d31.79( 26.10%) f53.86( 44.23%) 1062. (0.00000) RY (14) H 18 s( 0.80%)p44.64( 35.58%)d31.76( 25.31%) f48.08( 38.32%) 1063. (0.00000) RY (15) H 18 s( 8.54%)p 3.78( 32.28%)d 2.58( 22.00%) f 4.35( 37.18%) 1064. (0.00000) RY (16) H 18 s( 4.05%)p12.69( 51.36%)d 4.61( 18.67%) f 6.41( 25.93%) 1065. (0.00000) RY (17) H 18 s( 0.74%)p79.60( 58.87%)d13.01( 9.62%) f41.60( 30.77%) 1066. (0.00000) RY (18) H 18 s( 1.51%)p19.81( 29.95%)d44.41( 67.16%) f 0.91( 1.37%) 1067. (0.00000) RY (19) H 18 s( 0.12%)p99.99( 53.68%)d99.99( 38.42%) f62.70( 7.77%) 1068. (0.00000) RY (20) H 18 s( 0.11%)p99.99( 29.31%)d99.99( 66.77%) f34.54( 3.82%) 1069. (0.00000) RY (21) H 18 s( 3.29%)p 8.04( 26.47%)d19.33( 63.69%) f 1.99( 6.55%) 1070. (0.00000) RY (22) H 18 s( 0.03%)p99.99( 4.33%)d99.99( 86.23%) f99.99( 9.42%) 1071. (0.00000) RY (23) H 18 s( 0.04%)p33.04( 1.28%)d99.99( 90.30%) f99.99( 8.38%) 1072. (0.00000) RY (24) H 18 s( 0.14%)p94.64( 13.01%)d99.99( 73.73%) f95.45( 13.12%) 1073. (0.00000) RY (25) H 18 s( 0.03%)p99.99( 6.13%)d99.99( 51.15%) f99.99( 42.69%) 1074. (0.00000) RY (26) H 18 s( 0.02%)p99.99( 2.27%)d99.99( 13.41%) f99.99( 84.30%) 1075. (0.00000) RY (27) H 18 s( 0.14%)p27.62( 3.92%)d99.99( 21.27%) f99.99( 74.67%) 1076. (0.00000) RY (28) H 18 s( 0.44%)p48.35( 21.51%)d48.86( 21.74%) f99.99( 56.31%) 1077. (0.00000) RY (29) H 18 s( 1.88%)p 7.03( 13.22%)d11.17( 21.01%) f33.98( 63.89%) 1078. (0.00110) RY ( 1) H 19 s( 85.55%)p 0.15( 12.89%)d 0.02( 1.50%) f 0.00( 0.05%) -0.0070 0.9249 -0.0064 0.0044 0.3258 -0.0120 0.0113 0.0754 -0.0718 -0.0416 0.0992 0.0086 -0.0057 -0.0275 -0.0123 -0.0370 0.0102 0.0067 -0.0036 -0.1099 0.0190 -0.0058 -0.0078 -0.0044 -0.0085 -0.0041 0.0090 0.0023 0.0167 -0.0078 1079. (0.00068) RY ( 2) H 19 s( 0.02%)p99.99( 74.74%)d99.99( 23.91%) f75.15( 1.34%) 0.0007 -0.0085 0.0101 0.0014 -0.2296 -0.0325 0.0292 -0.0501 0.0064 0.0060 0.8178 0.1039 -0.1031 -0.0781 0.0032 -0.2998 0.0216 0.3376 -0.0177 0.1071 -0.0091 -0.1291 0.0092 -0.0567 0.0344 -0.0315 -0.0028 -0.0834 -0.0132 0.0289 1080. (0.00034) RY ( 3) H 19 s( 8.28%)p 6.82( 56.45%)d 3.87( 32.05%) f 0.39( 3.21%) 0.0020 0.2653 -0.1029 -0.0432 -0.3301 0.0025 0.0955 -0.6430 0.0285 0.1223 -0.1275 0.0127 0.0270 0.1740 -0.0229 0.1653 -0.0078 0.0031 -0.0034 0.5088 -0.0434 -0.0361 -0.0141 0.0339 0.0171 0.0423 -0.0551 0.0144 -0.1402 0.0772 1081. (0.00021) RY ( 4) H 19 s( 83.51%)p 0.08( 6.54%)d 0.11( 9.35%) f 0.01( 0.59%) 0.0041 0.0875 0.9096 -0.0062 -0.2234 -0.0829 -0.0053 -0.0134 0.0015 -0.0692 -0.0566 0.0042 0.0194 -0.2639 0.0037 0.0698 -0.0080 -0.0865 0.0027 0.0302 0.0102 -0.1018 0.0103 0.0243 0.0253 -0.0206 -0.0114 0.0370 0.0016 0.0528 1082. (0.00006) RY ( 5) H 19 s( 3.49%)p19.79( 69.05%)d 7.37( 25.72%) f 0.50( 1.74%) 1083. (0.00002) RY ( 6) H 19 s( 5.60%)p 7.95( 44.55%)d 8.30( 46.51%) f 0.59( 3.33%) 1084. (0.00001) RY ( 7) H 19 s( 4.80%)p10.47( 50.24%)d 8.77( 42.04%) f 0.61( 2.93%) 1085. (0.00001) RY ( 8) H 19 s( 2.93%)p16.67( 48.82%)d15.58( 45.65%) f 0.89( 2.60%) 1086. (0.00000) RY ( 9) H 19 s( 7.16%)p 9.01( 64.55%)d 3.66( 26.23%) f 0.29( 2.06%) 1087. (0.00000) RY (10) H 19 s( 15.11%)p 1.31( 19.75%)d 3.96( 59.84%) f 0.35( 5.31%) 1088. (0.00000) RY (11) H 19 s( 0.21%)p35.90( 7.50%)d99.99( 29.97%) f99.99( 62.33%) 1089. (0.00000) RY (12) H 19 s( 0.22%)p87.46( 19.57%)d99.99( 24.92%) f99.99( 55.28%) 1090. (0.00000) RY (13) H 19 s( 1.48%)p 5.93( 8.78%)d18.37( 27.21%) f42.24( 62.54%) 1091. (0.00000) RY (14) H 19 s( 0.04%)p99.99( 10.92%)d99.99( 24.36%) f99.99( 64.68%) 1092. (0.00000) RY (15) H 19 s( 21.28%)p 1.94( 41.34%)d 0.93( 19.84%) f 0.82( 17.55%) 1093. (0.00000) RY (16) H 19 s( 21.10%)p 2.30( 48.61%)d 1.19( 25.03%) f 0.25( 5.25%) 1094. (0.00000) RY (17) H 19 s( 0.67%)p44.23( 29.77%)d13.31( 8.96%) f90.05( 60.60%) 1095. (0.00000) RY (18) H 19 s( 0.20%)p99.99( 29.46%)d51.66( 10.38%) f99.99( 59.96%) 1096. (0.00000) RY (19) H 19 s( 15.68%)p 1.47( 22.98%)d 2.09( 32.72%) f 1.83( 28.63%) 1097. (0.00000) RY (20) H 19 s( 5.63%)p11.27( 63.48%)d 4.53( 25.52%) f 0.95( 5.37%) 1098. (0.00000) RY (21) H 19 s( 10.44%)p 4.95( 51.69%)d 2.46( 25.66%) f 1.17( 12.21%) 1099. (0.00000) RY (22) H 19 s( 3.02%)p 9.51( 28.67%)d19.13( 57.67%) f 3.53( 10.64%) 1100. (0.00000) RY (23) H 19 s( 1.94%)p24.85( 48.23%)d22.26( 43.20%) f 3.42( 6.63%) 1101. (0.00000) RY (24) H 19 s( 0.18%)p25.28( 4.63%)d99.99( 90.79%) f24.02( 4.40%) 1102. (0.00000) RY (25) H 19 s( 0.30%)p19.55( 5.94%)d99.99( 81.31%) f40.97( 12.45%) 1103. (0.00000) RY (26) H 19 s( 0.03%)p99.99( 15.16%)d99.99( 62.23%) f99.99( 22.58%) 1104. (0.00000) RY (27) H 19 s( 1.19%)p 4.91( 5.81%)d54.13( 64.16%) f24.33( 28.84%) 1105. (0.00000) RY (28) H 19 s( 0.07%)p88.08( 5.82%)d99.99( 18.94%) f99.99( 75.17%) 1106. (0.00000) RY (29) H 19 s( 0.01%)p 1.00( 3.93%)d 3.64( 14.33%) f20.78( 81.73%) 1107. (0.00078) RY ( 1) H 20 s( 29.67%)p 1.92( 56.93%)d 0.42( 12.55%) f 0.03( 0.86%) 0.0024 0.5444 0.0137 -0.0094 -0.4390 -0.0342 -0.0135 0.5176 0.0533 -0.0432 -0.3135 -0.0598 0.0284 0.1373 -0.0207 -0.0130 0.0041 -0.2284 0.0115 -0.1703 0.0121 0.1565 -0.0112 -0.0246 0.0238 0.0348 0.0335 -0.0495 -0.0490 0.0145 1108. (0.00069) RY ( 2) H 20 s( 21.81%)p 2.88( 62.83%)d 0.66( 14.34%) f 0.05( 1.02%) -0.0031 0.4652 0.0416 0.0045 0.4027 0.0546 -0.0491 0.3121 0.0028 -0.0303 0.5996 0.0464 -0.0266 0.1345 -0.0166 0.0895 -0.0056 -0.0513 0.0085 0.1646 -0.0085 -0.2939 0.0269 0.0294 -0.0810 -0.0160 -0.0031 -0.0329 0.0210 0.0318 1109. (0.00042) RY ( 3) H 20 s( 45.69%)p 0.87( 39.78%)d 0.29( 13.40%) f 0.02( 1.13%) -0.0061 0.6623 -0.1346 0.0099 -0.1062 -0.0115 -0.0486 -0.6149 -0.0039 0.0641 -0.0159 0.0155 0.0364 -0.2161 0.0238 -0.1223 -0.0025 0.1854 -0.0166 0.1651 0.0013 0.0996 -0.0021 -0.0110 0.0280 -0.0212 -0.0346 0.0743 0.0253 -0.0506 1110. (0.00022) RY ( 4) H 20 s( 77.69%)p 0.22( 17.31%)d 0.06( 4.65%) f 0.00( 0.36%) 0.0093 0.0993 0.8757 -0.0012 0.2615 0.1172 0.0052 -0.0601 0.0973 -0.0151 -0.2574 -0.1065 0.0012 -0.0041 -0.0057 -0.2015 0.0255 0.0024 0.0000 0.0671 -0.0123 0.0233 -0.0057 0.0064 0.0291 -0.0127 -0.0437 0.0080 0.0183 -0.0141 1111. (0.00004) RY ( 5) H 20 s( 1.41%)p51.60( 72.49%)d15.48( 21.75%) f 3.09( 4.35%) 1112. (0.00003) RY ( 6) H 20 s( 13.44%)p 3.66( 49.21%)d 2.57( 34.53%) f 0.21( 2.81%) 1113. (0.00002) RY ( 7) H 20 s( 0.52%)p74.47( 38.97%)d99.99( 55.71%) f 9.16( 4.79%) 1114. (0.00002) RY ( 8) H 20 s( 23.52%)p 2.21( 52.08%)d 0.78( 18.35%) f 0.26( 6.05%) 1115. (0.00000) RY ( 9) H 20 s( 4.75%)p 7.83( 37.20%)d11.26( 53.46%) f 0.97( 4.60%) 1116. (0.00000) RY (10) H 20 s( 20.32%)p 1.38( 28.08%)d 1.99( 40.47%) f 0.55( 11.12%) 1117. (0.00000) RY (11) H 20 s( 8.29%)p 1.74( 14.44%)d 7.82( 64.80%) f 1.50( 12.47%) 1118. (0.00000) RY (12) H 20 s( 1.74%)p17.12( 29.74%)d38.84( 67.48%) f 0.60( 1.04%) 1119. (0.00000) RY (13) H 20 s( 13.80%)p 2.89( 39.95%)d 3.19( 44.02%) f 0.16( 2.22%) 1120. (0.00000) RY (14) H 20 s( 0.31%)p91.15( 27.94%)d65.67( 20.13%) f99.99( 51.63%) 1121. (0.00000) RY (15) H 20 s( 0.16%)p99.99( 44.97%)d99.99( 26.45%) f99.99( 28.42%) 1122. (0.00000) RY (16) H 20 s( 2.90%)p 8.52( 24.74%)d 6.98( 20.25%) f17.95( 52.10%) 1123. (0.00000) RY (17) H 20 s( 1.27%)p43.23( 54.75%)d11.83( 14.98%) f22.89( 29.00%) 1124. (0.00000) RY (18) H 20 s( 10.49%)p 3.80( 39.90%)d 2.78( 29.12%) f 1.95( 20.49%) 1125. (0.00000) RY (19) H 20 s( 2.15%)p21.76( 46.79%)d 2.18( 4.68%) f21.57( 46.38%) 1126. (0.00000) RY (20) H 20 s( 4.20%)p12.58( 52.87%)d 4.84( 20.34%) f 5.37( 22.58%) 1127. (0.00000) RY (21) H 20 s( 15.40%)p 2.20( 33.88%)d 1.59( 24.49%) f 1.70( 26.24%) 1128. (0.00000) RY (22) H 20 s( 0.02%)p81.33( 1.30%)d99.99( 46.42%) f99.99( 52.27%) 1129. (0.00000) RY (23) H 20 s( 0.00%)p 1.00( 6.22%)d12.07( 75.08%) f 3.00( 18.69%) 1130. (0.00000) RY (24) H 20 s( 0.03%)p99.99( 4.50%)d99.99( 51.10%) f99.99( 44.36%) 1131. (0.00000) RY (25) H 20 s( 0.33%)p 0.61( 0.20%)d99.99( 52.26%) f99.99( 47.20%) 1132. (0.00000) RY (26) H 20 s( 0.01%)p99.99( 15.69%)d99.99( 55.53%) f99.99( 28.76%) 1133. (0.00000) RY (27) H 20 s( 0.02%)p99.99( 1.95%)d99.99( 50.98%) f99.99( 47.06%) 1134. (0.00000) RY (28) H 20 s( 0.17%)p18.87( 3.30%)d99.99( 31.27%) f99.99( 65.25%) 1135. (0.00000) RY (29) H 20 s( 0.02%)p99.99( 1.85%)d99.99( 31.38%) f99.99( 66.75%) 1136. (0.00078) RY ( 1) H 21 s( 2.11%)p36.88( 77.92%)d 8.98( 18.98%) f 0.47( 0.99%) 0.0052 0.1404 0.0283 -0.0240 -0.7939 -0.1026 0.0494 0.2993 0.0328 -0.0405 0.2030 0.0415 -0.0262 -0.0395 -0.0067 -0.3114 0.0185 0.1908 -0.0118 -0.1529 0.0077 0.1750 -0.0162 0.0423 -0.0575 0.0456 -0.0499 -0.0028 -0.0146 -0.0016 1137. (0.00057) RY ( 2) H 21 s( 42.54%)p 1.02( 43.21%)d 0.31( 13.32%) f 0.02( 0.94%) -0.0035 0.6514 -0.0306 -0.0079 0.2679 0.0190 -0.0577 0.5727 -0.0162 -0.0759 -0.1498 0.0122 -0.0051 0.0445 -0.0155 0.1464 -0.0112 0.3052 -0.0289 0.0566 0.0002 -0.1096 0.0123 -0.0438 0.0170 0.0698 0.0168 0.0450 0.0007 -0.0040 1138. (0.00033) RY ( 3) H 21 s( 52.81%)p 0.57( 30.03%)d 0.30( 15.69%) f 0.03( 1.47%) -0.0004 0.7246 0.0502 0.0235 -0.1106 0.0232 0.0022 -0.5278 0.0182 0.0620 0.0310 0.0394 -0.0470 -0.0945 0.0071 0.0404 0.0094 -0.3194 0.0238 0.0115 0.0049 0.2084 -0.0007 0.0610 0.0071 -0.0906 0.0077 -0.0485 0.0038 -0.0173 1139. (0.00017) RY ( 4) H 21 s( 69.88%)p 0.32( 22.47%)d 0.10( 7.31%) f 0.00( 0.34%) 0.0129 -0.0295 0.8353 0.0050 0.1290 0.0006 -0.0437 0.0014 0.0176 -0.0642 0.4224 0.1517 0.0181 0.0391 -0.0071 0.1651 -0.0313 0.1512 -0.0121 0.0489 0.0000 0.1306 -0.0279 0.0154 0.0431 0.0216 0.0079 0.0277 -0.0022 0.0038 1140. (0.00006) RY ( 5) H 21 s( 2.99%)p20.41( 61.04%)d10.93( 32.70%) f 1.09( 3.27%) 1141. (0.00003) RY ( 6) H 21 s( 23.33%)p 2.43( 56.76%)d 0.64( 14.93%) f 0.21( 4.98%) 1142. (0.00002) RY ( 7) H 21 s( 10.19%)p 4.65( 47.38%)d 3.78( 38.46%) f 0.39( 3.97%) 1143. (0.00001) RY ( 8) H 21 s( 9.30%)p 5.45( 50.71%)d 4.02( 37.34%) f 0.28( 2.65%) 1144. (0.00000) RY ( 9) H 21 s( 3.41%)p11.67( 39.81%)d14.31( 48.78%) f 2.35( 8.00%) 1145. (0.00000) RY (10) H 21 s( 18.94%)p 1.69( 31.97%)d 2.39( 45.30%) f 0.20( 3.78%) 1146. (0.00000) RY (11) H 21 s( 38.28%)p 0.38( 14.38%)d 1.02( 39.00%) f 0.22( 8.34%) 1147. (0.00000) RY (12) H 21 s( 1.29%)p44.59( 57.48%)d27.50( 35.44%) f 4.49( 5.79%) 1148. (0.00000) RY (13) H 21 s( 0.38%)p90.69( 34.62%)d80.88( 30.88%) f89.36( 34.11%) 1149. (0.00000) RY (14) H 21 s( 1.19%)p15.55( 18.55%)d19.25( 22.95%) f48.06( 57.31%) 1150. (0.00000) RY (15) H 21 s( 0.36%)p20.83( 7.60%)d63.17( 23.04%) f99.99( 69.00%) 1151. (0.00000) RY (16) H 21 s( 3.76%)p13.17( 49.47%)d 5.46( 20.49%) f 7.00( 26.29%) 1152. (0.00000) RY (17) H 21 s( 1.38%)p46.13( 63.45%)d11.63( 15.99%) f13.95( 19.19%) 1153. (0.00000) RY (18) H 21 s( 2.50%)p20.09( 50.20%)d 7.37( 18.42%) f11.56( 28.88%) 1154. (0.00000) RY (19) H 21 s( 1.18%)p16.84( 19.91%)d60.38( 71.37%) f 6.38( 7.54%) 1155. (0.00000) RY (20) H 21 s( 11.22%)p 2.00( 22.48%)d 1.24( 13.90%) f 4.67( 52.40%) 1156. (0.00000) RY (21) H 21 s( 2.50%)p11.08( 27.75%)d24.49( 61.31%) f 3.37( 8.44%) 1157. (0.00000) RY (22) H 21 s( 0.02%)p99.99( 6.96%)d99.99( 86.91%) f99.99( 6.12%) 1158. (0.00000) RY (23) H 21 s( 0.02%)p99.99( 5.06%)d99.99( 90.65%) f99.99( 4.28%) 1159. (0.00000) RY (24) H 21 s( 0.01%)p99.99( 5.86%)d99.99( 29.50%) f99.99( 64.62%) 1160. (0.00000) RY (25) H 21 s( 0.13%)p99.99( 17.68%)d99.99( 65.37%) f99.99( 16.82%) 1161. (0.00000) RY (26) H 21 s( 0.08%)p79.67( 6.71%)d99.99( 11.93%) f99.99( 81.27%) 1162. (0.00000) RY (27) H 21 s( 0.04%)p99.99( 4.30%)d99.99( 22.69%) f99.99( 72.97%) 1163. (0.00000) RY (28) H 21 s( 0.04%)p99.99( 7.29%)d99.99( 12.63%) f99.99( 80.03%) 1164. (0.00000) RY (29) H 21 s( 0.28%)p67.17( 18.83%)d99.99( 54.71%) f93.35( 26.17%) 1165. (0.00115) RY ( 1) H 22 s( 85.50%)p 0.15( 12.90%)d 0.02( 1.54%) f 0.00( 0.06%) -0.0054 0.9246 -0.0074 0.0043 0.0097 0.0310 0.0448 -0.2210 0.0161 -0.0197 0.2737 -0.0317 -0.0243 -0.0217 -0.0116 -0.0518 0.0100 0.0938 -0.0123 0.0524 -0.0149 -0.0067 -0.0088 -0.0141 -0.0040 -0.0027 -0.0095 -0.0122 -0.0061 0.0076 1166. (0.00073) RY ( 2) H 22 s( 0.46%)p99.99( 75.71%)d48.68( 22.57%) f 2.72( 1.26%) 0.0014 0.0673 0.0104 0.0012 -0.5512 -0.0859 0.0528 -0.4194 -0.0355 0.0364 -0.5093 -0.0543 0.0471 -0.0667 0.0070 0.1632 -0.0121 -0.2268 0.0134 0.3753 -0.0213 -0.0385 -0.0027 0.0478 0.0210 0.0055 0.0144 0.0458 -0.0424 0.0758 1167. (0.00041) RY ( 3) H 22 s( 9.11%)p 6.86( 62.43%)d 2.83( 25.79%) f 0.29( 2.67%) 0.0019 0.2999 0.0008 -0.0331 0.4337 -0.0272 -0.0465 0.2085 0.0403 -0.0488 -0.6145 0.0018 0.0911 0.0305 -0.0283 0.1850 -0.0231 -0.3550 0.0275 -0.3068 0.0192 0.0055 -0.0115 0.0806 -0.0041 -0.0204 0.0269 0.0901 0.0593 -0.0861 1168. (0.00020) RY ( 4) H 22 s( 83.80%)p 0.07( 6.18%)d 0.11( 9.56%) f 0.01( 0.46%) 0.0043 0.0440 0.9143 -0.0022 -0.0920 -0.0445 0.0570 0.1819 0.0816 -0.0163 -0.0472 -0.0320 -0.0694 -0.2442 0.0161 -0.0117 0.0157 0.0943 -0.0037 -0.0292 -0.0037 -0.1598 0.0043 -0.0139 0.0160 -0.0357 0.0020 -0.0124 0.0447 0.0276 1169. (0.00005) RY ( 5) H 22 s( 3.01%)p22.39( 67.38%)d 9.07( 27.30%) f 0.77( 2.31%) 1170. (0.00002) RY ( 6) H 22 s( 11.27%)p 4.48( 50.46%)d 3.07( 34.61%) f 0.33( 3.67%) 1171. (0.00001) RY ( 7) H 22 s( 3.05%)p14.62( 44.65%)d16.27( 49.67%) f 0.86( 2.63%) 1172. (0.00001) RY ( 8) H 22 s( 0.56%)p93.73( 52.71%)d80.19( 45.09%) f 2.91( 1.64%) 1173. (0.00000) RY ( 9) H 22 s( 13.67%)p 3.08( 42.11%)d 2.45( 33.52%) f 0.78( 10.70%) 1174. (0.00000) RY (10) H 22 s( 14.68%)p 1.70( 24.97%)d 4.06( 59.58%) f 0.05( 0.76%) 1175. (0.00000) RY (11) H 22 s( 0.06%)p33.79( 2.09%)d99.99( 47.40%) f99.99( 50.45%) 1176. (0.00000) RY (12) H 22 s( 0.16%)p 6.55( 1.03%)d99.99( 19.13%) f99.99( 79.68%) 1177. (0.00000) RY (13) H 22 s( 0.12%)p99.99( 36.73%)d99.99( 40.48%) f99.99( 22.66%) 1178. (0.00000) RY (14) H 22 s( 2.71%)p 4.27( 11.58%)d 5.89( 15.97%) f25.70( 69.73%) 1179. (0.00000) RY (15) H 22 s( 1.51%)p33.98( 51.36%)d12.85( 19.42%) f18.33( 27.70%) 1180. (0.00000) RY (16) H 22 s( 16.67%)p 2.73( 45.53%)d 0.57( 9.54%) f 1.70( 28.26%) 1181. (0.00000) RY (17) H 22 s( 4.91%)p 5.51( 27.05%)d 1.42( 6.98%) f12.44( 61.06%) 1182. (0.00000) RY (18) H 22 s( 0.02%)p99.99( 46.97%)d99.99( 16.33%) f99.99( 36.67%) 1183. (0.00000) RY (19) H 22 s( 21.19%)p 1.14( 24.08%)d 1.86( 39.43%) f 0.72( 15.30%) 1184. (0.00000) RY (20) H 22 s( 3.08%)p19.60( 60.38%)d 9.83( 30.30%) f 2.02( 6.24%) 1185. (0.00000) RY (21) H 22 s( 2.70%)p13.83( 37.33%)d17.29( 46.67%) f 4.93( 13.30%) 1186. (0.00000) RY (22) H 22 s( 20.94%)p 1.36( 28.58%)d 2.10( 44.02%) f 0.31( 6.47%) 1187. (0.00000) RY (23) H 22 s( 0.48%)p99.99( 52.42%)d92.88( 44.55%) f 5.33( 2.56%) 1188. (0.00000) RY (24) H 22 s( 0.09%)p99.99( 9.72%)d99.99( 55.99%) f99.99( 34.19%) 1189. (0.00000) RY (25) H 22 s( 0.08%)p54.20( 4.13%)d99.99( 65.50%) f99.99( 30.30%) 1190. (0.00000) RY (26) H 22 s( 0.14%)p36.75( 5.31%)d99.99( 66.48%) f99.99( 28.06%) 1191. (0.00000) RY (27) H 22 s( 0.05%)p19.95( 1.02%)d99.99( 42.73%) f99.99( 56.19%) 1192. (0.00000) RY (28) H 22 s( 0.02%)p99.99( 12.11%)d99.99( 43.05%) f99.99( 44.82%) 1193. (0.00000) RY (29) H 22 s( 0.09%)p32.57( 2.93%)d99.99( 36.79%) f99.99( 60.18%) 1194. (0.00072) RY ( 1) H 23 s( 15.89%)p 4.35( 69.05%)d 0.89( 14.14%) f 0.06( 0.91%) -0.0013 0.3984 -0.0125 -0.0006 -0.4092 -0.0570 0.0215 0.6686 0.0976 -0.0449 0.2363 0.0571 -0.0419 0.1056 -0.0170 -0.0907 -0.0001 0.2966 -0.0139 -0.0892 0.0051 0.1587 -0.0211 0.0457 -0.0143 0.0558 -0.0274 0.0517 -0.0157 0.0081 1195. (0.00062) RY ( 2) H 23 s( 31.61%)p 1.70( 53.76%)d 0.43( 13.68%) f 0.03( 0.95%) -0.0041 0.5604 -0.0403 -0.0180 -0.4331 -0.0237 0.0275 -0.5603 -0.0531 0.0597 0.1613 -0.0067 -0.0493 -0.1343 0.0111 -0.0660 0.0122 -0.2804 0.0174 -0.1224 0.0073 0.1405 -0.0224 0.0391 -0.0112 -0.0570 -0.0346 -0.0468 -0.0336 -0.0059 1196. (0.00031) RY ( 3) H 23 s( 49.37%)p 0.64( 31.63%)d 0.35( 17.34%) f 0.03( 1.67%) 0.0004 0.6953 0.0968 0.0295 0.4562 -0.0024 -0.0950 0.0709 0.0054 -0.0155 -0.2976 0.0713 0.0132 0.0034 -0.0026 0.2925 -0.0037 0.0442 -0.0042 0.2279 -0.0106 -0.1815 0.0289 -0.0924 0.0309 0.0145 0.0779 0.0045 0.0292 -0.0011 1197. (0.00013) RY ( 4) H 23 s( 56.82%)p 0.47( 26.90%)d 0.27( 15.49%) f 0.01( 0.78%) 0.0123 -0.0027 0.7537 -0.0048 0.2742 0.1730 0.1210 -0.0344 0.0057 -0.0028 0.3721 0.0672 -0.0712 0.0001 0.0005 0.0873 -0.0019 -0.0192 0.0021 -0.1067 -0.0078 0.3660 -0.0386 0.0793 0.0302 -0.0117 -0.0072 -0.0046 -0.0206 -0.0012 1198. (0.00008) RY ( 5) H 23 s( 16.32%)p 3.45( 56.34%)d 1.53( 24.97%) f 0.14( 2.37%) 1199. (0.00003) RY ( 6) H 23 s( 1.09%)p41.28( 44.84%)d47.36( 51.44%) f 2.42( 2.63%) 1200. (0.00002) RY ( 7) H 23 s( 16.03%)p 3.70( 59.31%)d 1.33( 21.36%) f 0.21( 3.30%) 1201. (0.00001) RY ( 8) H 23 s( 17.72%)p 2.62( 46.35%)d 1.88( 33.25%) f 0.15( 2.68%) 1202. (0.00000) RY ( 9) H 23 s( 4.37%)p 8.37( 36.57%)d12.94( 56.56%) f 0.57( 2.50%) 1203. (0.00000) RY (10) H 23 s( 31.06%)p 1.31( 40.67%)d 0.60( 18.70%) f 0.31( 9.57%) 1204. (0.00000) RY (11) H 23 s( 22.65%)p 0.70( 15.82%)d 2.39( 54.04%) f 0.33( 7.49%) 1205. (0.00000) RY (12) H 23 s( 0.06%)p99.99( 11.52%)d99.99( 21.20%) f99.99( 67.22%) 1206. (0.00000) RY (13) H 23 s( 0.57%)p50.67( 28.73%)d69.12( 39.19%) f55.57( 31.51%) 1207. (0.00000) RY (14) H 23 s( 0.72%)p29.31( 21.23%)d22.35( 16.19%) f85.40( 61.86%) 1208. (0.00000) RY (15) H 23 s( 0.88%)p34.00( 29.99%)d33.68( 29.71%) f44.68( 39.41%) 1209. (0.00000) RY (16) H 23 s( 1.38%)p46.34( 63.74%)d18.44( 25.36%) f 6.92( 9.52%) 1210. (0.00000) RY (17) H 23 s( 17.94%)p 1.54( 27.68%)d 0.80( 14.37%) f 2.23( 40.00%) 1211. (0.00000) RY (18) H 23 s( 0.57%)p69.14( 39.11%)d34.63( 19.59%) f72.01( 40.73%) 1212. (0.00000) RY (19) H 23 s( 1.19%)p52.14( 61.91%)d14.72( 17.48%) f16.35( 19.42%) 1213. (0.00000) RY (20) H 23 s( 1.46%)p16.85( 24.60%)d27.25( 39.79%) f23.38( 34.15%) 1214. (0.00000) RY (21) H 23 s( 0.39%)p99.99( 44.00%)d99.99( 46.08%) f24.27( 9.52%) 1215. (0.00000) RY (22) H 23 s( 11.77%)p 2.98( 35.06%)d 4.32( 50.82%) f 0.20( 2.34%) 1216. (0.00000) RY (23) H 23 s( 0.01%)p 1.00( 5.07%)d12.02( 61.01%) f 6.68( 33.90%) 1217. (0.00000) RY (24) H 23 s( 0.00%)p 1.00( 7.05%)d11.78( 83.11%) f 1.39( 9.83%) 1218. (0.00000) RY (25) H 23 s( 0.05%)p 8.30( 0.45%)d99.99( 81.98%) f99.99( 17.52%) 1219. (0.00000) RY (26) H 23 s( 0.09%)p10.05( 0.95%)d99.99( 58.85%) f99.99( 40.11%) 1220. (0.00000) RY (27) H 23 s( 0.02%)p99.99( 14.71%)d99.99( 47.02%) f99.99( 38.26%) 1221. (0.00000) RY (28) H 23 s( 0.02%)p33.16( 0.74%)d99.99( 11.13%) f99.99( 88.12%) 1222. (0.00000) RY (29) H 23 s( 0.08%)p26.25( 2.07%)d99.99( 16.13%) f99.99( 81.72%) 1223. (0.00065) RY ( 1) H 24 s( 0.06%)p99.99( 76.25%)d99.99( 22.52%) f20.52( 1.17%) 0.0013 0.0034 0.0213 -0.0103 -0.6700 -0.0988 0.0701 0.4508 0.0329 -0.0370 -0.3027 -0.0310 0.0259 0.1256 -0.0218 0.1155 -0.0123 0.1178 -0.0083 0.4253 -0.0236 -0.0104 -0.0010 0.0234 0.0200 -0.0177 -0.0039 -0.0184 -0.0273 -0.0968 1224. (0.00050) RY ( 2) H 24 s( 17.91%)p 3.38( 60.44%)d 1.12( 20.11%) f 0.09( 1.54%) -0.0021 0.4139 -0.0837 -0.0266 -0.2804 -0.0089 0.0461 0.0685 -0.0142 0.0205 0.7128 -0.0049 -0.1011 0.0812 -0.0207 -0.1599 0.0231 -0.3763 0.0363 0.1090 -0.0081 -0.1138 0.0118 -0.0727 0.0090 0.0276 -0.0518 0.0663 -0.0069 -0.0465 1225. (0.00028) RY ( 3) H 24 s( 78.04%)p 0.15( 11.63%)d 0.12( 9.50%) f 0.01( 0.82%) 0.0015 0.8747 0.1218 0.0225 0.0842 -0.0739 0.0278 -0.0868 -0.1096 0.0307 -0.2835 0.0164 0.0431 0.0910 0.0149 0.1165 -0.0037 0.2351 -0.0148 -0.1241 -0.0068 -0.0431 -0.0119 0.0463 -0.0147 0.0122 0.0354 -0.0594 0.0240 0.0194 1226. (0.00013) RY ( 4) H 24 s( 76.85%)p 0.19( 14.27%)d 0.11( 8.45%) f 0.01( 0.44%) 0.0100 -0.1231 0.8677 -0.0158 -0.1868 -0.0842 -0.0007 -0.3099 -0.0066 0.0061 -0.0185 -0.0258 -0.0598 0.1993 -0.0425 -0.0687 0.0073 -0.1417 -0.0049 -0.0404 0.0263 -0.1231 0.0243 -0.0340 0.0080 0.0202 -0.0094 0.0454 0.0202 -0.0137 1227. (0.00007) RY ( 5) H 24 s( 2.03%)p32.53( 65.92%)d14.63( 29.65%) f 1.19( 2.40%) 1228. (0.00002) RY ( 6) H 24 s( 0.42%)p99.99( 44.90%)d99.99( 52.48%) f 5.24( 2.20%) 1229. (0.00002) RY ( 7) H 24 s( 14.62%)p 4.99( 72.98%)d 0.70( 10.22%) f 0.15( 2.17%) 1230. (0.00001) RY ( 8) H 24 s( 30.00%)p 1.05( 31.37%)d 1.01( 30.17%) f 0.28( 8.46%) 1231. (0.00001) RY ( 9) H 24 s( 15.94%)p 2.50( 39.90%)d 2.57( 41.04%) f 0.20( 3.12%) 1232. (0.00000) RY (10) H 24 s( 4.64%)p 7.18( 33.35%)d12.03( 55.89%) f 1.32( 6.11%) 1233. (0.00000) RY (11) H 24 s( 0.40%)p18.67( 7.51%)d95.03( 38.21%) f99.99( 53.88%) 1234. (0.00000) RY (12) H 24 s( 0.60%)p19.37( 11.53%)d32.05( 19.07%) f99.99( 68.81%) 1235. (0.00000) RY (13) H 24 s( 2.38%)p15.43( 36.72%)d11.25( 26.77%) f14.34( 34.13%) 1236. (0.00000) RY (14) H 24 s( 2.67%)p18.13( 48.36%)d12.01( 32.01%) f 6.36( 16.96%) 1237. (0.00000) RY (15) H 24 s( 17.83%)p 0.91( 16.30%)d 0.98( 17.42%) f 2.72( 48.45%) 1238. (0.00000) RY (16) H 24 s( 7.33%)p 8.81( 64.56%)d 3.32( 24.31%) f 0.52( 3.80%) 1239. (0.00000) RY (17) H 24 s( 6.25%)p 4.93( 30.82%)d 2.30( 14.39%) f 7.77( 48.54%) 1240. (0.00000) RY (18) H 24 s( 0.02%)p99.99( 74.99%)d99.99( 19.46%) f99.99( 5.53%) 1241. (0.00000) RY (19) H 24 s( 3.39%)p 5.52( 18.75%)d17.61( 59.75%) f 5.34( 18.11%) 1242. (0.00000) RY (20) H 24 s( 1.21%)p34.04( 41.07%)d17.07( 20.59%) f30.78( 37.13%) 1243. (0.00000) RY (21) H 24 s( 2.21%)p11.92( 26.33%)d32.25( 71.25%) f 0.10( 0.21%) 1244. (0.00000) RY (22) H 24 s( 14.24%)p 2.62( 37.29%)d 3.04( 43.29%) f 0.36( 5.18%) 1245. (0.00000) RY (23) H 24 s( 0.03%)p97.99( 2.94%)d99.99( 61.39%) f99.99( 35.64%) 1246. (0.00000) RY (24) H 24 s( 0.00%)p 1.00( 4.79%)d14.60( 69.87%) f 5.30( 25.34%) 1247. (0.00000) RY (25) H 24 s( 0.04%)p98.38( 3.58%)d99.99( 49.52%) f99.99( 46.86%) 1248. (0.00000) RY (26) H 24 s( 0.15%)p22.32( 3.29%)d99.99( 60.70%) f99.99( 35.87%) 1249. (0.00000) RY (27) H 24 s( 0.29%)p12.47( 3.68%)d99.99( 41.95%) f99.99( 54.08%) 1250. (0.00000) RY (28) H 24 s( 0.30%)p33.53( 10.19%)d55.68( 16.91%) f99.99( 72.60%) 1251. (0.00000) RY (29) H 24 s( 0.29%)p20.97( 6.18%)d99.99( 33.10%) f99.99( 60.42%) 1252. (0.00135) RY ( 1) H 25 s( 89.03%)p 0.12( 10.76%)d 0.00( 0.20%) f 0.00( 0.01%) -0.0021 0.9435 -0.0126 0.0004 -0.2648 -0.0650 -0.0581 -0.1614 -0.0517 -0.0108 -0.0077 -0.0283 0.0146 0.0003 0.0057 -0.0252 -0.0053 0.0098 -0.0006 0.0315 0.0059 0.0139 -0.0049 0.0012 0.0050 -0.0038 -0.0037 -0.0002 -0.0016 0.0004 1253. (0.00052) RY ( 2) H 25 s( 34.89%)p 1.45( 50.59%)d 0.39( 13.47%) f 0.03( 1.05%) 0.0029 -0.0309 0.5899 0.0060 -0.1767 0.0498 -0.0065 0.1917 -0.0714 -0.0047 -0.6197 -0.2062 0.0613 0.1041 -0.0179 -0.1756 0.0285 -0.0335 0.0001 -0.0203 0.0069 0.2982 -0.0370 0.0209 0.0853 -0.0183 -0.0257 0.0068 -0.0371 0.0193 1254. (0.00049) RY ( 3) H 25 s( 45.91%)p 0.87( 40.17%)d 0.28( 12.93%) f 0.02( 0.98%) 0.0004 0.1337 0.6643 -0.0034 0.3545 0.2347 -0.0763 0.0953 -0.1069 0.0289 0.4400 0.0099 -0.0106 0.0033 0.0047 0.1517 -0.0242 -0.0802 0.0110 0.2666 -0.0219 -0.1641 0.0260 0.0358 -0.0894 0.0086 -0.0001 0.0080 0.0161 -0.0135 1255. (0.00032) RY ( 4) H 25 s( 10.87%)p 5.38( 58.52%)d 2.80( 30.41%) f 0.02( 0.20%) 0.0004 -0.1521 0.2902 -0.0369 -0.1186 0.0123 0.0309 -0.7518 0.0382 0.0545 -0.0092 0.0135 -0.0086 -0.4659 0.0615 -0.0137 0.0127 0.2662 -0.0401 -0.0998 0.0153 0.0097 0.0086 -0.0079 -0.0012 0.0105 0.0117 0.0292 0.0035 -0.0293 1256. (0.00014) RY ( 5) H 25 s( 3.88%)p20.08( 77.88%)d 4.29( 16.65%) f 0.41( 1.59%) 0.0069 -0.1194 0.0970 0.1228 -0.0913 -0.4965 -0.0039 -0.2262 -0.6431 -0.1641 0.0093 0.1661 -0.0681 0.2893 -0.0638 0.2073 0.0398 -0.1608 0.0455 0.0021 -0.0716 -0.0292 0.0147 -0.0554 -0.0302 -0.0067 0.0890 -0.0034 -0.0621 -0.0117 1257. (0.00004) RY ( 6) H 25 s( 0.09%)p99.99( 40.25%)d99.99( 53.83%) f68.36( 5.84%) 1258. (0.00003) RY ( 7) H 25 s( 3.64%)p15.11( 54.97%)d 9.19( 33.42%) f 2.19( 7.97%) 1259. (0.00002) RY ( 8) H 25 s( 4.80%)p14.19( 68.13%)d 5.44( 26.09%) f 0.20( 0.98%) 1260. (0.00002) RY ( 9) H 25 s( 11.51%)p 4.37( 50.26%)d 3.09( 35.56%) f 0.23( 2.67%) 1261. (0.00001) RY (10) H 25 s( 0.69%)p67.34( 46.58%)d13.77( 9.53%) f62.46( 43.20%) 1262. (0.00001) RY (11) H 25 s( 24.18%)p 0.68( 16.43%)d 2.40( 57.96%) f 0.06( 1.44%) 1263. (0.00000) RY (12) H 25 s( 31.28%)p 0.80( 24.99%)d 1.23( 38.58%) f 0.16( 5.15%) 1264. (0.00000) RY (13) H 25 s( 2.99%)p 7.48( 22.39%)d21.95( 65.73%) f 2.97( 8.88%) 1265. (0.00000) RY (14) H 25 s( 2.14%)p11.08( 23.68%)d31.18( 66.62%) f 3.54( 7.57%) 1266. (0.00000) RY (15) H 25 s( 1.21%)p14.35( 17.35%)d46.02( 55.66%) f21.31( 25.78%) 1267. (0.00000) RY (16) H 25 s( 0.83%)p34.56( 28.68%)d42.47( 35.25%) f42.47( 35.24%) 1268. (0.00000) RY (17) H 25 s( 0.71%)p14.24( 10.09%)d55.61( 39.40%) f70.29( 49.80%) 1269. (0.00000) RY (18) H 25 s( 2.89%)p16.77( 48.46%)d 4.03( 11.63%) f12.81( 37.02%) 1270. (0.00000) RY (19) H 25 s( 26.23%)p 1.35( 35.30%)d 0.90( 23.71%) f 0.56( 14.76%) 1271. (0.00000) RY (20) H 25 s( 0.80%)p56.62( 45.32%)d20.08( 16.08%) f47.22( 37.80%) 1272. (0.00000) RY (21) H 25 s( 0.01%)p 1.00( 2.07%)d33.01( 68.43%) f14.22( 29.49%) 1273. (0.00000) RY (22) H 25 s( 0.00%)p 1.00( 2.29%)d38.48( 88.16%) f 4.17( 9.55%) 1274. (0.00000) RY (23) H 25 s( 0.51%)p 8.63( 4.37%)d86.63( 43.90%) f99.99( 51.22%) 1275. (0.00000) RY (24) H 25 s( 0.02%)p99.99( 7.08%)d99.99( 27.08%) f99.99( 65.82%) 1276. (0.00000) RY (25) H 25 s( 0.43%)p64.08( 27.34%)d96.15( 41.03%) f73.14( 31.21%) 1277. (0.00000) RY (26) H 25 s( 0.05%)p99.99( 25.51%)d99.99( 7.81%) f99.99( 66.64%) 1278. (0.00000) RY (27) H 25 s( 0.14%)p99.99( 27.23%)d99.99( 29.60%) f99.99( 43.03%) 1279. (0.00000) RY (28) H 25 s( 0.17%)p99.99( 28.55%)d99.99( 25.07%) f99.99( 46.22%) 1280. (0.00000) RY (29) H 25 s( 0.23%)p20.10( 4.67%)d99.99( 26.20%) f99.99( 68.89%) 1281. (0.00057) RY ( 1) H 26 s( 79.85%)p 0.19( 15.47%)d 0.06( 4.45%) f 0.00( 0.23%) -0.0018 0.8888 0.0918 -0.0103 -0.1356 0.0485 0.0075 0.0532 0.1792 0.0312 0.1283 0.2779 -0.0652 0.0768 -0.0031 0.1197 -0.0148 0.1263 -0.0119 -0.0586 0.0010 -0.0672 0.0042 0.0323 0.0023 0.0076 -0.0283 0.0185 0.0016 0.0080 1282. (0.00040) RY ( 2) H 26 s( 20.34%)p 2.76( 56.23%)d 1.05( 21.43%) f 0.10( 2.00%) -0.0026 -0.2407 0.3807 -0.0236 -0.6494 -0.1798 0.0980 0.1194 0.1483 0.0043 0.2467 -0.0263 0.0301 -0.0641 0.0023 0.4349 -0.0565 -0.0550 -0.0123 0.0947 -0.0153 -0.0685 0.0282 0.0445 -0.1219 0.0324 -0.0276 0.0356 0.0088 -0.0004 1283. (0.00035) RY ( 3) H 26 s( 63.75%)p 0.38( 23.99%)d 0.18( 11.36%) f 0.01( 0.90%) -0.0089 -0.0676 0.7954 -0.0151 0.3469 0.1193 -0.0424 -0.1682 0.1937 0.0612 0.1657 -0.0370 0.0714 0.1035 -0.0070 -0.1763 0.0326 0.1587 -0.0554 -0.0560 -0.0012 0.1976 0.0139 -0.0768 0.0519 0.0150 0.0089 -0.0100 0.0006 0.0043 1284. (0.00026) RY ( 4) H 26 s( 3.47%)p17.82( 61.90%)d 9.87( 34.30%) f 0.09( 0.32%) -0.0001 0.0773 0.1609 0.0538 0.1913 0.0059 -0.0020 0.7439 0.1033 -0.0709 0.0184 -0.1087 0.0347 -0.0959 0.0121 -0.1481 0.0223 -0.5378 0.0572 -0.0705 0.0014 -0.1146 0.0241 -0.0030 -0.0024 0.0416 0.0352 0.0045 -0.0041 -0.0146 1285. (0.00017) RY ( 5) H 26 s( 10.88%)p 5.95( 64.68%)d 2.21( 24.03%) f 0.04( 0.41%) 0.0038 0.0975 0.2889 0.1257 -0.0637 -0.1594 -0.0236 -0.2752 -0.6948 -0.1761 0.0683 0.1496 -0.0167 -0.0211 0.0158 -0.1015 0.0199 -0.3037 0.0785 -0.2077 0.0013 -0.2953 0.0126 0.0467 0.0107 -0.0350 -0.0229 0.0019 -0.0050 -0.0002 1286. (0.00003) RY ( 6) H 26 s( 3.72%)p13.51( 50.27%)d10.64( 39.60%) f 1.72( 6.41%) 1287. (0.00003) RY ( 7) H 26 s( 4.83%)p 9.89( 47.75%)d 8.33( 40.20%) f 1.50( 7.22%) 1288. (0.00002) RY ( 8) H 26 s( 7.73%)p 9.17( 70.88%)d 2.68( 20.69%) f 0.09( 0.70%) 1289. (0.00001) RY ( 9) H 26 s( 12.89%)p 4.18( 53.86%)d 1.50( 19.35%) f 1.08( 13.90%) 1290. (0.00001) RY (10) H 26 s( 3.04%)p10.45( 31.80%)d14.00( 42.59%) f 7.42( 22.57%) 1291. (0.00001) RY (11) H 26 s( 12.06%)p 1.29( 15.60%)d 4.53( 54.62%) f 1.47( 17.73%) 1292. (0.00000) RY (12) H 26 s( 1.85%)p22.58( 41.86%)d23.55( 43.64%) f 6.82( 12.65%) 1293. (0.00000) RY (13) H 26 s( 37.22%)p 0.79( 29.31%)d 0.85( 31.70%) f 0.05( 1.77%) 1294. (0.00000) RY (14) H 26 s( 0.11%)p99.99( 30.83%)d99.99( 46.11%) f99.99( 22.94%) 1295. (0.00000) RY (15) H 26 s( 1.06%)p12.77( 13.50%)d30.21( 31.94%) f50.62( 53.51%) 1296. (0.00000) RY (16) H 26 s( 0.08%)p99.99( 31.88%)d99.99( 32.33%) f99.99( 35.72%) 1297. (0.00000) RY (17) H 26 s( 4.99%)p 8.08( 40.36%)d 0.79( 3.94%) f10.16( 50.71%) 1298. (0.00000) RY (18) H 26 s( 23.73%)p 1.08( 25.70%)d 1.36( 32.24%) f 0.77( 18.33%) 1299. (0.00000) RY (19) H 26 s( 0.92%)p43.03( 39.38%)d26.89( 24.61%) f38.35( 35.10%) 1300. (0.00000) RY (20) H 26 s( 6.54%)p 2.48( 16.25%)d10.80( 70.60%) f 1.01( 6.61%) 1301. (0.00000) RY (21) H 26 s( 0.10%)p14.58( 1.42%)d99.99( 88.67%) f99.99( 9.81%) 1302. (0.00000) RY (22) H 26 s( 0.01%)p99.99( 1.32%)d99.99( 80.23%) f99.99( 18.44%) 1303. (0.00000) RY (23) H 26 s( 0.13%)p67.19( 8.53%)d99.99( 40.46%) f99.99( 50.89%) 1304. (0.00000) RY (24) H 26 s( 0.09%)p99.99( 17.60%)d99.99( 38.86%) f99.99( 43.45%) 1305. (0.00000) RY (25) H 26 s( 0.02%)p99.99( 20.05%)d99.99( 36.04%) f99.99( 43.89%) 1306. (0.00000) RY (26) H 26 s( 0.00%)p 1.00( 14.92%)d 1.28( 19.05%) f 4.42( 66.02%) 1307. (0.00000) RY (27) H 26 s( 0.04%)p99.99( 30.02%)d99.99( 23.11%) f99.99( 46.83%) 1308. (0.00000) RY (28) H 26 s( 0.06%)p99.99( 33.74%)d99.99( 22.28%) f99.99( 43.93%) 1309. (0.00000) RY (29) H 26 s( 0.61%)p17.75( 10.84%)d35.31( 21.56%) f99.99( 66.99%) 1310. (0.00065) RY ( 1) H 27 s( 93.72%)p 0.05( 4.92%)d 0.01( 1.20%) f 0.00( 0.16%) 0.0033 0.9681 -0.0022 0.0007 -0.0965 0.1506 -0.0766 0.0956 0.0092 0.0336 -0.0065 0.0285 -0.0089 0.0991 0.0116 -0.0111 -0.0043 0.0095 0.0017 -0.0359 -0.0089 0.0175 0.0118 -0.0100 -0.0301 0.0099 0.0104 -0.0045 0.0154 -0.0119 1311. (0.00049) RY ( 2) H 27 s( 66.41%)p 0.40( 26.88%)d 0.10( 6.47%) f 0.00( 0.24%) 0.0070 -0.0014 0.8149 0.0038 -0.2034 -0.2197 -0.0047 0.3477 -0.0844 -0.0266 0.2194 0.0385 -0.0276 -0.1877 0.0394 -0.1492 0.0194 0.0053 0.0015 -0.0123 0.0012 0.0708 0.0074 -0.0139 0.0356 -0.0101 0.0158 -0.0150 0.0073 -0.0185 1312. (0.00047) RY ( 3) H 27 s( 6.44%)p10.73( 69.07%)d 3.54( 22.79%) f 0.26( 1.70%) 0.0019 0.0082 0.2536 -0.0025 0.0440 -0.0370 -0.0129 0.0903 -0.0183 -0.0048 -0.7913 -0.2089 0.0944 -0.0299 0.0084 0.4301 -0.0690 -0.1336 0.0124 -0.0490 0.0086 0.1283 -0.0143 0.0852 -0.0334 0.0081 -0.0735 0.0523 0.0140 -0.0161 1313. (0.00029) RY ( 4) H 27 s( 14.85%)p 4.16( 61.76%)d 1.56( 23.19%) f 0.01( 0.19%) -0.0028 0.0219 0.3846 -0.0126 -0.1749 0.0446 -0.0063 -0.7602 -0.0681 0.0490 -0.0068 0.0031 -0.0062 0.3693 -0.0498 0.0210 -0.0056 0.0563 -0.0072 0.2957 -0.0405 0.0019 0.0178 -0.0081 -0.0170 0.0217 0.0017 -0.0080 -0.0238 -0.0206 1314. (0.00017) RY ( 5) H 27 s( 1.69%)p43.60( 73.57%)d14.09( 23.78%) f 0.57( 0.97%) 0.0008 -0.0034 -0.0037 0.1298 0.0227 0.1667 -0.0680 -0.1905 -0.7970 -0.1755 -0.0005 0.0196 -0.0023 -0.1429 0.0922 -0.0311 0.0003 -0.0190 0.0120 -0.4527 0.0214 -0.0450 0.0013 -0.0169 -0.0622 0.0208 0.0142 -0.0138 0.0204 -0.0654 1315. (0.00004) RY ( 6) H 27 s( 4.08%)p17.21( 70.18%)d 5.00( 20.40%) f 1.31( 5.34%) 1316. (0.00002) RY ( 7) H 27 s( 0.38%)p99.99( 40.06%)d99.99( 58.18%) f 3.64( 1.38%) 1317. (0.00002) RY ( 8) H 27 s( 5.32%)p12.11( 64.47%)d 5.41( 28.82%) f 0.26( 1.38%) 1318. (0.00001) RY ( 9) H 27 s( 0.21%)p99.99( 49.74%)d28.47( 6.02%) f99.99( 44.03%) 1319. (0.00001) RY (10) H 27 s( 34.77%)p 0.77( 26.75%)d 1.02( 35.61%) f 0.08( 2.87%) 1320. (0.00001) RY (11) H 27 s( 0.31%)p34.44( 10.61%)d99.99( 88.69%) f 1.28( 0.39%) 1321. (0.00000) RY (12) H 27 s( 9.35%)p 3.49( 32.64%)d 4.90( 45.80%) f 1.31( 12.21%) 1322. (0.00000) RY (13) H 27 s( 7.58%)p 2.03( 15.35%)d 3.52( 26.67%) f 6.65( 50.41%) 1323. (0.00000) RY (14) H 27 s( 0.27%)p19.01( 5.11%)d35.26( 9.48%) f99.99( 85.13%) 1324. (0.00000) RY (15) H 27 s( 2.12%)p 3.47( 7.37%)d10.13( 21.49%) f32.54( 69.02%) 1325. (0.00000) RY (16) H 27 s( 6.57%)p 8.44( 55.40%)d 3.16( 20.74%) f 2.63( 17.29%) 1326. (0.00000) RY (17) H 27 s( 6.17%)p 4.90( 30.24%)d 4.21( 26.00%) f 6.09( 37.59%) 1327. (0.00000) RY (18) H 27 s( 2.31%)p26.86( 62.06%)d 3.92( 9.07%) f11.50( 26.57%) 1328. (0.00000) RY (19) H 27 s( 6.30%)p 4.26( 26.87%)d 8.70( 54.83%) f 1.90( 12.00%) 1329. (0.00000) RY (20) H 27 s( 24.43%)p 1.28( 31.23%)d 1.45( 35.53%) f 0.36( 8.81%) 1330. (0.00000) RY (21) H 27 s( 0.01%)p 1.00( 0.72%)d99.99( 91.48%) f10.81( 7.79%) 1331. (0.00000) RY (22) H 27 s( 0.02%)p63.49( 1.38%)d99.99( 90.68%) f99.99( 7.92%) 1332. (0.00000) RY (23) H 27 s( 0.15%)p99.99( 18.98%)d99.99( 52.90%) f99.99( 27.97%) 1333. (0.00000) RY (24) H 27 s( 1.11%)p22.63( 25.10%)d12.11( 13.43%) f54.43( 60.37%) 1334. (0.00000) RY (25) H 27 s( 0.34%)p96.06( 32.70%)d37.80( 12.87%) f99.99( 54.10%) 1335. (0.00000) RY (26) H 27 s( 1.35%)p 4.82( 6.50%)d24.57( 33.17%) f43.67( 58.97%) 1336. (0.00000) RY (27) H 27 s( 0.51%)p28.04( 14.26%)d73.23( 37.25%) f94.32( 47.98%) 1337. (0.00000) RY (28) H 27 s( 2.98%)p 9.49( 28.31%)d13.79( 41.15%) f 9.24( 27.56%) 1338. (0.00000) RY (29) H 27 s( 0.37%)p20.54( 7.68%)d99.99( 62.31%) f79.28( 29.63%) 1339. (0.00111) RY ( 1) H 28 s( 83.91%)p 0.19( 15.84%)d 0.00( 0.24%) f 0.00( 0.02%) -0.0040 0.9149 -0.0464 -0.0006 -0.2937 -0.0705 -0.0541 -0.2395 -0.0209 -0.0137 -0.0661 0.0301 -0.0307 -0.0136 0.0103 0.0324 0.0095 -0.0179 0.0064 0.0123 0.0092 0.0181 -0.0005 0.0041 0.0094 -0.0013 0.0068 -0.0004 0.0013 0.0007 1340. (0.00050) RY ( 2) H 28 s( 5.41%)p13.39( 72.39%)d 3.78( 20.44%) f 0.33( 1.76%) -0.0005 0.1406 0.1851 -0.0066 0.5490 0.1991 -0.0591 -0.0863 -0.0529 0.0223 -0.5964 -0.1089 0.0342 -0.0823 0.0175 -0.0314 0.0088 0.0063 -0.0024 0.2463 -0.0284 -0.3632 0.0537 -0.0801 -0.0902 0.0126 0.0352 -0.0184 0.0305 -0.0201 1341. (0.00049) RY ( 3) H 28 s( 67.05%)p 0.38( 25.33%)d 0.11( 7.31%) f 0.00( 0.31%) 0.0030 0.1588 0.8033 0.0054 0.0502 0.1524 -0.0277 0.3352 -0.0926 0.0164 0.2366 0.2161 -0.0536 0.0867 -0.0122 0.0202 -0.0022 0.1265 -0.0122 0.1369 -0.0061 0.1725 -0.0185 -0.0187 0.0417 -0.0132 0.0037 0.0010 -0.0262 0.0125 1342. (0.00032) RY ( 4) H 28 s( 20.45%)p 2.46( 50.38%)d 1.42( 28.99%) f 0.01( 0.17%) 0.0008 -0.1945 0.4063 -0.0400 -0.0995 0.0488 0.0419 -0.6936 0.0379 0.0588 0.0593 0.0190 0.0042 -0.3772 0.0483 -0.0120 -0.0130 -0.3560 0.0550 -0.0957 0.0191 0.0755 -0.0051 0.0077 0.0043 -0.0044 -0.0122 -0.0360 -0.0015 -0.0141 1343. (0.00013) RY ( 5) H 28 s( 4.95%)p15.93( 78.83%)d 2.92( 14.47%) f 0.35( 1.75%) 0.0068 -0.0880 0.1638 0.1219 -0.0647 -0.4331 -0.0064 -0.2015 -0.6688 -0.1522 -0.0188 -0.2894 0.0361 0.2113 -0.0449 -0.1937 -0.0582 0.2178 -0.0492 -0.0106 -0.0534 -0.0642 -0.0122 0.0340 -0.0835 -0.0039 -0.0873 0.0057 -0.0405 -0.0082 1344. (0.00004) RY ( 6) H 28 s( 1.49%)p34.41( 51.13%)d29.49( 43.82%) f 2.40( 3.57%) 1345. (0.00003) RY ( 7) H 28 s( 2.74%)p19.07( 52.22%)d13.31( 36.43%) f 3.14( 8.61%) 1346. (0.00002) RY ( 8) H 28 s( 6.62%)p10.16( 67.25%)d 3.67( 24.27%) f 0.28( 1.87%) 1347. (0.00002) RY ( 9) H 28 s( 13.59%)p 3.28( 44.60%)d 2.93( 39.78%) f 0.15( 2.02%) 1348. (0.00001) RY (10) H 28 s( 0.35%)p99.99( 52.98%)d18.85( 6.54%) f99.99( 40.13%) 1349. (0.00000) RY (11) H 28 s( 52.94%)p 0.30( 15.66%)d 0.51( 26.94%) f 0.08( 4.46%) 1350. (0.00000) RY (12) H 28 s( 4.66%)p 1.70( 7.94%)d17.84( 83.05%) f 0.94( 4.36%) 1351. (0.00000) RY (13) H 28 s( 0.64%)p61.11( 39.11%)d76.69( 49.08%) f17.46( 11.17%) 1352. (0.00000) RY (14) H 28 s( 15.82%)p 0.55( 8.64%)d 4.64( 73.47%) f 0.13( 2.08%) 1353. (0.00000) RY (15) H 28 s( 0.02%)p99.99( 12.95%)d99.99( 57.22%) f99.99( 29.81%) 1354. (0.00000) RY (16) H 28 s( 0.45%)p85.90( 38.53%)d83.82( 37.60%) f52.20( 23.42%) 1355. (0.00000) RY (17) H 28 s( 1.38%)p 3.61( 4.99%)d28.89( 39.99%) f38.75( 53.64%) 1356. (0.00000) RY (18) H 28 s( 1.34%)p31.13( 41.76%)d 7.32( 9.82%) f35.10( 47.08%) 1357. (0.00000) RY (19) H 28 s( 13.65%)p 2.59( 35.41%)d 2.18( 29.74%) f 1.55( 21.20%) 1358. (0.00000) RY (20) H 28 s( 0.93%)p56.42( 52.66%)d10.25( 9.57%) f39.48( 36.84%) 1359. (0.00000) RY (21) H 28 s( 0.12%)p 6.65( 0.83%)d99.99( 94.17%) f39.23( 4.88%) 1360. (0.00000) RY (22) H 28 s( 0.25%)p10.31( 2.57%)d99.99( 84.38%) f51.43( 12.81%) 1361. (0.00000) RY (23) H 28 s( 0.34%)p11.47( 3.96%)d42.02( 14.49%) f99.99( 81.21%) 1362. (0.00000) RY (24) H 28 s( 0.11%)p99.99( 42.61%)d99.99( 17.44%) f99.99( 39.84%) 1363. (0.00000) RY (25) H 28 s( 0.04%)p99.99( 16.85%)d99.99( 54.34%) f99.99( 28.77%) 1364. (0.00000) RY (26) H 28 s( 0.15%)p10.06( 1.55%)d99.99( 24.70%) f99.99( 73.59%) 1365. (0.00000) RY (27) H 28 s( 0.19%)p99.99( 26.13%)d99.99( 31.61%) f99.99( 42.08%) 1366. (0.00000) RY (28) H 28 s( 0.38%)p83.35( 31.54%)d46.14( 17.46%) f99.99( 50.61%) 1367. (0.00000) RY (29) H 28 s( 0.16%)p33.04( 5.28%)d99.99( 22.64%) f99.99( 71.92%) 1368. (0.00060) RY ( 1) H 29 s( 79.33%)p 0.20( 15.99%)d 0.06( 4.52%) f 0.00( 0.16%) 0.0025 0.8893 -0.0462 0.0143 -0.0144 -0.1467 0.0096 -0.0445 -0.2560 -0.0456 0.1251 0.2214 -0.0613 -0.1091 0.0104 0.0837 -0.0069 0.1443 -0.0231 0.0370 0.0008 0.0577 -0.0086 0.0086 -0.0260 -0.0074 -0.0162 0.0184 0.0070 -0.0139 1369. (0.00039) RY ( 2) H 29 s( 72.25%)p 0.29( 20.96%)d 0.08( 6.03%) f 0.01( 0.76%) -0.0058 0.1141 0.8421 -0.0165 -0.2025 -0.1066 0.0801 0.0876 0.1888 0.0109 -0.3145 0.0726 -0.0565 -0.0373 -0.0068 -0.2088 0.0023 0.0393 0.0263 0.0892 -0.0154 -0.0569 0.0399 -0.0287 -0.0578 0.0285 0.0376 -0.0345 -0.0006 0.0083 1370. (0.00037) RY ( 3) H 29 s( 14.62%)p 3.86( 56.44%)d 1.82( 26.61%) f 0.16( 2.32%) -0.0054 -0.0100 0.3821 -0.0091 0.6639 0.1687 -0.0865 -0.1179 0.0654 0.0454 0.2122 0.1263 -0.0808 0.1178 -0.0131 0.2796 -0.0505 -0.0792 0.0305 -0.1687 0.0217 0.3664 -0.0315 0.1339 0.0246 0.0077 -0.0594 0.0298 0.0107 -0.0104 1371. (0.00023) RY ( 4) H 29 s( 1.90%)p29.12( 55.22%)d22.46( 42.59%) f 0.16( 0.30%) -0.0029 0.1200 -0.0078 -0.0670 -0.1474 0.0152 0.0058 -0.7129 -0.0237 0.1044 -0.0651 -0.0774 0.0158 0.2459 -0.0314 -0.1884 0.0257 -0.5453 0.0668 0.1275 -0.0095 0.1003 -0.0093 0.0187 0.0080 -0.0302 0.0321 0.0217 -0.0052 0.0104 1372. (0.00020) RY ( 5) H 29 s( 12.36%)p 5.42( 66.99%)d 1.64( 20.30%) f 0.03( 0.35%) 0.0021 -0.2186 0.2417 0.1319 -0.0499 -0.1244 -0.0559 -0.3404 -0.6903 -0.1463 -0.0801 -0.1690 0.0039 -0.0208 0.0319 0.1794 -0.0311 0.2476 -0.0682 -0.2649 0.0119 -0.1793 0.0014 -0.0080 0.0405 -0.0359 0.0039 0.0200 -0.0072 0.0002 1373. (0.00003) RY ( 6) H 29 s( 3.03%)p15.40( 46.60%)d14.59( 44.17%) f 2.05( 6.20%) 1374. (0.00003) RY ( 7) H 29 s( 6.57%)p 7.13( 46.81%)d 5.81( 38.17%) f 1.29( 8.45%) 1375. (0.00002) RY ( 8) H 29 s( 4.11%)p17.81( 73.21%)d 5.38( 22.12%) f 0.13( 0.55%) 1376. (0.00001) RY ( 9) H 29 s( 0.22%)p99.99( 54.05%)d39.55( 8.58%) f99.99( 37.16%) 1377. (0.00001) RY (10) H 29 s( 7.81%)p 1.16( 9.04%)d10.50( 82.07%) f 0.14( 1.07%) 1378. (0.00000) RY (11) H 29 s( 1.59%)p13.23( 20.99%)d15.36( 24.36%) f33.45( 53.06%) 1379. (0.00000) RY (12) H 29 s( 0.24%)p99.99( 30.21%)d99.99( 46.62%) f95.01( 22.93%) 1380. (0.00000) RY (13) H 29 s( 1.35%)p21.03( 28.45%)d24.38( 32.97%) f27.52( 37.22%) 1381. (0.00000) RY (14) H 29 s( 1.57%)p16.46( 25.84%)d10.25( 16.10%) f35.98( 56.49%) 1382. (0.00000) RY (15) H 29 s( 4.15%)p 6.21( 25.75%)d 2.02( 8.38%) f14.89( 61.72%) 1383. (0.00000) RY (16) H 29 s( 42.86%)p 0.21( 8.82%)d 1.03( 44.28%) f 0.09( 4.04%) 1384. (0.00000) RY (17) H 29 s( 5.20%)p 6.96( 36.18%)d 5.58( 29.05%) f 5.69( 29.57%) 1385. (0.00000) RY (18) H 29 s( 1.96%)p16.83( 33.00%)d22.97( 45.04%) f10.20( 20.00%) 1386. (0.00000) RY (19) H 29 s( 9.23%)p 4.90( 45.18%)d 4.09( 37.76%) f 0.85( 7.83%) 1387. (0.00000) RY (20) H 29 s( 8.92%)p 4.82( 43.01%)d 4.24( 37.85%) f 1.14( 10.21%) 1388. (0.00000) RY (21) H 29 s( 19.19%)p 2.35( 45.02%)d 1.60( 30.76%) f 0.26( 5.03%) 1389. (0.00000) RY (22) H 29 s( 0.26%)p10.56( 2.72%)d99.99( 83.85%) f51.20( 13.18%) 1390. (0.00000) RY (23) H 29 s( 0.00%)p 1.00( 1.42%)d61.95( 87.73%) f 7.67( 10.85%) 1391. (0.00000) RY (24) H 29 s( 0.36%)p24.96( 8.97%)d98.84( 35.52%) f99.99( 55.15%) 1392. (0.00000) RY (25) H 29 s( 0.05%)p99.99( 28.61%)d99.99( 33.50%) f99.99( 37.84%) 1393. (0.00000) RY (26) H 29 s( 0.50%)p15.22( 7.68%)d88.04( 44.44%) f93.87( 47.38%) 1394. (0.00000) RY (27) H 29 s( 0.06%)p99.99( 33.91%)d99.99( 22.25%) f99.99( 43.77%) 1395. (0.00000) RY (28) H 29 s( 0.25%)p22.14( 5.49%)d35.97( 8.92%) f99.99( 85.35%) 1396. (0.00000) RY (29) H 29 s( 0.20%)p99.99( 23.35%)d99.99( 35.43%) f99.99( 41.03%) NHO DIRECTIONALITY AND BOND BENDING (deviation from line of nuclear centers at the position of maximum hybrid amplitude) [Thresholds for printing: angular deviation > 1.0 degree] p- or d-character > 25.0% orbital occupancy > 0.10e Line of Centers Hybrid 1 Hybrid 2 --------------- ------------------- ------------------ NBO Theta Phi Theta Phi Dev Theta Phi Dev =============================================================================== 48. LP ( 1)Co 1 -- -- 91.7 252.9 -- -- -- -- 49. LP ( 2)Co 1 -- -- 93.6 1.1 -- -- -- -- 50. LP ( 3)Co 1 -- -- 139.1 320.3 -- -- -- -- 52. LP ( 2) S 2 -- -- 126.4 77.8 -- -- -- -- 53. LP ( 1) S 3 -- -- 106.7 114.4 -- -- -- -- 54. LP ( 2) S 3 -- -- 130.0 249.5 -- -- -- -- 56. LP ( 2) S 4 -- -- 88.5 145.1 -- -- -- -- 57. LP ( 1) S 5 -- -- 68.4 116.4 -- -- -- -- 58. LP ( 2) S 5 -- -- 55.3 252.3 -- -- -- -- 60. LP ( 2) S 6 -- -- 50.2 78.5 -- -- -- -- 61. BD ( 1)Co 1- S 2 139.3 222.1 132.7 226.9 7.3 36.3 49.8 6.5 62. BD ( 1)Co 1- S 6 43.1 225.0 49.9 228.9 7.3 141.2 53.6 7.1 63. BD ( 1)Co 1- P 10 91.0 311.0 91.5 303.7 7.3 89.7 133.4 2.5 64. BD ( 1) S 2- S 3 86.6 164.0 86.2 165.4 1.5 90.9 342.5 2.9 65. BD ( 1) S 3- S 4 41.6 234.4 41.0 235.7 1.1 137.4 54.5 1.0 66. BD ( 1) S 4- S 5 37.0 50.9 -- -- -- 143.6 232.5 1.1 67. BD ( 1) S 5- S 6 88.0 345.2 91.1 343.9 3.4 93.0 166.8 1.9 68. BD ( 1) C 7- P 10 148.4 172.2 -- -- -- 31.2 356.2 2.2 70. BD ( 1) C 7- H 17 78.1 61.8 76.9 60.7 1.5 -- -- -- 71. BD ( 1) C 7- H 18 42.0 197.6 40.3 198.5 1.8 -- -- -- 72. BD ( 1) C 8- P 10 82.1 69.8 82.1 71.0 1.3 97.8 246.3 3.4 74. BD ( 1) C 8- H 20 51.5 193.5 52.0 195.9 2.0 -- -- -- 75. BD ( 1) C 8- H 21 160.2 198.1 159.5 202.0 1.5 -- -- -- 76. BD ( 1) C 9- P 10 43.0 187.8 42.2 186.5 1.1 136.5 11.2 2.4 78. BD ( 1) C 9- H 23 150.6 175.5 152.5 175.5 1.9 -- -- -- 79. BD ( 1) C 9- H 24 84.1 57.7 85.3 56.7 1.5 -- -- -- 80. BD ( 1) C 11- C 12 65.1 345.3 57.6 357.1 12.8 107.8 160.3 8.5 81. BD ( 1) C 11- C 15 172.9 1.3 164.9 77.4 15.0 17.9 125.6 15.0 82. BD ( 1) C 11- H 25 61.2 170.7 61.1 169.2 1.3 -- -- -- Failed to locate density maximum for hybrid 105 on center 12 83. BD ( 1) C 12- C 13 137.6 348.3 -- -- -- 36.5 147.6 14.3 84. BD ( 2) C 12- C 13 137.6 348.3 101.4 260.5 80.1 86.5 247.2 80.0 86. BD ( 1) C 13- C 14 151.1 164.6 156.7 148.8 8.9 37.8 3.3 13.5 88. BD ( 1) C 14- C 15 78.3 165.7 85.8 154.5 13.4 108.7 357.5 13.3 90. BD ( 1) C 15- H 28 132.4 169.4 132.5 167.5 1.4 -- -- -- SECOND ORDER PERTURBATION THEORY ANALYSIS OF FOCK MATRIX IN NBO BASIS Threshold for printing: 0.50 kcal/mol (Intermolecular threshold: 0.05 kcal/mol) E(2) E(NL)-E(L) F(L,NL) Donor (L) NBO Acceptor (NL) NBO kcal/mol a.u. a.u. =============================================================================== within unit 1 48. LP ( 1)Co 1 93. BD*( 1)Co 1- S 2 0.55 0.35 0.012 48. LP ( 1)Co 1 94. BD*( 1)Co 1- S 6 0.53 0.35 0.012 48. LP ( 1)Co 1 133. RY (10)Co 1 0.71 2.49 0.038 48. LP ( 1)Co 1 212. RY ( 4) S 2 1.24 1.89 0.043 48. LP ( 1)Co 1 213. RY ( 5) S 2 0.90 2.29 0.041 48. LP ( 1)Co 1 456. RY ( 4) S 6 1.11 1.84 0.040 48. LP ( 1)Co 1 457. RY ( 5) S 6 0.57 2.57 0.034 48. LP ( 1)Co 1 670. RY ( 1) P 10 2.28 1.88 0.058 48. LP ( 1)Co 1 675. RY ( 6) P 10 1.18 1.71 0.040 49. LP ( 2)Co 1 95. BD*( 1)Co 1- P 10 2.03 0.34 0.024 49. LP ( 2)Co 1 99. BD*( 1) S 5- S 6 0.50 0.32 0.011 49. LP ( 2)Co 1 213. RY ( 5) S 2 0.60 2.27 0.033 49. LP ( 2)Co 1 454. RY ( 2) S 6 0.53 1.40 0.024 49. LP ( 2)Co 1 459. RY ( 7) S 6 0.83 2.46 0.040 49. LP ( 2)Co 1 670. RY ( 1) P 10 0.95 1.86 0.038 49. LP ( 2)Co 1 675. RY ( 6) P 10 0.63 1.69 0.029 50. LP ( 3)Co 1 93. BD*( 1)Co 1- S 2 0.61 0.33 0.013 50. LP ( 3)Co 1 96. BD*( 1) S 2- S 3 0.65 0.32 0.013 50. LP ( 3)Co 1 100. BD*( 1) C 7- P 10 0.72 0.40 0.015 50. LP ( 3)Co 1 215. RY ( 7) S 2 0.51 2.56 0.032 50. LP ( 3)Co 1 671. RY ( 2) P 10 0.92 1.61 0.034 50. LP ( 3)Co 1 672. RY ( 3) P 10 1.30 1.48 0.039 50. LP ( 3)Co 1 676. RY ( 7) P 10 2.36 1.72 0.057 51. LP ( 1) S 2 93. BD*( 1)Co 1- S 2 2.23 0.59 0.032 51. LP ( 1) S 2 94. BD*( 1)Co 1- S 6 4.49 0.59 0.046 51. LP ( 1) S 2 95. BD*( 1)Co 1- P 10 3.48 0.60 0.041 51. LP ( 1) S 2 100. BD*( 1) C 7- P 10 1.14 0.66 0.025 51. LP ( 1) S 2 135. RY (12)Co 1 1.00 3.02 0.049 51. LP ( 1) S 2 138. RY (15)Co 1 1.34 4.42 0.069 51. LP ( 1) S 2 148. RY (25)Co 1 0.71 5.79 0.057 51. LP ( 1) S 2 156. RY (33)Co 1 0.82 5.48 0.060 51. LP ( 1) S 2 173. RY (50)Co 1 0.54 6.71 0.054 51. LP ( 1) S 2 176. RY (53)Co 1 0.94 110.53 0.288 51. LP ( 1) S 2 178. RY (55)Co 1 0.59 119.58 0.237 51. LP ( 1) S 2 179. RY (56)Co 1 0.60 51.86 0.157 51. LP ( 1) S 2 180. RY (57)Co 1 0.56 121.80 0.232 51. LP ( 1) S 2 181. RY (58)Co 1 0.93 247.16 0.429 51. LP ( 1) S 2 182. RY (59)Co 1 0.72 60.85 0.187 51. LP ( 1) S 2 183. RY (60)Co 1 1.16 111.92 0.322 51. LP ( 1) S 2 186. RY (63)Co 1 0.69 153.43 0.290 51. LP ( 1) S 2 199. RY (76)Co 1 0.62 14.25 0.084 51. LP ( 1) S 2 203. RY (80)Co 1 0.52 8.84 0.060 51. LP ( 1) S 2 204. RY (81)Co 1 1.14 11.52 0.102 51. LP ( 1) S 2 214. RY ( 6) S 2 0.55 3.01 0.036 52. LP ( 2) S 2 94. BD*( 1)Co 1- S 6 1.43 0.34 0.020 52. LP ( 2) S 2 95. BD*( 1)Co 1- P 10 1.02 0.34 0.017 52. LP ( 2) S 2 97. BD*( 1) S 3- S 4 7.47 0.28 0.041 52. LP ( 2) S 2 270. RY ( 1) S 3 3.86 0.95 0.054 54. LP ( 2) S 3 93. BD*( 1)Co 1- S 2 1.99 0.35 0.024 54. LP ( 2) S 3 98. BD*( 1) S 4- S 5 5.24 0.30 0.035 54. LP ( 2) S 3 209. RY ( 1) S 2 2.55 1.36 0.053 54. LP ( 2) S 3 274. RY ( 5) S 3 0.60 1.90 0.030 54. LP ( 2) S 3 331. RY ( 1) S 4 2.98 0.95 0.047 56. LP ( 2) S 4 96. BD*( 1) S 2- S 3 4.82 0.34 0.036 56. LP ( 2) S 4 99. BD*( 1) S 5- S 6 4.81 0.34 0.036 56. LP ( 2) S 4 270. RY ( 1) S 3 2.08 0.97 0.040 56. LP ( 2) S 4 271. RY ( 2) S 3 1.06 0.93 0.028 56. LP ( 2) S 4 335. RY ( 5) S 4 0.82 1.90 0.035 56. LP ( 2) S 4 337. RY ( 7) S 4 0.51 1.09 0.021 56. LP ( 2) S 4 392. RY ( 1) S 5 2.08 0.97 0.040 56. LP ( 2) S 4 393. RY ( 2) S 5 1.06 0.92 0.028 58. LP ( 2) S 5 94. BD*( 1)Co 1- S 6 2.09 0.35 0.024 58. LP ( 2) S 5 97. BD*( 1) S 3- S 4 5.26 0.29 0.035 58. LP ( 2) S 5 331. RY ( 1) S 4 2.97 0.94 0.047 58. LP ( 2) S 5 396. RY ( 5) S 5 0.56 1.88 0.029 58. LP ( 2) S 5 453. RY ( 1) S 6 2.46 1.38 0.052 59. LP ( 1) S 6 93. BD*( 1)Co 1- S 2 4.38 0.59 0.045 59. LP ( 1) S 6 94. BD*( 1)Co 1- S 6 2.22 0.59 0.032 59. LP ( 1) S 6 95. BD*( 1)Co 1- P 10 3.37 0.60 0.040 59. LP ( 1) S 6 108. BD*( 1) C 9- P 10 1.37 0.66 0.027 59. LP ( 1) S 6 135. RY (12)Co 1 0.93 3.02 0.047 59. LP ( 1) S 6 138. RY (15)Co 1 1.17 4.42 0.064 59. LP ( 1) S 6 139. RY (16)Co 1 0.81 2.86 0.043 59. LP ( 1) S 6 148. RY (25)Co 1 0.64 5.79 0.054 59. LP ( 1) S 6 156. RY (33)Co 1 0.78 5.48 0.058 59. LP ( 1) S 6 176. RY (53)Co 1 0.95 110.53 0.289 59. LP ( 1) S 6 178. RY (55)Co 1 0.59 119.58 0.237 59. LP ( 1) S 6 179. RY (56)Co 1 0.60 51.86 0.157 59. LP ( 1) S 6 180. RY (57)Co 1 0.56 121.80 0.232 59. LP ( 1) S 6 181. RY (58)Co 1 0.94 247.16 0.430 59. LP ( 1) S 6 182. RY (59)Co 1 0.73 60.84 0.188 59. LP ( 1) S 6 183. RY (60)Co 1 1.16 111.92 0.322 59. LP ( 1) S 6 186. RY (63)Co 1 0.69 153.43 0.291 59. LP ( 1) S 6 199. RY (76)Co 1 0.67 14.25 0.087 59. LP ( 1) S 6 203. RY (80)Co 1 0.51 8.84 0.060 59. LP ( 1) S 6 204. RY (81)Co 1 1.25 11.52 0.107 59. LP ( 1) S 6 214. RY ( 6) S 2 0.54 3.01 0.036 59. LP ( 1) S 6 458. RY ( 6) S 6 0.53 2.90 0.035 60. LP ( 2) S 6 93. BD*( 1)Co 1- S 2 1.49 0.34 0.020 60. LP ( 2) S 6 95. BD*( 1)Co 1- P 10 1.18 0.35 0.018 60. LP ( 2) S 6 98. BD*( 1) S 4- S 5 7.50 0.28 0.041 60. LP ( 2) S 6 392. RY ( 1) S 5 3.84 0.95 0.054 61. BD ( 1)Co 1- S 2 93. BD*( 1)Co 1- S 2 18.63 0.41 0.078 61. BD ( 1)Co 1- S 2 94. BD*( 1)Co 1- S 6 33.90 0.42 0.106 61. BD ( 1)Co 1- S 2 95. BD*( 1)Co 1- P 10 36.43 0.42 0.111 61. BD ( 1)Co 1- S 2 96. BD*( 1) S 2- S 3 0.52 0.40 0.013 61. BD ( 1)Co 1- S 2 100. BD*( 1) C 7- P 10 1.89 0.48 0.027 61. BD ( 1)Co 1- S 2 124. RY ( 1)Co 1 4.30 1.82 0.079 61. BD ( 1)Co 1- S 2 127. RY ( 4)Co 1 2.16 2.30 0.063 61. BD ( 1)Co 1- S 2 128. RY ( 5)Co 1 1.50 1.66 0.044 61. BD ( 1)Co 1- S 2 129. RY ( 6)Co 1 4.16 2.82 0.097 61. BD ( 1)Co 1- S 2 131. RY ( 8)Co 1 0.81 2.22 0.038 61. BD ( 1)Co 1- S 2 132. RY ( 9)Co 1 2.65 2.50 0.073 61. BD ( 1)Co 1- S 2 135. RY (12)Co 1 1.52 2.85 0.059 61. BD ( 1)Co 1- S 2 136. RY (13)Co 1 1.24 2.19 0.047 61. BD ( 1)Co 1- S 2 138. RY (15)Co 1 8.10 4.24 0.165 61. BD ( 1)Co 1- S 2 139. RY (16)Co 1 3.81 2.68 0.090 61. BD ( 1)Co 1- S 2 140. RY (17)Co 1 1.98 3.00 0.069 61. BD ( 1)Co 1- S 2 145. RY (22)Co 1 1.83 2.98 0.066 61. BD ( 1)Co 1- S 2 146. RY (23)Co 1 1.24 2.98 0.054 61. BD ( 1)Co 1- S 2 147. RY (24)Co 1 1.42 3.94 0.067 61. BD ( 1)Co 1- S 2 148. RY (25)Co 1 5.08 5.61 0.151 61. BD ( 1)Co 1- S 2 149. RY (26)Co 1 1.07 3.39 0.054 61. BD ( 1)Co 1- S 2 150. RY (27)Co 1 0.97 3.90 0.055 61. BD ( 1)Co 1- S 2 151. RY (28)Co 1 1.21 3.48 0.058 61. BD ( 1)Co 1- S 2 153. RY (30)Co 1 1.32 4.07 0.065 61. BD ( 1)Co 1- S 2 156. RY (33)Co 1 3.83 5.30 0.127 61. BD ( 1)Co 1- S 2 158. RY (35)Co 1 1.66 7.39 0.099 61. BD ( 1)Co 1- S 2 160. RY (37)Co 1 1.58 5.56 0.084 61. BD ( 1)Co 1- S 2 161. RY (38)Co 1 1.04 6.50 0.073 61. BD ( 1)Co 1- S 2 163. RY (40)Co 1 1.24 5.17 0.071 61. BD ( 1)Co 1- S 2 164. RY (41)Co 1 1.37 8.01 0.093 61. BD ( 1)Co 1- S 2 166. RY (43)Co 1 2.41 10.46 0.142 61. BD ( 1)Co 1- S 2 168. RY (45)Co 1 0.63 11.31 0.075 61. BD ( 1)Co 1- S 2 172. RY (49)Co 1 0.79 7.59 0.069 61. BD ( 1)Co 1- S 2 173. RY (50)Co 1 3.47 6.54 0.134 61. BD ( 1)Co 1- S 2 174. RY (51)Co 1 0.59 6.00 0.053 61. BD ( 1)Co 1- S 2 175. RY (52)Co 1 0.60 7.25 0.059 61. BD ( 1)Co 1- S 2 176. RY (53)Co 1 6.18 110.35 0.737 61. BD ( 1)Co 1- S 2 177. RY (54)Co 1 0.63 23.85 0.109 61. BD ( 1)Co 1- S 2 178. RY (55)Co 1 4.57 119.40 0.659 61. BD ( 1)Co 1- S 2 179. RY (56)Co 1 4.36 51.69 0.424 61. BD ( 1)Co 1- S 2 180. RY (57)Co 1 4.26 121.62 0.642 61. BD ( 1)Co 1- S 2 181. RY (58)Co 1 6.93 246.99 1.168 61. BD ( 1)Co 1- S 2 182. RY (59)Co 1 5.34 60.67 0.508 61. BD ( 1)Co 1- S 2 183. RY (60)Co 1 8.26 111.74 0.857 61. BD ( 1)Co 1- S 2 184. RY (61)Co 1 1.59 25.60 0.180 61. BD ( 1)Co 1- S 2 185. RY (62)Co 1 2.38 24.01 0.213 61. BD ( 1)Co 1- S 2 186. RY (63)Co 1 5.27 153.26 0.802 61. BD ( 1)Co 1- S 2 187. RY (64)Co 1 1.36 20.80 0.150 61. BD ( 1)Co 1- S 2 189. RY (66)Co 1 1.44 12.83 0.122 61. BD ( 1)Co 1- S 2 194. RY (71)Co 1 0.64 10.33 0.072 61. BD ( 1)Co 1- S 2 195. RY (72)Co 1 0.65 11.02 0.076 61. BD ( 1)Co 1- S 2 197. RY (74)Co 1 0.58 8.72 0.063 61. BD ( 1)Co 1- S 2 199. RY (76)Co 1 5.14 14.07 0.240 61. BD ( 1)Co 1- S 2 201. RY (78)Co 1 1.29 9.39 0.098 61. BD ( 1)Co 1- S 2 202. RY (79)Co 1 1.38 8.14 0.095 61. BD ( 1)Co 1- S 2 203. RY (80)Co 1 2.87 8.66 0.141 61. BD ( 1)Co 1- S 2 204. RY (81)Co 1 7.07 11.34 0.253 61. BD ( 1)Co 1- S 2 205. RY (82)Co 1 0.56 10.68 0.069 61. BD ( 1)Co 1- S 2 207. RY (84)Co 1 0.57 12.37 0.075 61. BD ( 1)Co 1- S 2 209. RY ( 1) S 2 1.04 1.43 0.034 61. BD ( 1)Co 1- S 2 212. RY ( 4) S 2 1.37 1.96 0.046 61. BD ( 1)Co 1- S 2 214. RY ( 6) S 2 4.14 2.83 0.097 61. BD ( 1)Co 1- S 2 219. RY (11) S 2 0.83 2.37 0.040 61. BD ( 1)Co 1- S 2 229. RY (21) S 2 0.73 2.25 0.036 61. BD ( 1)Co 1- S 2 230. RY (22) S 2 0.64 2.94 0.039 61. BD ( 1)Co 1- S 2 271. RY ( 2) S 3 0.52 0.99 0.020 61. BD ( 1)Co 1- S 2 272. RY ( 3) S 3 1.40 0.89 0.032 61. BD ( 1)Co 1- S 2 453. RY ( 1) S 6 1.86 1.44 0.046 61. BD ( 1)Co 1- S 2 456. RY ( 4) S 6 1.17 1.90 0.042 61. BD ( 1)Co 1- S 2 457. RY ( 5) S 6 0.86 2.63 0.043 61. BD ( 1)Co 1- S 2 458. RY ( 6) S 6 7.07 2.72 0.124 61. BD ( 1)Co 1- S 2 460. RY ( 8) S 6 0.91 2.18 0.040 61. BD ( 1)Co 1- S 2 463. RY (11) S 6 0.72 2.45 0.038 61. BD ( 1)Co 1- S 2 465. RY (13) S 6 0.59 2.06 0.031 61. BD ( 1)Co 1- S 2 472. RY (20) S 6 0.51 2.29 0.030 61. BD ( 1)Co 1- S 2 476. RY (24) S 6 0.56 2.96 0.036 61. BD ( 1)Co 1- S 2 567. RY ( 2) C 8 0.63 3.24 0.040 61. BD ( 1)Co 1- S 2 570. RY ( 5) C 8 0.71 1.63 0.030 61. BD ( 1)Co 1- S 2 670. RY ( 1) P 10 4.14 1.94 0.080 61. BD ( 1)Co 1- S 2 671. RY ( 2) P 10 0.51 1.69 0.026 61. BD ( 1)Co 1- S 2 673. RY ( 4) P 10 0.69 1.64 0.030 61. BD ( 1)Co 1- S 2 674. RY ( 5) P 10 2.77 1.85 0.064 61. BD ( 1)Co 1- S 2 675. RY ( 6) P 10 1.28 1.77 0.042 61. BD ( 1)Co 1- S 2 677. RY ( 8) P 10 4.26 1.78 0.078 61. BD ( 1)Co 1- S 2 687. RY (18) P 10 0.78 2.93 0.043 62. BD ( 1)Co 1- S 6 93. BD*( 1)Co 1- S 2 33.08 0.42 0.105 62. BD ( 1)Co 1- S 6 94. BD*( 1)Co 1- S 6 17.85 0.42 0.077 62. BD ( 1)Co 1- S 6 95. BD*( 1)Co 1- P 10 35.44 0.42 0.109 62. BD ( 1)Co 1- S 6 99. BD*( 1) S 5- S 6 0.61 0.40 0.014 62. BD ( 1)Co 1- S 6 108. BD*( 1) C 9- P 10 2.01 0.48 0.028 62. BD ( 1)Co 1- S 6 124. RY ( 1)Co 1 3.93 1.82 0.075 62. BD ( 1)Co 1- S 6 127. RY ( 4)Co 1 2.11 2.30 0.062 62. BD ( 1)Co 1- S 6 128. RY ( 5)Co 1 1.43 1.66 0.044 62. BD ( 1)Co 1- S 6 129. RY ( 6)Co 1 4.19 2.82 0.097 62. BD ( 1)Co 1- S 6 132. RY ( 9)Co 1 2.58 2.50 0.072 62. BD ( 1)Co 1- S 6 135. RY (12)Co 1 1.60 2.85 0.060 62. BD ( 1)Co 1- S 6 136. RY (13)Co 1 1.19 2.19 0.045 62. BD ( 1)Co 1- S 6 138. RY (15)Co 1 8.48 4.24 0.169 62. BD ( 1)Co 1- S 6 139. RY (16)Co 1 2.09 2.68 0.067 62. BD ( 1)Co 1- S 6 140. RY (17)Co 1 1.85 3.00 0.066 62. BD ( 1)Co 1- S 6 145. RY (22)Co 1 2.30 2.98 0.074 62. BD ( 1)Co 1- S 6 147. RY (24)Co 1 1.54 3.94 0.069 62. BD ( 1)Co 1- S 6 148. RY (25)Co 1 5.35 5.61 0.155 62. BD ( 1)Co 1- S 6 149. RY (26)Co 1 0.92 3.39 0.050 62. BD ( 1)Co 1- S 6 150. RY (27)Co 1 1.37 3.90 0.065 62. BD ( 1)Co 1- S 6 151. RY (28)Co 1 1.22 3.48 0.058 62. BD ( 1)Co 1- S 6 153. RY (30)Co 1 1.10 4.07 0.060 62. BD ( 1)Co 1- S 6 156. RY (33)Co 1 3.61 5.30 0.123 62. BD ( 1)Co 1- S 6 158. RY (35)Co 1 1.66 7.39 0.099 62. BD ( 1)Co 1- S 6 160. RY (37)Co 1 1.72 5.56 0.087 62. BD ( 1)Co 1- S 6 161. RY (38)Co 1 0.98 6.50 0.071 62. BD ( 1)Co 1- S 6 163. RY (40)Co 1 1.06 5.17 0.066 62. BD ( 1)Co 1- S 6 164. RY (41)Co 1 1.10 8.01 0.084 62. BD ( 1)Co 1- S 6 166. RY (43)Co 1 2.13 10.46 0.133 62. BD ( 1)Co 1- S 6 172. RY (49)Co 1 0.71 7.59 0.066 62. BD ( 1)Co 1- S 6 173. RY (50)Co 1 3.45 6.54 0.134 62. BD ( 1)Co 1- S 6 174. RY (51)Co 1 0.85 6.00 0.064 62. BD ( 1)Co 1- S 6 176. RY (53)Co 1 5.97 110.35 0.724 62. BD ( 1)Co 1- S 6 177. RY (54)Co 1 0.59 23.85 0.106 62. BD ( 1)Co 1- S 6 178. RY (55)Co 1 4.39 119.40 0.646 62. BD ( 1)Co 1- S 6 179. RY (56)Co 1 4.26 51.69 0.419 62. BD ( 1)Co 1- S 6 180. RY (57)Co 1 4.12 121.62 0.632 62. BD ( 1)Co 1- S 6 181. RY (58)Co 1 6.69 246.99 1.147 62. BD ( 1)Co 1- S 6 182. RY (59)Co 1 5.16 60.67 0.500 62. BD ( 1)Co 1- S 6 183. RY (60)Co 1 7.96 111.74 0.842 62. BD ( 1)Co 1- S 6 184. RY (61)Co 1 1.58 25.61 0.179 62. BD ( 1)Co 1- S 6 185. RY (62)Co 1 2.33 24.01 0.211 62. BD ( 1)Co 1- S 6 186. RY (63)Co 1 5.10 153.26 0.789 62. BD ( 1)Co 1- S 6 187. RY (64)Co 1 1.38 20.80 0.151 62. BD ( 1)Co 1- S 6 189. RY (66)Co 1 1.37 12.83 0.119 62. BD ( 1)Co 1- S 6 195. RY (72)Co 1 0.65 11.02 0.076 62. BD ( 1)Co 1- S 6 199. RY (76)Co 1 4.86 14.07 0.233 62. BD ( 1)Co 1- S 6 201. RY (78)Co 1 1.47 9.39 0.105 62. BD ( 1)Co 1- S 6 202. RY (79)Co 1 2.04 8.14 0.115 62. BD ( 1)Co 1- S 6 203. RY (80)Co 1 3.01 8.66 0.144 62. BD ( 1)Co 1- S 6 204. RY (81)Co 1 6.50 11.34 0.242 62. BD ( 1)Co 1- S 6 205. RY (82)Co 1 0.64 10.68 0.074 62. BD ( 1)Co 1- S 6 207. RY (84)Co 1 0.72 12.37 0.084 62. BD ( 1)Co 1- S 6 209. RY ( 1) S 2 1.62 1.43 0.043 62. BD ( 1)Co 1- S 6 212. RY ( 4) S 2 1.22 1.96 0.044 62. BD ( 1)Co 1- S 6 214. RY ( 6) S 2 6.85 2.83 0.124 62. BD ( 1)Co 1- S 6 216. RY ( 8) S 2 0.56 2.11 0.031 62. BD ( 1)Co 1- S 6 218. RY (10) S 2 1.04 1.64 0.037 62. BD ( 1)Co 1- S 6 229. RY (21) S 2 0.65 2.25 0.034 62. BD ( 1)Co 1- S 6 230. RY (22) S 2 0.65 2.94 0.039 62. BD ( 1)Co 1- S 6 393. RY ( 2) S 5 0.65 0.98 0.023 62. BD ( 1)Co 1- S 6 394. RY ( 3) S 5 1.24 0.89 0.030 62. BD ( 1)Co 1- S 6 453. RY ( 1) S 6 1.12 1.44 0.036 62. BD ( 1)Co 1- S 6 456. RY ( 4) S 6 1.20 1.90 0.043 62. BD ( 1)Co 1- S 6 457. RY ( 5) S 6 0.59 2.63 0.035 62. BD ( 1)Co 1- S 6 458. RY ( 6) S 6 3.67 2.72 0.089 62. BD ( 1)Co 1- S 6 478. RY (26) S 6 0.53 3.20 0.037 62. BD ( 1)Co 1- S 6 519. RY ( 6) C 7 0.51 1.63 0.026 62. BD ( 1)Co 1- S 6 567. RY ( 2) C 8 0.51 3.24 0.036 62. BD ( 1)Co 1- S 6 570. RY ( 5) C 8 0.70 1.63 0.030 62. BD ( 1)Co 1- S 6 670. RY ( 1) P 10 4.59 1.95 0.084 62. BD ( 1)Co 1- S 6 673. RY ( 4) P 10 0.64 1.64 0.029 62. BD ( 1)Co 1- S 6 674. RY ( 5) P 10 2.83 1.85 0.065 62. BD ( 1)Co 1- S 6 675. RY ( 6) P 10 1.22 1.77 0.041 62. BD ( 1)Co 1- S 6 677. RY ( 8) P 10 3.73 1.78 0.073 62. BD ( 1)Co 1- S 6 678. RY ( 9) P 10 0.58 2.32 0.033 62. BD ( 1)Co 1- S 6 687. RY (18) P 10 0.74 2.93 0.042 63. BD ( 1)Co 1- P 10 93. BD*( 1)Co 1- S 2 41.16 0.43 0.119 63. BD ( 1)Co 1- P 10 94. BD*( 1)Co 1- S 6 41.20 0.43 0.119 63. BD ( 1)Co 1- P 10 95. BD*( 1)Co 1- P 10 20.38 0.44 0.085 63. BD ( 1)Co 1- P 10 96. BD*( 1) S 2- S 3 2.00 0.42 0.026 63. BD ( 1)Co 1- P 10 99. BD*( 1) S 5- S 6 1.96 0.42 0.026 63. BD ( 1)Co 1- P 10 100. BD*( 1) C 7- P 10 1.93 0.50 0.028 63. BD ( 1)Co 1- P 10 101. BD*( 1) C 7- H 16 2.15 0.65 0.033 63. BD ( 1)Co 1- P 10 104. BD*( 1) C 8- P 10 1.71 0.51 0.026 63. BD ( 1)Co 1- P 10 105. BD*( 1) C 8- H 19 1.46 0.66 0.028 63. BD ( 1)Co 1- P 10 108. BD*( 1) C 9- P 10 1.93 0.50 0.028 63. BD ( 1)Co 1- P 10 109. BD*( 1) C 9- H 22 2.11 0.65 0.033 63. BD ( 1)Co 1- P 10 124. RY ( 1)Co 1 5.76 1.84 0.092 63. BD ( 1)Co 1- P 10 127. RY ( 4)Co 1 3.83 2.32 0.084 63. BD ( 1)Co 1- P 10 128. RY ( 5)Co 1 1.54 1.67 0.045 63. BD ( 1)Co 1- P 10 129. RY ( 6)Co 1 3.49 2.84 0.089 63. BD ( 1)Co 1- P 10 132. RY ( 9)Co 1 0.53 2.52 0.033 63. BD ( 1)Co 1- P 10 135. RY (12)Co 1 3.18 2.86 0.085 63. BD ( 1)Co 1- P 10 136. RY (13)Co 1 1.43 2.20 0.050 63. BD ( 1)Co 1- P 10 138. RY (15)Co 1 10.47 4.26 0.189 63. BD ( 1)Co 1- P 10 139. RY (16)Co 1 3.81 2.70 0.091 63. BD ( 1)Co 1- P 10 140. RY (17)Co 1 2.12 3.02 0.071 63. BD ( 1)Co 1- P 10 142. RY (19)Co 1 0.61 3.12 0.039 63. BD ( 1)Co 1- P 10 145. RY (22)Co 1 1.87 3.00 0.067 63. BD ( 1)Co 1- P 10 146. RY (23)Co 1 0.76 3.00 0.043 63. BD ( 1)Co 1- P 10 147. RY (24)Co 1 2.61 3.96 0.091 63. BD ( 1)Co 1- P 10 148. RY (25)Co 1 5.33 5.63 0.155 63. BD ( 1)Co 1- P 10 149. RY (26)Co 1 1.22 3.41 0.058 63. BD ( 1)Co 1- P 10 150. RY (27)Co 1 1.76 3.92 0.074 63. BD ( 1)Co 1- P 10 151. RY (28)Co 1 1.20 3.50 0.058 63. BD ( 1)Co 1- P 10 153. RY (30)Co 1 1.18 4.09 0.062 63. BD ( 1)Co 1- P 10 155. RY (32)Co 1 0.71 3.69 0.046 63. BD ( 1)Co 1- P 10 156. RY (33)Co 1 4.73 5.32 0.142 63. BD ( 1)Co 1- P 10 158. RY (35)Co 1 1.92 7.41 0.107 63. BD ( 1)Co 1- P 10 160. RY (37)Co 1 2.22 5.58 0.099 63. BD ( 1)Co 1- P 10 161. RY (38)Co 1 1.41 6.52 0.085 63. BD ( 1)Co 1- P 10 163. RY (40)Co 1 1.24 5.19 0.072 63. BD ( 1)Co 1- P 10 164. RY (41)Co 1 1.34 8.03 0.093 63. BD ( 1)Co 1- P 10 166. RY (43)Co 1 2.30 10.48 0.139 63. BD ( 1)Co 1- P 10 168. RY (45)Co 1 0.82 11.33 0.086 63. BD ( 1)Co 1- P 10 172. RY (49)Co 1 1.08 7.61 0.081 63. BD ( 1)Co 1- P 10 173. RY (50)Co 1 4.15 6.55 0.147 63. BD ( 1)Co 1- P 10 174. RY (51)Co 1 0.91 6.02 0.066 63. BD ( 1)Co 1- P 10 175. RY (52)Co 1 0.66 7.27 0.062 63. BD ( 1)Co 1- P 10 176. RY (53)Co 1 7.29 110.37 0.801 63. BD ( 1)Co 1- P 10 177. RY (54)Co 1 0.71 23.87 0.116 63. BD ( 1)Co 1- P 10 178. RY (55)Co 1 5.24 119.42 0.706 63. BD ( 1)Co 1- P 10 179. RY (56)Co 1 5.08 51.70 0.457 63. BD ( 1)Co 1- P 10 180. RY (57)Co 1 4.89 121.64 0.688 63. BD ( 1)Co 1- P 10 181. RY (58)Co 1 8.01 247.01 1.256 63. BD ( 1)Co 1- P 10 182. RY (59)Co 1 6.19 60.69 0.547 63. BD ( 1)Co 1- P 10 183. RY (60)Co 1 9.58 111.76 0.924 63. BD ( 1)Co 1- P 10 184. RY (61)Co 1 1.87 25.62 0.195 63. BD ( 1)Co 1- P 10 185. RY (62)Co 1 2.89 24.02 0.235 63. BD ( 1)Co 1- P 10 186. RY (63)Co 1 6.05 153.27 0.860 63. BD ( 1)Co 1- P 10 187. RY (64)Co 1 1.63 20.82 0.164 63. BD ( 1)Co 1- P 10 189. RY (66)Co 1 1.64 12.85 0.130 63. BD ( 1)Co 1- P 10 194. RY (71)Co 1 0.64 10.35 0.073 63. BD ( 1)Co 1- P 10 195. RY (72)Co 1 0.68 11.04 0.077 63. BD ( 1)Co 1- P 10 197. RY (74)Co 1 0.66 8.74 0.068 63. BD ( 1)Co 1- P 10 199. RY (76)Co 1 5.80 14.09 0.255 63. BD ( 1)Co 1- P 10 200. RY (77)Co 1 0.62 9.75 0.069 63. BD ( 1)Co 1- P 10 201. RY (78)Co 1 1.62 9.41 0.110 63. BD ( 1)Co 1- P 10 202. RY (79)Co 1 1.88 8.16 0.111 63. BD ( 1)Co 1- P 10 203. RY (80)Co 1 3.92 8.68 0.165 63. BD ( 1)Co 1- P 10 204. RY (81)Co 1 7.74 11.36 0.265 63. BD ( 1)Co 1- P 10 205. RY (82)Co 1 0.82 10.70 0.084 63. BD ( 1)Co 1- P 10 206. RY (83)Co 1 0.55 9.13 0.063 63. BD ( 1)Co 1- P 10 207. RY (84)Co 1 0.85 12.39 0.091 63. BD ( 1)Co 1- P 10 209. RY ( 1) S 2 2.95 1.45 0.058 63. BD ( 1)Co 1- P 10 212. RY ( 4) S 2 1.89 1.98 0.055 63. BD ( 1)Co 1- P 10 214. RY ( 6) S 2 8.22 2.85 0.137 63. BD ( 1)Co 1- P 10 215. RY ( 7) S 2 0.51 2.66 0.033 63. BD ( 1)Co 1- P 10 218. RY (10) S 2 1.34 1.66 0.042 63. BD ( 1)Co 1- P 10 220. RY (12) S 2 0.53 2.78 0.034 63. BD ( 1)Co 1- P 10 226. RY (18) S 2 0.64 3.88 0.044 63. BD ( 1)Co 1- P 10 229. RY (21) S 2 0.60 2.27 0.033 63. BD ( 1)Co 1- P 10 230. RY (22) S 2 0.75 2.96 0.042 63. BD ( 1)Co 1- P 10 453. RY ( 1) S 6 3.39 1.46 0.063 63. BD ( 1)Co 1- P 10 456. RY ( 4) S 6 1.52 1.92 0.048 63. BD ( 1)Co 1- P 10 457. RY ( 5) S 6 1.00 2.65 0.046 63. BD ( 1)Co 1- P 10 458. RY ( 6) S 6 8.16 2.74 0.134 63. BD ( 1)Co 1- P 10 460. RY ( 8) S 6 0.74 2.20 0.036 63. BD ( 1)Co 1- P 10 463. RY (11) S 6 0.55 2.47 0.033 63. BD ( 1)Co 1- P 10 464. RY (12) S 6 0.75 2.60 0.039 63. BD ( 1)Co 1- P 10 472. RY (20) S 6 0.57 2.31 0.032 63. BD ( 1)Co 1- P 10 476. RY (24) S 6 0.67 2.98 0.040 63. BD ( 1)Co 1- P 10 514. RY ( 1) C 7 2.54 2.09 0.065 63. BD ( 1)Co 1- P 10 566. RY ( 1) C 8 3.40 2.16 0.076 63. BD ( 1)Co 1- P 10 570. RY ( 5) C 8 1.17 1.65 0.039 63. BD ( 1)Co 1- P 10 618. RY ( 1) C 9 2.33 2.09 0.062 63. BD ( 1)Co 1- P 10 670. RY ( 1) P 10 2.76 1.96 0.066 63. BD ( 1)Co 1- P 10 674. RY ( 5) P 10 1.15 1.87 0.041 63. BD ( 1)Co 1- P 10 675. RY ( 6) P 10 0.75 1.79 0.033 63. BD ( 1)Co 1- P 10 677. RY ( 8) P 10 4.33 1.80 0.079 63. BD ( 1)Co 1- P 10 1110. RY ( 4) H 20 0.59 2.03 0.031 64. BD ( 1) S 2- S 3 124. RY ( 1)Co 1 3.83 2.02 0.078 64. BD ( 1) S 2- S 3 125. RY ( 2)Co 1 3.06 2.02 0.070 64. BD ( 1) S 2- S 3 130. RY ( 7)Co 1 0.91 2.10 0.039 64. BD ( 1) S 2- S 3 132. RY ( 9)Co 1 0.72 2.70 0.039 64. BD ( 1) S 2- S 3 215. RY ( 7) S 2 0.67 2.84 0.039 64. BD ( 1) S 2- S 3 274. RY ( 5) S 3 0.59 2.16 0.032 64. BD ( 1) S 2- S 3 333. RY ( 3) S 4 0.89 1.38 0.031 65. BD ( 1) S 3- S 4 96. BD*( 1) S 2- S 3 0.55 0.59 0.016 65. BD ( 1) S 3- S 4 98. BD*( 1) S 4- S 5 0.59 0.55 0.016 65. BD ( 1) S 3- S 4 210. RY ( 2) S 2 0.96 1.58 0.035 65. BD ( 1) S 3- S 4 211. RY ( 3) S 2 1.25 1.84 0.043 65. BD ( 1) S 3- S 4 395. RY ( 4) S 5 1.07 1.32 0.034 66. BD ( 1) S 4- S 5 97. BD*( 1) S 3- S 4 0.59 0.55 0.016 66. BD ( 1) S 4- S 5 99. BD*( 1) S 5- S 6 0.58 0.59 0.017 66. BD ( 1) S 4- S 5 273. RY ( 4) S 3 1.14 1.34 0.035 66. BD ( 1) S 4- S 5 454. RY ( 2) S 6 1.30 1.67 0.042 66. BD ( 1) S 4- S 5 455. RY ( 3) S 6 0.89 1.73 0.035 66. BD ( 1) S 4- S 5 460. RY ( 8) S 6 0.57 2.37 0.033 67. BD ( 1) S 5- S 6 124. RY ( 1)Co 1 3.73 2.02 0.077 67. BD ( 1) S 5- S 6 125. RY ( 2)Co 1 3.15 2.02 0.071 67. BD ( 1) S 5- S 6 130. RY ( 7)Co 1 0.83 2.10 0.037 67. BD ( 1) S 5- S 6 132. RY ( 9)Co 1 0.78 2.70 0.041 67. BD ( 1) S 5- S 6 333. RY ( 3) S 4 0.89 1.38 0.031 67. BD ( 1) S 5- S 6 396. RY ( 5) S 5 0.51 2.14 0.029 67. BD ( 1) S 5- S 6 459. RY ( 7) S 6 0.68 2.74 0.038 68. BD ( 1) C 7- P 10 95. BD*( 1)Co 1- P 10 0.77 0.63 0.020 68. BD ( 1) C 7- P 10 104. BD*( 1) C 8- P 10 1.24 0.69 0.026 68. BD ( 1) C 7- P 10 107. BD*( 1) C 8- H 21 1.00 0.86 0.026 68. BD ( 1) C 7- P 10 108. BD*( 1) C 9- P 10 1.35 0.69 0.027 68. BD ( 1) C 7- P 10 110. BD*( 1) C 9- H 23 0.97 0.84 0.026 68. BD ( 1) C 7- P 10 566. RY ( 1) C 8 1.17 2.35 0.047 68. BD ( 1) C 7- P 10 567. RY ( 2) C 8 0.87 3.44 0.049 68. BD ( 1) C 7- P 10 618. RY ( 1) C 9 0.91 2.27 0.040 68. BD ( 1) C 7- P 10 619. RY ( 2) C 9 0.65 3.51 0.043 68. BD ( 1) C 7- P 10 620. RY ( 3) C 9 1.06 1.90 0.040 68. BD ( 1) C 7- P 10 993. RY ( 3) H 16 0.72 3.36 0.044 69. BD ( 1) C 7- H 16 95. BD*( 1)Co 1- P 10 0.92 0.61 0.021 69. BD ( 1) C 7- H 16 673. RY ( 4) P 10 0.51 1.83 0.027 69. BD ( 1) C 7- H 16 1020. RY ( 1) H 17 0.90 3.37 0.049 69. BD ( 1) C 7- H 16 1049. RY ( 1) H 18 0.93 3.21 0.049 70. BD ( 1) C 7- H 17 104. BD*( 1) C 8- P 10 2.04 0.67 0.033 70. BD ( 1) C 7- H 17 672. RY ( 3) P 10 0.51 1.74 0.027 70. BD ( 1) C 7- H 17 992. RY ( 2) H 16 0.78 3.19 0.045 70. BD ( 1) C 7- H 17 1050. RY ( 2) H 18 0.55 2.89 0.036 71. BD ( 1) C 7- H 18 108. BD*( 1) C 9- P 10 2.45 0.66 0.036 71. BD ( 1) C 7- H 18 673. RY ( 4) P 10 0.90 1.82 0.036 71. BD ( 1) C 7- H 18 992. RY ( 2) H 16 0.68 3.19 0.041 72. BD ( 1) C 8- P 10 95. BD*( 1)Co 1- P 10 0.62 0.62 0.017 72. BD ( 1) C 8- P 10 100. BD*( 1) C 7- P 10 1.24 0.68 0.026 72. BD ( 1) C 8- P 10 102. BD*( 1) C 7- H 17 1.18 0.83 0.028 72. BD ( 1) C 8- P 10 108. BD*( 1) C 9- P 10 1.18 0.68 0.025 72. BD ( 1) C 8- P 10 111. BD*( 1) C 9- H 24 1.22 0.83 0.028 72. BD ( 1) C 8- P 10 132. RY ( 9)Co 1 1.25 2.70 0.052 72. BD ( 1) C 8- P 10 514. RY ( 1) C 7 1.20 2.26 0.046 72. BD ( 1) C 8- P 10 515. RY ( 2) C 7 0.90 3.67 0.051 72. BD ( 1) C 8- P 10 618. RY ( 1) C 9 1.29 2.26 0.048 72. BD ( 1) C 8- P 10 619. RY ( 2) C 9 1.15 3.50 0.057 72. BD ( 1) C 8- P 10 687. RY (18) P 10 0.67 3.12 0.041 72. BD ( 1) C 8- P 10 1080. RY ( 3) H 19 0.63 3.73 0.043 73. BD ( 1) C 8- H 19 95. BD*( 1)Co 1- P 10 1.09 0.60 0.023 73. BD ( 1) C 8- H 19 100. BD*( 1) C 7- P 10 0.52 0.66 0.017 73. BD ( 1) C 8- H 19 670. RY ( 1) P 10 0.77 2.12 0.036 73. BD ( 1) C 8- H 19 1107. RY ( 1) H 20 0.96 3.07 0.049 73. BD ( 1) C 8- H 19 1136. RY ( 1) H 21 0.94 3.13 0.048 74. BD ( 1) C 8- H 20 108. BD*( 1) C 9- P 10 2.08 0.65 0.033 74. BD ( 1) C 8- H 20 670. RY ( 1) P 10 0.52 2.11 0.029 74. BD ( 1) C 8- H 20 672. RY ( 3) P 10 0.56 1.72 0.028 74. BD ( 1) C 8- H 20 1079. RY ( 2) H 19 0.72 3.31 0.044 74. BD ( 1) C 8- H 20 1136. RY ( 1) H 21 0.57 3.12 0.038 75. BD ( 1) C 8- H 21 100. BD*( 1) C 7- P 10 2.01 0.65 0.032 75. BD ( 1) C 8- H 21 672. RY ( 3) P 10 0.74 1.73 0.032 75. BD ( 1) C 8- H 21 1079. RY ( 2) H 19 0.73 3.31 0.044 75. BD ( 1) C 8- H 21 1108. RY ( 2) H 20 0.77 3.05 0.043 76. BD ( 1) C 9- P 10 95. BD*( 1)Co 1- P 10 0.79 0.63 0.020 76. BD ( 1) C 9- P 10 100. BD*( 1) C 7- P 10 1.32 0.69 0.027 76. BD ( 1) C 9- P 10 103. BD*( 1) C 7- H 18 0.98 0.85 0.026 76. BD ( 1) C 9- P 10 104. BD*( 1) C 8- P 10 1.27 0.69 0.027 76. BD ( 1) C 9- P 10 106. BD*( 1) C 8- H 20 1.02 0.87 0.027 76. BD ( 1) C 9- P 10 130. RY ( 7)Co 1 0.79 2.11 0.036 76. BD ( 1) C 9- P 10 514. RY ( 1) C 7 0.96 2.27 0.042 76. BD ( 1) C 9- P 10 515. RY ( 2) C 7 0.93 3.68 0.052 76. BD ( 1) C 9- P 10 516. RY ( 3) C 7 0.71 1.80 0.032 76. BD ( 1) C 9- P 10 566. RY ( 1) C 8 1.29 2.35 0.049 76. BD ( 1) C 9- P 10 567. RY ( 2) C 8 0.66 3.44 0.042 76. BD ( 1) C 9- P 10 568. RY ( 3) C 8 0.71 1.69 0.031 76. BD ( 1) C 9- P 10 1167. RY ( 3) H 22 0.69 3.37 0.043 76. BD ( 1) C 9- P 10 1224. RY ( 2) H 24 0.55 3.59 0.040 77. BD ( 1) C 9- H 22 95. BD*( 1)Co 1- P 10 0.93 0.61 0.021 77. BD ( 1) C 9- H 22 672. RY ( 3) P 10 0.59 1.75 0.029 77. BD ( 1) C 9- H 22 1194. RY ( 1) H 23 0.83 3.11 0.045 77. BD ( 1) C 9- H 22 1223. RY ( 1) H 24 0.84 3.36 0.047 78. BD ( 1) C 9- H 23 100. BD*( 1) C 7- P 10 2.57 0.67 0.037 78. BD ( 1) C 9- H 23 673. RY ( 4) P 10 1.05 1.82 0.039 78. BD ( 1) C 9- H 23 1166. RY ( 2) H 22 0.69 3.17 0.042 78. BD ( 1) C 9- H 23 1223. RY ( 1) H 24 0.52 3.35 0.037 79. BD ( 1) C 9- H 24 104. BD*( 1) C 8- P 10 1.89 0.68 0.032 79. BD ( 1) C 9- H 24 1166. RY ( 2) H 22 0.75 3.17 0.044 79. BD ( 1) C 9- H 24 1195. RY ( 2) H 23 0.72 3.03 0.042 from unit 1 to unit 2 48. LP ( 1)Co 1 114. BD*( 1) C 11- H 25 0.56 0.65 0.017 48. LP ( 1)Co 1 116. BD*( 2) C 12- C 13 0.43 0.23 0.009 48. LP ( 1)Co 1 117. BD*( 1) C 12- H 26 0.68 0.64 0.019 48. LP ( 1)Co 1 119. BD*( 1) C 13- H 27 0.82 0.62 0.020 48. LP ( 1)Co 1 121. BD*( 1) C 14- H 29 0.72 0.64 0.019 48. LP ( 1)Co 1 122. BD*( 1) C 15- H 28 0.56 0.65 0.017 48. LP ( 1)Co 1 123. 3C*( 1)C11-C14-C15 0.13 0.30 0.006 48. LP ( 1)Co 1 734. RY ( 4) C 11 0.11 1.73 0.012 48. LP ( 1)Co 1 783. RY ( 1) C 12 0.19 1.69 0.016 48. LP ( 1)Co 1 784. RY ( 2) C 12 0.09 2.08 0.012 48. LP ( 1)Co 1 786. RY ( 4) C 12 0.11 1.80 0.013 48. LP ( 1)Co 1 835. RY ( 1) C 13 0.19 1.51 0.015 48. LP ( 1)Co 1 836. RY ( 2) C 13 0.10 2.04 0.013 48. LP ( 1)Co 1 887. RY ( 1) C 14 0.18 1.66 0.015 48. LP ( 1)Co 1 888. RY ( 2) C 14 0.12 1.96 0.013 48. LP ( 1)Co 1 890. RY ( 4) C 14 0.06 1.97 0.010 48. LP ( 1)Co 1 942. RY ( 4) C 15 0.08 1.78 0.011 48. LP ( 1)Co 1 1281. RY ( 1) H 26 0.09 2.92 0.015 48. LP ( 1)Co 1 1288. RY ( 8) H 26 0.05 5.09 0.014 48. LP ( 1)Co 1 1310. RY ( 1) H 27 0.08 2.50 0.013 48. LP ( 1)Co 1 1368. RY ( 1) H 29 0.12 2.64 0.016 48. LP ( 1)Co 1 1375. RY ( 8) H 29 0.06 5.03 0.016 49. LP ( 2)Co 1 114. BD*( 1) C 11- H 25 0.08 0.63 0.006 49. LP ( 2)Co 1 116. BD*( 2) C 12- C 13 11.28 0.21 0.044 49. LP ( 2)Co 1 118. BD*( 1) C 13- C 14 0.05 0.66 0.005 49. LP ( 2)Co 1 122. BD*( 1) C 15- H 28 0.09 0.63 0.007 49. LP ( 2)Co 1 123. 3C*( 1)C11-C14-C15 0.43 0.28 0.010 49. LP ( 2)Co 1 731. RY ( 1) C 11 0.11 1.68 0.012 49. LP ( 2)Co 1 733. RY ( 3) C 11 0.07 1.92 0.010 49. LP ( 2)Co 1 741. RY (11) C 11 0.06 2.46 0.011 49. LP ( 2)Co 1 783. RY ( 1) C 12 1.71 1.67 0.048 49. LP ( 2)Co 1 789. RY ( 7) C 12 0.07 3.45 0.014 49. LP ( 2)Co 1 816. RY (34) C 12 0.05 8.60 0.019 49. LP ( 2)Co 1 835. RY ( 1) C 13 1.28 1.49 0.039 49. LP ( 2)Co 1 836. RY ( 2) C 13 0.16 2.02 0.016 49. LP ( 2)Co 1 838. RY ( 4) C 13 0.06 2.15 0.010 49. LP ( 2)Co 1 842. RY ( 8) C 13 0.09 2.64 0.014 49. LP ( 2)Co 1 844. RY (10) C 13 0.06 3.57 0.013 49. LP ( 2)Co 1 848. RY (14) C 13 0.17 5.39 0.027 49. LP ( 2)Co 1 865. RY (31) C 13 0.06 6.51 0.017 49. LP ( 2)Co 1 887. RY ( 1) C 14 0.66 1.64 0.029 49. LP ( 2)Co 1 889. RY ( 3) C 14 0.06 2.01 0.010 49. LP ( 2)Co 1 894. RY ( 8) C 14 0.09 2.75 0.014 49. LP ( 2)Co 1 939. RY ( 1) C 15 0.66 1.61 0.029 49. LP ( 2)Co 1 940. RY ( 2) C 15 0.07 2.08 0.010 49. LP ( 2)Co 1 948. RY (10) C 15 0.07 3.06 0.013 49. LP ( 2)Co 1 1285. RY ( 5) H 26 0.05 2.71 0.010 49. LP ( 2)Co 1 1314. RY ( 5) H 27 0.05 3.80 0.013 50. LP ( 3)Co 1 116. BD*( 2) C 12- C 13 1.17 0.21 0.014 50. LP ( 3)Co 1 123. 3C*( 1)C11-C14-C15 10.20 0.28 0.048 50. LP ( 3)Co 1 731. RY ( 1) C 11 2.25 1.68 0.055 50. LP ( 3)Co 1 732. RY ( 2) C 11 0.07 2.08 0.011 50. LP ( 3)Co 1 740. RY (10) C 11 0.16 2.79 0.019 50. LP ( 3)Co 1 751. RY (21) C 11 0.07 4.95 0.017 50. LP ( 3)Co 1 783. RY ( 1) C 12 0.08 1.67 0.010 50. LP ( 3)Co 1 785. RY ( 3) C 12 0.06 1.90 0.010 50. LP ( 3)Co 1 790. RY ( 8) C 12 0.09 3.06 0.015 50. LP ( 3)Co 1 835. RY ( 1) C 13 0.12 1.49 0.012 50. LP ( 3)Co 1 887. RY ( 1) C 14 0.43 1.64 0.024 50. LP ( 3)Co 1 894. RY ( 8) C 14 0.06 2.75 0.011 50. LP ( 3)Co 1 939. RY ( 1) C 15 3.00 1.61 0.062 50. LP ( 3)Co 1 949. RY (11) C 15 0.13 2.75 0.017 50. LP ( 3)Co 1 954. RY (16) C 15 0.06 4.36 0.014 50. LP ( 3)Co 1 959. RY (21) C 15 0.07 4.05 0.015 50. LP ( 3)Co 1 971. RY (33) C 15 0.07 5.63 0.018 50. LP ( 3)Co 1 1339. RY ( 1) H 28 0.07 1.50 0.009 50. LP ( 3)Co 1 1372. RY ( 5) H 29 0.05 2.61 0.011 51. LP ( 1) S 2 116. BD*( 2) C 12- C 13 0.08 0.47 0.005 51. LP ( 1) S 2 731. RY ( 1) C 11 0.40 1.94 0.025 51. LP ( 1) S 2 732. RY ( 2) C 11 0.05 2.34 0.010 51. LP ( 1) S 2 741. RY (11) C 11 0.12 2.72 0.016 51. LP ( 1) S 2 754. RY (24) C 11 0.05 5.74 0.016 51. LP ( 1) S 2 761. RY (31) C 11 0.05 5.23 0.014 51. LP ( 1) S 2 783. RY ( 1) C 12 0.27 1.93 0.020 51. LP ( 1) S 2 786. RY ( 4) C 12 0.13 2.04 0.014 51. LP ( 1) S 2 792. RY (10) C 12 0.10 3.67 0.017 51. LP ( 1) S 2 814. RY (32) C 12 0.06 4.78 0.015 51. LP ( 1) S 2 863. RY (29) C 13 0.06 4.67 0.015 51. LP ( 1) S 2 887. RY ( 1) C 14 0.19 1.90 0.017 51. LP ( 1) S 2 890. RY ( 4) C 14 0.09 2.21 0.013 51. LP ( 1) S 2 939. RY ( 1) C 15 0.17 1.87 0.016 51. LP ( 1) S 2 940. RY ( 2) C 15 0.08 2.34 0.012 51. LP ( 1) S 2 942. RY ( 4) C 15 0.08 2.02 0.011 51. LP ( 1) S 2 949. RY (11) C 15 0.09 3.01 0.015 51. LP ( 1) S 2 966. RY (28) C 15 0.10 6.03 0.022 52. LP ( 2) S 2 113. BD*( 1) C 11- C 15 0.19 0.68 0.010 52. LP ( 2) S 2 118. BD*( 1) C 13- C 14 0.16 0.67 0.009 52. LP ( 2) S 2 123. 3C*( 1)C11-C14-C15 0.23 0.28 0.007 54. LP ( 2) S 3 120. BD*( 1) C 14- C 15 0.08 0.69 0.007 54. LP ( 2) S 3 122. BD*( 1) C 15- H 28 0.10 0.65 0.007 54. LP ( 2) S 3 123. 3C*( 1)C11-C14-C15 0.09 0.30 0.005 57. LP ( 1) S 5 114. BD*( 1) C 11- H 25 0.07 0.91 0.007 58. LP ( 2) S 5 114. BD*( 1) C 11- H 25 0.22 0.65 0.011 58. LP ( 2) S 5 123. 3C*( 1)C11-C14-C15 0.06 0.30 0.004 59. LP ( 1) S 6 116. BD*( 2) C 12- C 13 0.08 0.47 0.005 59. LP ( 1) S 6 731. RY ( 1) C 11 0.29 1.94 0.021 59. LP ( 1) S 6 732. RY ( 2) C 11 0.07 2.34 0.012 59. LP ( 1) S 6 733. RY ( 3) C 11 0.06 2.18 0.010 59. LP ( 1) S 6 734. RY ( 4) C 11 0.05 1.97 0.009 59. LP ( 1) S 6 741. RY (11) C 11 0.11 2.72 0.015 59. LP ( 1) S 6 761. RY (31) C 11 0.06 5.23 0.016 59. LP ( 1) S 6 783. RY ( 1) C 12 0.16 1.93 0.015 59. LP ( 1) S 6 786. RY ( 4) C 12 0.10 2.04 0.013 59. LP ( 1) S 6 792. RY (10) C 12 0.06 3.67 0.013 59. LP ( 1) S 6 814. RY (32) C 12 0.07 4.78 0.016 59. LP ( 1) S 6 863. RY (29) C 13 0.05 4.67 0.014 59. LP ( 1) S 6 887. RY ( 1) C 14 0.27 1.90 0.020 59. LP ( 1) S 6 890. RY ( 4) C 14 0.13 2.21 0.015 59. LP ( 1) S 6 896. RY (10) C 14 0.07 3.74 0.015 59. LP ( 1) S 6 939. RY ( 1) C 15 0.30 1.87 0.021 59. LP ( 1) S 6 940. RY ( 2) C 15 0.06 2.34 0.010 59. LP ( 1) S 6 942. RY ( 4) C 15 0.07 2.02 0.010 59. LP ( 1) S 6 949. RY (11) C 15 0.10 3.01 0.015 59. LP ( 1) S 6 966. RY (28) C 15 0.12 6.03 0.024 60. LP ( 2) S 6 113. BD*( 1) C 11- C 15 0.13 0.68 0.008 60. LP ( 2) S 6 115. BD*( 1) C 12- C 13 0.23 0.67 0.011 60. LP ( 2) S 6 116. BD*( 2) C 12- C 13 0.66 0.22 0.011 60. LP ( 2) S 6 123. 3C*( 1)C11-C14-C15 0.15 0.28 0.006 61. BD ( 1)Co 1- S 2 116. BD*( 2) C 12- C 13 0.09 0.29 0.005 61. BD ( 1)Co 1- S 2 117. BD*( 1) C 12- H 26 0.11 0.70 0.008 61. BD ( 1)Co 1- S 2 119. BD*( 1) C 13- H 27 0.06 0.68 0.006 61. BD ( 1)Co 1- S 2 122. BD*( 1) C 15- H 28 0.17 0.71 0.010 61. BD ( 1)Co 1- S 2 731. RY ( 1) C 11 4.63 1.76 0.081 61. BD ( 1)Co 1- S 2 732. RY ( 2) C 11 0.67 2.16 0.034 61. BD ( 1)Co 1- S 2 733. RY ( 3) C 11 0.37 2.00 0.024 61. BD ( 1)Co 1- S 2 734. RY ( 4) C 11 0.52 1.79 0.027 61. BD ( 1)Co 1- S 2 735. RY ( 5) C 11 0.07 3.16 0.014 61. BD ( 1)Co 1- S 2 736. RY ( 6) C 11 0.05 2.86 0.011 61. BD ( 1)Co 1- S 2 741. RY (11) C 11 0.97 2.54 0.044 61. BD ( 1)Co 1- S 2 746. RY (16) C 11 0.07 3.27 0.013 61. BD ( 1)Co 1- S 2 747. RY (17) C 11 0.06 4.69 0.015 61. BD ( 1)Co 1- S 2 751. RY (21) C 11 0.11 5.03 0.021 61. BD ( 1)Co 1- S 2 754. RY (24) C 11 0.29 5.56 0.036 61. BD ( 1)Co 1- S 2 756. RY (26) C 11 0.12 5.47 0.023 61. BD ( 1)Co 1- S 2 757. RY (27) C 11 0.07 5.46 0.018 61. BD ( 1)Co 1- S 2 758. RY (28) C 11 0.08 6.03 0.019 61. BD ( 1)Co 1- S 2 760. RY (30) C 11 0.09 4.79 0.019 61. BD ( 1)Co 1- S 2 761. RY (31) C 11 0.20 5.05 0.029 61. BD ( 1)Co 1- S 2 786. RY ( 4) C 12 0.26 1.86 0.020 61. BD ( 1)Co 1- S 2 789. RY ( 7) C 12 0.06 3.53 0.013 61. BD ( 1)Co 1- S 2 792. RY (10) C 12 0.58 3.50 0.040 61. BD ( 1)Co 1- S 2 793. RY (11) C 12 0.22 2.03 0.019 61. BD ( 1)Co 1- S 2 795. RY (13) C 12 0.14 3.27 0.019 61. BD ( 1)Co 1- S 2 798. RY (16) C 12 0.22 4.40 0.028 61. BD ( 1)Co 1- S 2 802. RY (20) C 12 0.09 3.94 0.017 61. BD ( 1)Co 1- S 2 805. RY (23) C 12 0.06 7.14 0.018 61. BD ( 1)Co 1- S 2 807. RY (25) C 12 0.08 7.21 0.021 61. BD ( 1)Co 1- S 2 808. RY (26) C 12 0.18 6.63 0.031 61. BD ( 1)Co 1- S 2 813. RY (31) C 12 0.08 5.05 0.018 61. BD ( 1)Co 1- S 2 814. RY (32) C 12 0.38 4.61 0.037 61. BD ( 1)Co 1- S 2 815. RY (33) C 12 0.06 5.21 0.016 61. BD ( 1)Co 1- S 2 816. RY (34) C 12 0.11 8.68 0.027 61. BD ( 1)Co 1- S 2 834. RY (52) C 12 0.07 7.73 0.021 61. BD ( 1)Co 1- S 2 835. RY ( 1) C 13 0.09 1.58 0.011 61. BD ( 1)Co 1- S 2 841. RY ( 7) C 13 0.06 3.87 0.013 61. BD ( 1)Co 1- S 2 842. RY ( 8) C 13 0.06 2.72 0.011 61. BD ( 1)Co 1- S 2 844. RY (10) C 13 0.25 3.65 0.027 61. BD ( 1)Co 1- S 2 846. RY (12) C 13 0.23 3.65 0.026 61. BD ( 1)Co 1- S 2 847. RY (13) C 13 0.10 3.53 0.017 61. BD ( 1)Co 1- S 2 848. RY (14) C 13 0.17 5.47 0.028 61. BD ( 1)Co 1- S 2 854. RY (20) C 13 0.13 4.84 0.022 61. BD ( 1)Co 1- S 2 859. RY (25) C 13 0.06 6.18 0.018 61. BD ( 1)Co 1- S 2 860. RY (26) C 13 0.08 4.85 0.018 61. BD ( 1)Co 1- S 2 863. RY (29) C 13 0.31 4.49 0.033 61. BD ( 1)Co 1- S 2 864. RY (30) C 13 0.18 4.75 0.026 61. BD ( 1)Co 1- S 2 865. RY (31) C 13 0.10 6.59 0.022 61. BD ( 1)Co 1- S 2 867. RY (33) C 13 0.21 4.71 0.028 61. BD ( 1)Co 1- S 2 887. RY ( 1) C 14 3.83 1.72 0.073 61. BD ( 1)Co 1- S 2 890. RY ( 4) C 14 0.75 2.04 0.035 61. BD ( 1)Co 1- S 2 893. RY ( 7) C 14 0.07 3.67 0.014 61. BD ( 1)Co 1- S 2 894. RY ( 8) C 14 0.06 2.83 0.012 61. BD ( 1)Co 1- S 2 896. RY (10) C 14 0.23 3.56 0.026 61. BD ( 1)Co 1- S 2 899. RY (13) C 14 0.24 3.21 0.025 61. BD ( 1)Co 1- S 2 902. RY (16) C 14 0.27 4.51 0.031 61. BD ( 1)Co 1- S 2 909. RY (23) C 14 0.09 7.00 0.022 61. BD ( 1)Co 1- S 2 912. RY (26) C 14 0.09 5.58 0.020 61. BD ( 1)Co 1- S 2 914. RY (28) C 14 0.12 5.85 0.023 61. BD ( 1)Co 1- S 2 917. RY (31) C 14 0.09 3.65 0.016 61. BD ( 1)Co 1- S 2 918. RY (32) C 14 0.12 5.88 0.024 61. BD ( 1)Co 1- S 2 919. RY (33) C 14 0.07 6.11 0.018 61. BD ( 1)Co 1- S 2 920. RY (34) C 14 0.22 5.34 0.031 61. BD ( 1)Co 1- S 2 938. RY (52) C 14 0.08 5.69 0.019 61. BD ( 1)Co 1- S 2 939. RY ( 1) C 15 3.72 1.69 0.071 61. BD ( 1)Co 1- S 2 940. RY ( 2) C 15 1.12 2.16 0.044 61. BD ( 1)Co 1- S 2 941. RY ( 3) C 15 0.19 1.88 0.017 61. BD ( 1)Co 1- S 2 942. RY ( 4) C 15 0.59 1.85 0.030 61. BD ( 1)Co 1- S 2 943. RY ( 5) C 15 0.08 2.91 0.014 61. BD ( 1)Co 1- S 2 947. RY ( 9) C 15 0.10 2.22 0.014 61. BD ( 1)Co 1- S 2 949. RY (11) C 15 0.61 2.84 0.037 61. BD ( 1)Co 1- S 2 950. RY (12) C 15 0.15 3.87 0.021 61. BD ( 1)Co 1- S 2 951. RY (13) C 15 0.09 3.97 0.017 61. BD ( 1)Co 1- S 2 953. RY (15) C 15 0.08 4.72 0.018 61. BD ( 1)Co 1- S 2 954. RY (16) C 15 0.08 4.45 0.017 61. BD ( 1)Co 1- S 2 955. RY (17) C 15 0.25 4.09 0.028 61. BD ( 1)Co 1- S 2 960. RY (22) C 15 0.06 5.33 0.017 61. BD ( 1)Co 1- S 2 961. RY (23) C 15 0.06 6.94 0.018 61. BD ( 1)Co 1- S 2 962. RY (24) C 15 0.05 5.28 0.015 61. BD ( 1)Co 1- S 2 966. RY (28) C 15 0.68 5.85 0.056 61. BD ( 1)Co 1- S 2 967. RY (29) C 15 0.19 4.78 0.027 61. BD ( 1)Co 1- S 2 969. RY (31) C 15 0.06 4.79 0.015 61. BD ( 1)Co 1- S 2 970. RY (32) C 15 0.14 5.42 0.025 61. BD ( 1)Co 1- S 2 1252. RY ( 1) H 25 0.33 1.52 0.020 61. BD ( 1)Co 1- S 2 1255. RY ( 4) H 25 0.08 3.13 0.014 61. BD ( 1)Co 1- S 2 1259. RY ( 8) H 25 0.08 5.11 0.018 61. BD ( 1)Co 1- S 2 1283. RY ( 3) H 26 0.15 2.39 0.017 61. BD ( 1)Co 1- S 2 1288. RY ( 8) H 26 0.06 5.15 0.015 61. BD ( 1)Co 1- S 2 1339. RY ( 1) H 28 0.30 1.59 0.019 61. BD ( 1)Co 1- S 2 1346. RY ( 8) H 28 0.07 5.19 0.017 61. BD ( 1)Co 1- S 2 1369. RY ( 2) H 29 0.10 2.27 0.014 61. BD ( 1)Co 1- S 2 1375. RY ( 8) H 29 0.15 5.09 0.025 61. BD ( 1)Co 1- S 2 1383. RY (16) H 29 0.06 7.00 0.018 62. BD ( 1)Co 1- S 6 114. BD*( 1) C 11- H 25 0.15 0.71 0.009 62. BD ( 1)Co 1- S 6 117. BD*( 1) C 12- H 26 0.10 0.70 0.007 62. BD ( 1)Co 1- S 6 121. BD*( 1) C 14- H 29 0.14 0.70 0.009 62. BD ( 1)Co 1- S 6 123. 3C*( 1)C11-C14-C15 0.84 0.36 0.016 62. BD ( 1)Co 1- S 6 731. RY ( 1) C 11 4.98 1.76 0.084 62. BD ( 1)Co 1- S 6 732. RY ( 2) C 11 1.07 2.16 0.043 62. BD ( 1)Co 1- S 6 733. RY ( 3) C 11 0.54 2.00 0.029 62. BD ( 1)Co 1- S 6 734. RY ( 4) C 11 0.41 1.79 0.024 62. BD ( 1)Co 1- S 6 735. RY ( 5) C 11 0.06 3.16 0.013 62. BD ( 1)Co 1- S 6 736. RY ( 6) C 11 0.06 2.86 0.012 62. BD ( 1)Co 1- S 6 741. RY (11) C 11 0.84 2.54 0.041 62. BD ( 1)Co 1- S 6 742. RY (12) C 11 0.07 3.59 0.014 62. BD ( 1)Co 1- S 6 743. RY (13) C 11 0.06 3.97 0.013 62. BD ( 1)Co 1- S 6 744. RY (14) C 11 0.05 4.06 0.013 62. BD ( 1)Co 1- S 6 746. RY (16) C 11 0.09 3.27 0.015 62. BD ( 1)Co 1- S 6 747. RY (17) C 11 0.11 4.69 0.020 62. BD ( 1)Co 1- S 6 748. RY (18) C 11 0.07 4.18 0.015 62. BD ( 1)Co 1- S 6 751. RY (21) C 11 0.11 5.03 0.021 62. BD ( 1)Co 1- S 6 754. RY (24) C 11 0.31 5.56 0.037 62. BD ( 1)Co 1- S 6 756. RY (26) C 11 0.11 5.47 0.022 62. BD ( 1)Co 1- S 6 757. RY (27) C 11 0.07 5.46 0.018 62. BD ( 1)Co 1- S 6 758. RY (28) C 11 0.09 6.03 0.021 62. BD ( 1)Co 1- S 6 760. RY (30) C 11 0.15 4.79 0.024 62. BD ( 1)Co 1- S 6 761. RY (31) C 11 0.24 5.05 0.031 62. BD ( 1)Co 1- S 6 762. RY (32) C 11 0.05 5.26 0.015 62. BD ( 1)Co 1- S 6 782. RY (52) C 11 0.09 9.48 0.026 62. BD ( 1)Co 1- S 6 783. RY ( 1) C 12 3.54 1.75 0.070 62. BD ( 1)Co 1- S 6 784. RY ( 2) C 12 0.06 2.14 0.010 62. BD ( 1)Co 1- S 6 785. RY ( 3) C 12 0.16 1.98 0.016 62. BD ( 1)Co 1- S 6 786. RY ( 4) C 12 0.61 1.86 0.030 62. BD ( 1)Co 1- S 6 789. RY ( 7) C 12 0.14 3.53 0.020 62. BD ( 1)Co 1- S 6 792. RY (10) C 12 0.29 3.50 0.029 62. BD ( 1)Co 1- S 6 793. RY (11) C 12 0.21 2.03 0.018 62. BD ( 1)Co 1- S 6 795. RY (13) C 12 0.06 3.27 0.013 62. BD ( 1)Co 1- S 6 796. RY (14) C 12 0.09 5.56 0.020 62. BD ( 1)Co 1- S 6 797. RY (15) C 12 0.05 3.22 0.011 62. BD ( 1)Co 1- S 6 798. RY (16) C 12 0.49 4.40 0.041 62. BD ( 1)Co 1- S 6 802. RY (20) C 12 0.08 3.94 0.016 62. BD ( 1)Co 1- S 6 803. RY (21) C 12 0.12 6.42 0.025 62. BD ( 1)Co 1- S 6 805. RY (23) C 12 0.05 7.14 0.018 62. BD ( 1)Co 1- S 6 807. RY (25) C 12 0.06 7.21 0.019 62. BD ( 1)Co 1- S 6 808. RY (26) C 12 0.15 6.63 0.028 62. BD ( 1)Co 1- S 6 813. RY (31) C 12 0.09 5.05 0.019 62. BD ( 1)Co 1- S 6 814. RY (32) C 12 0.26 4.61 0.031 62. BD ( 1)Co 1- S 6 815. RY (33) C 12 0.09 5.21 0.019 62. BD ( 1)Co 1- S 6 836. RY ( 2) C 13 0.08 2.10 0.011 62. BD ( 1)Co 1- S 6 838. RY ( 4) C 13 0.10 2.24 0.013 62. BD ( 1)Co 1- S 6 841. RY ( 7) C 13 0.07 3.87 0.015 62. BD ( 1)Co 1- S 6 843. RY ( 9) C 13 0.05 2.66 0.010 62. BD ( 1)Co 1- S 6 844. RY (10) C 13 0.22 3.65 0.025 62. BD ( 1)Co 1- S 6 846. RY (12) C 13 0.17 3.65 0.023 62. BD ( 1)Co 1- S 6 847. RY (13) C 13 0.11 3.53 0.017 62. BD ( 1)Co 1- S 6 848. RY (14) C 13 0.12 5.47 0.023 62. BD ( 1)Co 1- S 6 854. RY (20) C 13 0.14 4.84 0.023 62. BD ( 1)Co 1- S 6 860. RY (26) C 13 0.11 4.85 0.021 62. BD ( 1)Co 1- S 6 863. RY (29) C 13 0.21 4.49 0.028 62. BD ( 1)Co 1- S 6 864. RY (30) C 13 0.21 4.75 0.028 62. BD ( 1)Co 1- S 6 865. RY (31) C 13 0.09 6.59 0.022 62. BD ( 1)Co 1- S 6 867. RY (33) C 13 0.12 4.71 0.021 62. BD ( 1)Co 1- S 6 883. RY (49) C 13 0.05 7.71 0.018 62. BD ( 1)Co 1- S 6 884. RY (50) C 13 0.05 7.69 0.018 62. BD ( 1)Co 1- S 6 890. RY ( 4) C 14 0.20 2.04 0.018 62. BD ( 1)Co 1- S 6 893. RY ( 7) C 14 0.05 3.67 0.012 62. BD ( 1)Co 1- S 6 896. RY (10) C 14 0.35 3.56 0.032 62. BD ( 1)Co 1- S 6 899. RY (13) C 14 0.36 3.21 0.030 62. BD ( 1)Co 1- S 6 902. RY (16) C 14 0.12 4.51 0.021 62. BD ( 1)Co 1- S 6 906. RY (20) C 14 0.06 5.44 0.016 62. BD ( 1)Co 1- S 6 909. RY (23) C 14 0.07 7.00 0.019 62. BD ( 1)Co 1- S 6 910. RY (24) C 14 0.07 7.71 0.021 62. BD ( 1)Co 1- S 6 912. RY (26) C 14 0.09 5.58 0.020 62. BD ( 1)Co 1- S 6 914. RY (28) C 14 0.18 5.85 0.029 62. BD ( 1)Co 1- S 6 916. RY (30) C 14 0.05 6.74 0.017 62. BD ( 1)Co 1- S 6 918. RY (32) C 14 0.13 5.88 0.024 62. BD ( 1)Co 1- S 6 920. RY (34) C 14 0.12 5.34 0.023 62. BD ( 1)Co 1- S 6 933. RY (47) C 14 0.10 7.88 0.025 62. BD ( 1)Co 1- S 6 934. RY (48) C 14 0.08 6.83 0.021 62. BD ( 1)Co 1- S 6 938. RY (52) C 14 0.10 5.69 0.022 62. BD ( 1)Co 1- S 6 939. RY ( 1) C 15 2.60 1.69 0.059 62. BD ( 1)Co 1- S 6 940. RY ( 2) C 15 0.42 2.16 0.027 62. BD ( 1)Co 1- S 6 941. RY ( 3) C 15 0.09 1.88 0.011 62. BD ( 1)Co 1- S 6 942. RY ( 4) C 15 0.59 1.85 0.029 62. BD ( 1)Co 1- S 6 943. RY ( 5) C 15 0.09 2.91 0.014 62. BD ( 1)Co 1- S 6 947. RY ( 9) C 15 0.14 2.22 0.016 62. BD ( 1)Co 1- S 6 949. RY (11) C 15 0.75 2.84 0.041 62. BD ( 1)Co 1- S 6 954. RY (16) C 15 0.08 4.45 0.016 62. BD ( 1)Co 1- S 6 955. RY (17) C 15 0.09 4.09 0.017 62. BD ( 1)Co 1- S 6 959. RY (21) C 15 0.05 4.13 0.013 62. BD ( 1)Co 1- S 6 962. RY (24) C 15 0.11 5.28 0.022 62. BD ( 1)Co 1- S 6 966. RY (28) C 15 0.49 5.85 0.048 62. BD ( 1)Co 1- S 6 967. RY (29) C 15 0.16 4.78 0.025 62. BD ( 1)Co 1- S 6 970. RY (32) C 15 0.06 5.42 0.016 62. BD ( 1)Co 1- S 6 1252. RY ( 1) H 25 0.26 1.52 0.018 62. BD ( 1)Co 1- S 6 1258. RY ( 7) H 25 0.08 6.00 0.019 62. BD ( 1)Co 1- S 6 1259. RY ( 8) H 25 0.10 5.11 0.020 62. BD ( 1)Co 1- S 6 1270. RY (19) H 25 0.05 8.21 0.019 62. BD ( 1)Co 1- S 6 1283. RY ( 3) H 26 0.25 2.39 0.022 62. BD ( 1)Co 1- S 6 1288. RY ( 8) H 26 0.14 5.15 0.024 62. BD ( 1)Co 1- S 6 1289. RY ( 9) H 26 0.06 5.66 0.017 62. BD ( 1)Co 1- S 6 1298. RY (18) H 26 0.06 7.67 0.019 62. BD ( 1)Co 1- S 6 1339. RY ( 1) H 28 0.36 1.59 0.021 62. BD ( 1)Co 1- S 6 1346. RY ( 8) H 28 0.06 5.19 0.016 62. BD ( 1)Co 1- S 6 1369. RY ( 2) H 29 0.06 2.27 0.011 63. BD ( 1)Co 1- P 10 114. BD*( 1) C 11- H 25 0.10 0.73 0.008 63. BD ( 1)Co 1- P 10 116. BD*( 2) C 12- C 13 0.53 0.31 0.012 63. BD ( 1)Co 1- P 10 119. BD*( 1) C 13- H 27 0.18 0.70 0.010 63. BD ( 1)Co 1- P 10 122. BD*( 1) C 15- H 28 0.07 0.73 0.006 63. BD ( 1)Co 1- P 10 123. 3C*( 1)C11-C14-C15 0.20 0.38 0.008 63. BD ( 1)Co 1- P 10 731. RY ( 1) C 11 0.75 1.78 0.033 63. BD ( 1)Co 1- P 10 732. RY ( 2) C 11 0.34 2.18 0.024 63. BD ( 1)Co 1- P 10 733. RY ( 3) C 11 0.13 2.02 0.014 63. BD ( 1)Co 1- P 10 734. RY ( 4) C 11 0.30 1.81 0.021 63. BD ( 1)Co 1- P 10 736. RY ( 6) C 11 0.11 2.88 0.016 63. BD ( 1)Co 1- P 10 741. RY (11) C 11 1.30 2.56 0.051 63. BD ( 1)Co 1- P 10 746. RY (16) C 11 0.07 3.29 0.014 63. BD ( 1)Co 1- P 10 747. RY (17) C 11 0.11 4.71 0.021 63. BD ( 1)Co 1- P 10 754. RY (24) C 11 0.36 5.58 0.040 63. BD ( 1)Co 1- P 10 756. RY (26) C 11 0.15 5.49 0.025 63. BD ( 1)Co 1- P 10 757. RY (27) C 11 0.06 5.48 0.017 63. BD ( 1)Co 1- P 10 758. RY (28) C 11 0.16 6.05 0.028 63. BD ( 1)Co 1- P 10 760. RY (30) C 11 0.14 4.81 0.023 63. BD ( 1)Co 1- P 10 761. RY (31) C 11 0.23 5.07 0.031 63. BD ( 1)Co 1- P 10 778. RY (48) C 11 0.06 7.39 0.019 63. BD ( 1)Co 1- P 10 782. RY (52) C 11 0.08 9.50 0.024 63. BD ( 1)Co 1- P 10 783. RY ( 1) C 12 4.12 1.77 0.076 63. BD ( 1)Co 1- P 10 786. RY ( 4) C 12 0.79 1.88 0.034 63. BD ( 1)Co 1- P 10 789. RY ( 7) C 12 0.06 3.55 0.013 63. BD ( 1)Co 1- P 10 790. RY ( 8) C 12 0.16 3.17 0.020 63. BD ( 1)Co 1- P 10 792. RY (10) C 12 0.60 3.52 0.041 63. BD ( 1)Co 1- P 10 793. RY (11) C 12 0.17 2.05 0.017 63. BD ( 1)Co 1- P 10 795. RY (13) C 12 0.15 3.29 0.020 63. BD ( 1)Co 1- P 10 798. RY (16) C 12 0.20 4.41 0.027 63. BD ( 1)Co 1- P 10 802. RY (20) C 12 0.08 3.96 0.016 63. BD ( 1)Co 1- P 10 807. RY (25) C 12 0.06 7.23 0.018 63. BD ( 1)Co 1- P 10 808. RY (26) C 12 0.20 6.65 0.032 63. BD ( 1)Co 1- P 10 811. RY (29) C 12 0.08 6.61 0.021 63. BD ( 1)Co 1- P 10 812. RY (30) C 12 0.08 6.46 0.020 63. BD ( 1)Co 1- P 10 813. RY (31) C 12 0.10 5.07 0.020 63. BD ( 1)Co 1- P 10 814. RY (32) C 12 0.27 4.63 0.031 63. BD ( 1)Co 1- P 10 815. RY (33) C 12 0.10 5.23 0.021 63. BD ( 1)Co 1- P 10 836. RY ( 2) C 13 0.90 2.12 0.039 63. BD ( 1)Co 1- P 10 838. RY ( 4) C 13 0.42 2.25 0.027 63. BD ( 1)Co 1- P 10 842. RY ( 8) C 13 0.07 2.74 0.012 63. BD ( 1)Co 1- P 10 844. RY (10) C 13 0.17 3.67 0.022 63. BD ( 1)Co 1- P 10 846. RY (12) C 13 0.28 3.67 0.028 63. BD ( 1)Co 1- P 10 848. RY (14) C 13 0.49 5.49 0.046 63. BD ( 1)Co 1- P 10 854. RY (20) C 13 0.27 4.86 0.032 63. BD ( 1)Co 1- P 10 858. RY (24) C 13 0.07 6.38 0.019 63. BD ( 1)Co 1- P 10 859. RY (25) C 13 0.13 6.19 0.025 63. BD ( 1)Co 1- P 10 860. RY (26) C 13 0.09 4.87 0.019 63. BD ( 1)Co 1- P 10 863. RY (29) C 13 0.49 4.51 0.042 63. BD ( 1)Co 1- P 10 864. RY (30) C 13 0.35 4.77 0.037 63. BD ( 1)Co 1- P 10 865. RY (31) C 13 0.10 6.61 0.023 63. BD ( 1)Co 1- P 10 867. RY (33) C 13 0.27 4.73 0.032 63. BD ( 1)Co 1- P 10 887. RY ( 1) C 14 4.66 1.74 0.081 63. BD ( 1)Co 1- P 10 890. RY ( 4) C 14 0.81 2.05 0.036 63. BD ( 1)Co 1- P 10 894. RY ( 8) C 14 0.25 2.85 0.024 63. BD ( 1)Co 1- P 10 896. RY (10) C 14 0.43 3.58 0.035 63. BD ( 1)Co 1- P 10 898. RY (12) C 14 0.05 3.07 0.011 63. BD ( 1)Co 1- P 10 899. RY (13) C 14 0.32 3.23 0.029 63. BD ( 1)Co 1- P 10 902. RY (16) C 14 0.08 4.53 0.017 63. BD ( 1)Co 1- P 10 909. RY (23) C 14 0.10 7.02 0.024 63. BD ( 1)Co 1- P 10 912. RY (26) C 14 0.22 5.60 0.031 63. BD ( 1)Co 1- P 10 914. RY (28) C 14 0.08 5.87 0.019 63. BD ( 1)Co 1- P 10 918. RY (32) C 14 0.15 5.90 0.027 63. BD ( 1)Co 1- P 10 919. RY (33) C 14 0.11 6.13 0.023 63. BD ( 1)Co 1- P 10 920. RY (34) C 14 0.16 5.36 0.026 63. BD ( 1)Co 1- P 10 934. RY (48) C 14 0.09 6.85 0.022 63. BD ( 1)Co 1- P 10 938. RY (52) C 14 0.15 5.71 0.026 63. BD ( 1)Co 1- P 10 939. RY ( 1) C 15 0.74 1.71 0.032 63. BD ( 1)Co 1- P 10 940. RY ( 2) C 15 0.34 2.18 0.024 63. BD ( 1)Co 1- P 10 942. RY ( 4) C 15 0.39 1.86 0.024 63. BD ( 1)Co 1- P 10 943. RY ( 5) C 15 0.06 2.93 0.011 63. BD ( 1)Co 1- P 10 944. RY ( 6) C 15 0.09 3.20 0.015 63. BD ( 1)Co 1- P 10 947. RY ( 9) C 15 0.10 2.24 0.013 63. BD ( 1)Co 1- P 10 949. RY (11) C 15 0.97 2.85 0.047 63. BD ( 1)Co 1- P 10 950. RY (12) C 15 0.09 3.89 0.016 63. BD ( 1)Co 1- P 10 954. RY (16) C 15 0.13 4.46 0.022 63. BD ( 1)Co 1- P 10 955. RY (17) C 15 0.13 4.11 0.021 63. BD ( 1)Co 1- P 10 961. RY (23) C 15 0.05 6.96 0.017 63. BD ( 1)Co 1- P 10 962. RY (24) C 15 0.10 5.30 0.021 63. BD ( 1)Co 1- P 10 966. RY (28) C 15 0.65 5.87 0.055 63. BD ( 1)Co 1- P 10 967. RY (29) C 15 0.15 4.80 0.024 63. BD ( 1)Co 1- P 10 968. RY (30) C 15 0.08 5.71 0.019 63. BD ( 1)Co 1- P 10 969. RY (31) C 15 0.06 4.81 0.015 63. BD ( 1)Co 1- P 10 970. RY (32) C 15 0.11 5.44 0.022 63. BD ( 1)Co 1- P 10 983. RY (45) C 15 0.05 8.17 0.019 63. BD ( 1)Co 1- P 10 1252. RY ( 1) H 25 0.17 1.54 0.015 63. BD ( 1)Co 1- P 10 1255. RY ( 4) H 25 0.05 3.15 0.011 63. BD ( 1)Co 1- P 10 1283. RY ( 3) H 26 0.28 2.41 0.023 63. BD ( 1)Co 1- P 10 1288. RY ( 8) H 26 0.14 5.17 0.024 63. BD ( 1)Co 1- P 10 1298. RY (18) H 26 0.05 7.69 0.018 63. BD ( 1)Co 1- P 10 1314. RY ( 5) H 27 0.12 3.90 0.019 63. BD ( 1)Co 1- P 10 1317. RY ( 8) H 27 0.06 5.38 0.016 63. BD ( 1)Co 1- P 10 1339. RY ( 1) H 28 0.24 1.60 0.018 63. BD ( 1)Co 1- P 10 1369. RY ( 2) H 29 0.12 2.29 0.015 63. BD ( 1)Co 1- P 10 1375. RY ( 8) H 29 0.15 5.11 0.025 63. BD ( 1)Co 1- P 10 1383. RY (16) H 29 0.05 7.02 0.017 64. BD ( 1) S 2- S 3 123. 3C*( 1)C11-C14-C15 0.06 0.56 0.005 64. BD ( 1) S 2- S 3 733. RY ( 3) C 11 0.11 2.20 0.014 64. BD ( 1) S 2- S 3 783. RY ( 1) C 12 0.16 1.95 0.016 64. BD ( 1) S 2- S 3 835. RY ( 1) C 13 0.07 1.77 0.010 64. BD ( 1) S 2- S 3 838. RY ( 4) C 13 0.05 2.43 0.010 64. BD ( 1) S 2- S 3 889. RY ( 3) C 14 0.06 2.29 0.011 64. BD ( 1) S 2- S 3 890. RY ( 4) C 14 0.08 2.23 0.012 64. BD ( 1) S 2- S 3 949. RY (11) C 15 0.08 3.03 0.014 64. BD ( 1) S 2- S 3 966. RY (28) C 15 0.05 6.05 0.016 64. BD ( 1) S 2- S 3 1341. RY ( 3) H 28 0.05 3.48 0.012 67. BD ( 1) S 5- S 6 736. RY ( 6) C 11 0.08 3.06 0.014 67. BD ( 1) S 5- S 6 785. RY ( 3) C 12 0.16 2.18 0.017 67. BD ( 1) S 5- S 6 887. RY ( 1) C 14 0.14 1.92 0.015 68. BD ( 1) C 7- P 10 939. RY ( 1) C 15 0.13 1.89 0.014 70. BD ( 1) C 7- H 17 118. BD*( 1) C 13- C 14 0.05 0.93 0.006 72. BD ( 1) C 8- P 10 835. RY ( 1) C 13 0.07 1.77 0.010 76. BD ( 1) C 9- P 10 116. BD*( 2) C 12- C 13 0.14 0.50 0.007 76. BD ( 1) C 9- P 10 731. RY ( 1) C 11 0.11 1.97 0.013 79. BD ( 1) C 9- H 24 115. BD*( 1) C 12- C 13 0.08 0.94 0.008 from unit 2 to unit 1 80. BD ( 1) C 11- C 12 93. BD*( 1)Co 1- S 2 5.99 0.68 0.057 80. BD ( 1) C 11- C 12 95. BD*( 1)Co 1- P 10 4.22 0.69 0.048 80. BD ( 1) C 11- C 12 127. RY ( 4)Co 1 0.13 2.57 0.016 80. BD ( 1) C 11- C 12 128. RY ( 5)Co 1 0.12 1.92 0.014 80. BD ( 1) C 11- C 12 133. RY (10)Co 1 0.18 2.82 0.020 80. BD ( 1) C 11- C 12 137. RY (14)Co 1 0.05 2.25 0.010 80. BD ( 1) C 11- C 12 142. RY (19)Co 1 0.06 3.36 0.013 80. BD ( 1) C 11- C 12 143. RY (20)Co 1 0.12 3.05 0.017 80. BD ( 1) C 11- C 12 147. RY (24)Co 1 0.07 4.20 0.015 80. BD ( 1) C 11- C 12 461. RY ( 9) S 6 0.06 2.09 0.010 81. BD ( 1) C 11- C 15 94. BD*( 1)Co 1- S 6 0.16 0.68 0.009 81. BD ( 1) C 11- C 15 95. BD*( 1)Co 1- P 10 8.69 0.69 0.069 81. BD ( 1) C 11- C 15 127. RY ( 4)Co 1 0.32 2.57 0.025 81. BD ( 1) C 11- C 15 128. RY ( 5)Co 1 0.28 1.92 0.021 81. BD ( 1) C 11- C 15 132. RY ( 9)Co 1 0.09 2.77 0.014 81. BD ( 1) C 11- C 15 133. RY (10)Co 1 0.08 2.82 0.013 82. BD ( 1) C 11- H 25 93. BD*( 1)Co 1- S 2 0.53 0.60 0.016 82. BD ( 1) C 11- H 25 94. BD*( 1)Co 1- S 6 0.22 0.60 0.010 82. BD ( 1) C 11- H 25 95. BD*( 1)Co 1- P 10 2.08 0.61 0.032 82. BD ( 1) C 11- H 25 125. RY ( 2)Co 1 0.06 2.00 0.009 82. BD ( 1) C 11- H 25 138. RY (15)Co 1 0.10 4.43 0.019 82. BD ( 1) C 11- H 25 163. RY (40)Co 1 0.05 5.36 0.015 83. BD ( 1) C 12- C 13 93. BD*( 1)Co 1- S 2 9.26 0.69 0.071 83. BD ( 1) C 12- C 13 94. BD*( 1)Co 1- S 6 0.69 0.69 0.019 83. BD ( 1) C 12- C 13 95. BD*( 1)Co 1- P 10 0.10 0.70 0.008 83. BD ( 1) C 12- C 13 124. RY ( 1)Co 1 0.16 2.09 0.017 83. BD ( 1) C 12- C 13 126. RY ( 3)Co 1 0.09 2.01 0.012 83. BD ( 1) C 12- C 13 128. RY ( 5)Co 1 0.35 1.93 0.023 83. BD ( 1) C 12- C 13 129. RY ( 6)Co 1 0.12 3.09 0.017 83. BD ( 1) C 12- C 13 137. RY (14)Co 1 0.09 2.26 0.013 83. BD ( 1) C 12- C 13 141. RY (18)Co 1 0.07 3.57 0.014 84. BD ( 2) C 12- C 13 93. BD*( 1)Co 1- S 2 35.73 0.40 0.106 84. BD ( 2) C 12- C 13 94. BD*( 1)Co 1- S 6 3.44 0.40 0.033 84. BD ( 2) C 12- C 13 95. BD*( 1)Co 1- P 10 0.07 0.40 0.005 84. BD ( 2) C 12- C 13 99. BD*( 1) S 5- S 6 0.11 0.38 0.006 84. BD ( 2) C 12- C 13 100. BD*( 1) C 7- P 10 0.38 0.46 0.012 84. BD ( 2) C 12- C 13 104. BD*( 1) C 8- P 10 1.24 0.47 0.022 84. BD ( 2) C 12- C 13 124. RY ( 1)Co 1 0.38 1.80 0.023 84. BD ( 2) C 12- C 13 126. RY ( 3)Co 1 0.13 1.72 0.013 84. BD ( 2) C 12- C 13 127. RY ( 4)Co 1 0.05 2.28 0.010 84. BD ( 2) C 12- C 13 128. RY ( 5)Co 1 0.34 1.64 0.021 84. BD ( 2) C 12- C 13 129. RY ( 6)Co 1 0.11 2.80 0.016 84. BD ( 2) C 12- C 13 130. RY ( 7)Co 1 0.17 1.88 0.016 84. BD ( 2) C 12- C 13 131. RY ( 8)Co 1 0.05 2.20 0.010 84. BD ( 2) C 12- C 13 132. RY ( 9)Co 1 0.12 2.48 0.016 84. BD ( 2) C 12- C 13 135. RY (12)Co 1 0.07 2.83 0.013 84. BD ( 2) C 12- C 13 138. RY (15)Co 1 2.08 4.22 0.084 84. BD ( 2) C 12- C 13 139. RY (16)Co 1 0.65 2.66 0.037 84. BD ( 2) C 12- C 13 140. RY (17)Co 1 0.11 2.98 0.016 84. BD ( 2) C 12- C 13 141. RY (18)Co 1 0.07 3.28 0.013 84. BD ( 2) C 12- C 13 142. RY (19)Co 1 0.26 3.08 0.025 84. BD ( 2) C 12- C 13 143. RY (20)Co 1 0.06 2.76 0.011 84. BD ( 2) C 12- C 13 144. RY (21)Co 1 0.06 3.03 0.012 84. BD ( 2) C 12- C 13 145. RY (22)Co 1 0.57 2.96 0.037 84. BD ( 2) C 12- C 13 146. RY (23)Co 1 0.07 2.96 0.013 84. BD ( 2) C 12- C 13 147. RY (24)Co 1 0.47 3.92 0.038 84. BD ( 2) C 12- C 13 148. RY (25)Co 1 0.53 5.59 0.049 84. BD ( 2) C 12- C 13 149. RY (26)Co 1 0.18 3.37 0.022 84. BD ( 2) C 12- C 13 150. RY (27)Co 1 0.11 3.89 0.019 84. BD ( 2) C 12- C 13 151. RY (28)Co 1 0.16 3.46 0.021 84. BD ( 2) C 12- C 13 153. RY (30)Co 1 0.25 4.05 0.028 84. BD ( 2) C 12- C 13 154. RY (31)Co 1 0.07 3.76 0.015 84. BD ( 2) C 12- C 13 155. RY (32)Co 1 0.07 3.65 0.014 84. BD ( 2) C 12- C 13 156. RY (33)Co 1 0.71 5.28 0.055 84. BD ( 2) C 12- C 13 158. RY (35)Co 1 0.20 7.37 0.034 84. BD ( 2) C 12- C 13 160. RY (37)Co 1 0.27 5.54 0.035 84. BD ( 2) C 12- C 13 161. RY (38)Co 1 0.14 6.48 0.027 84. BD ( 2) C 12- C 13 163. RY (40)Co 1 0.28 5.16 0.034 84. BD ( 2) C 12- C 13 164. RY (41)Co 1 0.13 7.99 0.029 84. BD ( 2) C 12- C 13 166. RY (43)Co 1 0.29 10.44 0.049 84. BD ( 2) C 12- C 13 168. RY (45)Co 1 0.14 11.29 0.036 84. BD ( 2) C 12- C 13 171. RY (48)Co 1 0.07 6.85 0.019 84. BD ( 2) C 12- C 13 172. RY (49)Co 1 0.11 7.57 0.026 84. BD ( 2) C 12- C 13 173. RY (50)Co 1 0.62 6.52 0.057 84. BD ( 2) C 12- C 13 174. RY (51)Co 1 0.15 5.98 0.027 84. BD ( 2) C 12- C 13 175. RY (52)Co 1 0.08 7.24 0.022 84. BD ( 2) C 12- C 13 176. RY (53)Co 1 0.93 110.33 0.287 84. BD ( 2) C 12- C 13 177. RY (54)Co 1 0.10 23.83 0.045 84. BD ( 2) C 12- C 13 178. RY (55)Co 1 0.72 119.38 0.262 84. BD ( 2) C 12- C 13 179. RY (56)Co 1 0.68 51.67 0.167 84. BD ( 2) C 12- C 13 180. RY (57)Co 1 0.67 121.60 0.255 84. BD ( 2) C 12- C 13 181. RY (58)Co 1 1.08 246.97 0.460 84. BD ( 2) C 12- C 13 182. RY (59)Co 1 0.83 60.65 0.200 84. BD ( 2) C 12- C 13 183. RY (60)Co 1 1.26 111.72 0.335 84. BD ( 2) C 12- C 13 184. RY (61)Co 1 0.25 25.59 0.072 84. BD ( 2) C 12- C 13 185. RY (62)Co 1 0.34 23.99 0.081 84. BD ( 2) C 12- C 13 186. RY (63)Co 1 0.83 153.24 0.319 84. BD ( 2) C 12- C 13 187. RY (64)Co 1 0.22 20.78 0.060 84. BD ( 2) C 12- C 13 189. RY (66)Co 1 0.26 12.81 0.052 84. BD ( 2) C 12- C 13 194. RY (71)Co 1 0.10 10.31 0.028 84. BD ( 2) C 12- C 13 195. RY (72)Co 1 0.10 11.01 0.030 84. BD ( 2) C 12- C 13 197. RY (74)Co 1 0.05 8.70 0.019 84. BD ( 2) C 12- C 13 199. RY (76)Co 1 0.80 14.05 0.095 84. BD ( 2) C 12- C 13 200. RY (77)Co 1 0.08 9.71 0.025 84. BD ( 2) C 12- C 13 201. RY (78)Co 1 0.26 9.37 0.044 84. BD ( 2) C 12- C 13 202. RY (79)Co 1 0.24 8.12 0.040 84. BD ( 2) C 12- C 13 203. RY (80)Co 1 0.42 8.64 0.054 84. BD ( 2) C 12- C 13 204. RY (81)Co 1 1.05 11.32 0.097 84. BD ( 2) C 12- C 13 205. RY (82)Co 1 0.09 10.66 0.028 84. BD ( 2) C 12- C 13 206. RY (83)Co 1 0.06 9.09 0.021 84. BD ( 2) C 12- C 13 207. RY (84)Co 1 0.14 12.35 0.037 84. BD ( 2) C 12- C 13 209. RY ( 1) S 2 0.25 1.41 0.017 84. BD ( 2) C 12- C 13 210. RY ( 2) S 2 0.10 1.37 0.010 84. BD ( 2) C 12- C 13 212. RY ( 4) S 2 0.18 1.94 0.017 84. BD ( 2) C 12- C 13 214. RY ( 6) S 2 0.76 2.81 0.041 84. BD ( 2) C 12- C 13 215. RY ( 7) S 2 0.13 2.62 0.017 84. BD ( 2) C 12- C 13 216. RY ( 8) S 2 0.08 2.09 0.012 84. BD ( 2) C 12- C 13 218. RY (10) S 2 0.23 1.62 0.017 84. BD ( 2) C 12- C 13 219. RY (11) S 2 0.15 2.35 0.017 84. BD ( 2) C 12- C 13 222. RY (14) S 2 0.16 2.21 0.017 84. BD ( 2) C 12- C 13 229. RY (21) S 2 0.13 2.23 0.015 84. BD ( 2) C 12- C 13 230. RY (22) S 2 0.08 2.92 0.014 84. BD ( 2) C 12- C 13 453. RY ( 1) S 6 0.10 1.42 0.010 84. BD ( 2) C 12- C 13 456. RY ( 4) S 6 0.06 1.88 0.010 84. BD ( 2) C 12- C 13 458. RY ( 6) S 6 0.76 2.70 0.041 84. BD ( 2) C 12- C 13 459. RY ( 7) S 6 0.06 2.52 0.011 84. BD ( 2) C 12- C 13 460. RY ( 8) S 6 0.12 2.16 0.014 84. BD ( 2) C 12- C 13 463. RY (11) S 6 0.07 2.43 0.012 84. BD ( 2) C 12- C 13 465. RY (13) S 6 0.19 2.04 0.017 84. BD ( 2) C 12- C 13 472. RY (20) S 6 0.06 2.27 0.011 84. BD ( 2) C 12- C 13 474. RY (22) S 6 0.10 2.94 0.015 84. BD ( 2) C 12- C 13 570. RY ( 5) C 8 0.06 1.61 0.009 84. BD ( 2) C 12- C 13 670. RY ( 1) P 10 0.12 1.93 0.014 84. BD ( 2) C 12- C 13 674. RY ( 5) P 10 0.37 1.83 0.023 84. BD ( 2) C 12- C 13 675. RY ( 6) P 10 0.19 1.75 0.016 84. BD ( 2) C 12- C 13 677. RY ( 8) P 10 0.22 1.76 0.017 84. BD ( 2) C 12- C 13 687. RY (18) P 10 0.08 2.91 0.013 84. BD ( 2) C 12- C 13 690. RY (21) P 10 0.05 4.33 0.014 84. BD ( 2) C 12- C 13 1052. RY ( 4) H 18 0.08 2.09 0.011 84. BD ( 2) C 12- C 13 1110. RY ( 4) H 20 0.12 1.99 0.014 84. BD ( 2) C 12- C 13 1139. RY ( 4) H 21 0.05 1.68 0.008 84. BD ( 2) C 12- C 13 1197. RY ( 4) H 23 0.08 2.28 0.012 84. BD ( 2) C 12- C 13 1226. RY ( 4) H 24 0.12 1.52 0.012 85. BD ( 1) C 12- H 26 93. BD*( 1)Co 1- S 2 2.26 0.61 0.033 85. BD ( 1) C 12- H 26 94. BD*( 1)Co 1- S 6 0.25 0.61 0.011 85. BD ( 1) C 12- H 26 95. BD*( 1)Co 1- P 10 0.49 0.61 0.015 85. BD ( 1) C 12- H 26 132. RY ( 9)Co 1 0.08 2.69 0.013 85. BD ( 1) C 12- H 26 150. RY (27)Co 1 0.06 4.09 0.013 85. BD ( 1) C 12- H 26 173. RY (50)Co 1 0.05 6.73 0.017 86. BD ( 1) C 13- C 14 93. BD*( 1)Co 1- S 2 1.98 0.69 0.033 86. BD ( 1) C 13- C 14 94. BD*( 1)Co 1- S 6 9.31 0.69 0.072 86. BD ( 1) C 13- C 14 124. RY ( 1)Co 1 0.12 2.09 0.014 86. BD ( 1) C 13- C 14 128. RY ( 5)Co 1 0.29 1.93 0.021 86. BD ( 1) C 13- C 14 129. RY ( 6)Co 1 0.15 3.09 0.019 86. BD ( 1) C 13- C 14 130. RY ( 7)Co 1 0.06 2.18 0.010 86. BD ( 1) C 13- C 14 137. RY (14)Co 1 0.06 2.26 0.010 86. BD ( 1) C 13- C 14 140. RY (17)Co 1 0.06 3.27 0.012 86. BD ( 1) C 13- C 14 154. RY (31)Co 1 0.07 4.05 0.015 86. BD ( 1) C 13- C 14 677. RY ( 8) P 10 0.07 2.06 0.011 86. BD ( 1) C 13- C 14 688. RY (19) P 10 0.06 3.58 0.013 87. BD ( 1) C 13- H 27 93. BD*( 1)Co 1- S 2 1.46 0.62 0.027 87. BD ( 1) C 13- H 27 94. BD*( 1)Co 1- S 6 1.09 0.62 0.023 87. BD ( 1) C 13- H 27 95. BD*( 1)Co 1- P 10 0.25 0.63 0.011 87. BD ( 1) C 13- H 27 104. BD*( 1) C 8- P 10 0.43 0.70 0.015 87. BD ( 1) C 13- H 27 133. RY (10)Co 1 0.10 2.76 0.015 87. BD ( 1) C 13- H 27 138. RY (15)Co 1 0.13 4.45 0.021 87. BD ( 1) C 13- H 27 176. RY (53)Co 1 0.05 110.56 0.068 87. BD ( 1) C 13- H 27 183. RY (60)Co 1 0.06 111.95 0.073 87. BD ( 1) C 13- H 27 204. RY (81)Co 1 0.07 11.55 0.025 87. BD ( 1) C 13- H 27 674. RY ( 5) P 10 0.09 2.06 0.012 87. BD ( 1) C 13- H 27 677. RY ( 8) P 10 0.06 1.99 0.010 88. BD ( 1) C 14- C 15 94. BD*( 1)Co 1- S 6 6.78 0.68 0.061 88. BD ( 1) C 14- C 15 95. BD*( 1)Co 1- P 10 2.37 0.69 0.036 88. BD ( 1) C 14- C 15 127. RY ( 4)Co 1 0.16 2.57 0.018 88. BD ( 1) C 14- C 15 128. RY ( 5)Co 1 0.15 1.92 0.015 88. BD ( 1) C 14- C 15 132. RY ( 9)Co 1 0.08 2.76 0.014 88. BD ( 1) C 14- C 15 133. RY (10)Co 1 0.19 2.82 0.021 88. BD ( 1) C 14- C 15 134. RY (11)Co 1 0.06 2.31 0.011 88. BD ( 1) C 14- C 15 137. RY (14)Co 1 0.05 2.25 0.010 88. BD ( 1) C 14- C 15 144. RY (21)Co 1 0.06 3.31 0.012 89. BD ( 1) C 14- H 29 93. BD*( 1)Co 1- S 2 0.30 0.61 0.012 89. BD ( 1) C 14- H 29 94. BD*( 1)Co 1- S 6 2.33 0.61 0.034 89. BD ( 1) C 14- H 29 95. BD*( 1)Co 1- P 10 0.39 0.62 0.014 89. BD ( 1) C 14- H 29 138. RY (15)Co 1 0.07 4.43 0.016 90. BD ( 1) C 15- H 28 93. BD*( 1)Co 1- S 2 0.18 0.60 0.009 90. BD ( 1) C 15- H 28 94. BD*( 1)Co 1- S 6 0.72 0.60 0.019 90. BD ( 1) C 15- H 28 95. BD*( 1)Co 1- P 10 1.62 0.61 0.028 90. BD ( 1) C 15- H 28 97. BD*( 1) S 3- S 4 0.05 0.54 0.005 90. BD ( 1) C 15- H 28 125. RY ( 2)Co 1 0.09 2.01 0.012 90. BD ( 1) C 15- H 28 138. RY (15)Co 1 0.06 4.43 0.014 90. BD ( 1) C 15- H 28 153. RY (30)Co 1 0.06 4.25 0.015 91. 3C ( 1)C11-C14-C15 93. BD*( 1)Co 1- S 2 0.70 0.44 0.016 91. 3C ( 1)C11-C14-C15 94. BD*( 1)Co 1- S 6 17.09 0.45 0.078 91. 3C ( 1)C11-C14-C15 95. BD*( 1)Co 1- P 10 32.13 0.45 0.108 91. 3C ( 1)C11-C14-C15 99. BD*( 1) S 5- S 6 0.19 0.43 0.008 91. 3C ( 1)C11-C14-C15 108. BD*( 1) C 9- P 10 0.12 0.51 0.007 91. 3C ( 1)C11-C14-C15 124. RY ( 1)Co 1 0.78 1.85 0.034 91. 3C ( 1)C11-C14-C15 127. RY ( 4)Co 1 0.34 2.33 0.025 91. 3C ( 1)C11-C14-C15 128. RY ( 5)Co 1 0.27 1.68 0.019 91. 3C ( 1)C11-C14-C15 130. RY ( 7)Co 1 0.06 1.93 0.009 91. 3C ( 1)C11-C14-C15 132. RY ( 9)Co 1 0.26 2.53 0.023 91. 3C ( 1)C11-C14-C15 133. RY (10)Co 1 0.28 2.58 0.024 91. 3C ( 1)C11-C14-C15 135. RY (12)Co 1 0.44 2.87 0.032 91. 3C ( 1)C11-C14-C15 138. RY (15)Co 1 3.51 4.27 0.109 91. 3C ( 1)C11-C14-C15 139. RY (16)Co 1 1.01 2.71 0.047 91. 3C ( 1)C11-C14-C15 140. RY (17)Co 1 0.18 3.03 0.021 91. 3C ( 1)C11-C14-C15 145. RY (22)Co 1 0.42 3.01 0.032 91. 3C ( 1)C11-C14-C15 146. RY (23)Co 1 0.14 3.01 0.018 91. 3C ( 1)C11-C14-C15 147. RY (24)Co 1 0.31 3.97 0.031 91. 3C ( 1)C11-C14-C15 148. RY (25)Co 1 1.10 5.64 0.070 91. 3C ( 1)C11-C14-C15 149. RY (26)Co 1 0.22 3.42 0.025 91. 3C ( 1)C11-C14-C15 150. RY (27)Co 1 0.48 3.93 0.039 91. 3C ( 1)C11-C14-C15 151. RY (28)Co 1 0.27 3.51 0.027 91. 3C ( 1)C11-C14-C15 153. RY (30)Co 1 0.23 4.10 0.028 91. 3C ( 1)C11-C14-C15 154. RY (31)Co 1 0.06 3.81 0.013 91. 3C ( 1)C11-C14-C15 155. RY (32)Co 1 0.13 3.70 0.020 91. 3C ( 1)C11-C14-C15 156. RY (33)Co 1 0.97 5.33 0.064 91. 3C ( 1)C11-C14-C15 157. RY (34)Co 1 0.06 4.77 0.015 91. 3C ( 1)C11-C14-C15 158. RY (35)Co 1 0.31 7.42 0.043 91. 3C ( 1)C11-C14-C15 160. RY (37)Co 1 0.48 5.59 0.046 91. 3C ( 1)C11-C14-C15 161. RY (38)Co 1 0.16 6.53 0.029 91. 3C ( 1)C11-C14-C15 162. RY (39)Co 1 0.06 4.69 0.015 91. 3C ( 1)C11-C14-C15 163. RY (40)Co 1 0.24 5.20 0.031 91. 3C ( 1)C11-C14-C15 164. RY (41)Co 1 0.24 8.04 0.039 91. 3C ( 1)C11-C14-C15 166. RY (43)Co 1 0.61 10.49 0.072 91. 3C ( 1)C11-C14-C15 168. RY (45)Co 1 0.20 11.34 0.043 91. 3C ( 1)C11-C14-C15 172. RY (49)Co 1 0.12 7.62 0.026 91. 3C ( 1)C11-C14-C15 173. RY (50)Co 1 1.02 6.57 0.073 91. 3C ( 1)C11-C14-C15 174. RY (51)Co 1 0.17 6.03 0.029 91. 3C ( 1)C11-C14-C15 175. RY (52)Co 1 0.15 7.28 0.029 91. 3C ( 1)C11-C14-C15 176. RY (53)Co 1 1.38 110.38 0.349 91. 3C ( 1)C11-C14-C15 177. RY (54)Co 1 0.15 23.88 0.054 91. 3C ( 1)C11-C14-C15 178. RY (55)Co 1 1.08 119.43 0.321 91. 3C ( 1)C11-C14-C15 179. RY (56)Co 1 1.01 51.72 0.204 91. 3C ( 1)C11-C14-C15 180. RY (57)Co 1 1.00 121.65 0.311 91. 3C ( 1)C11-C14-C15 181. RY (58)Co 1 1.62 247.02 0.566 91. 3C ( 1)C11-C14-C15 182. RY (59)Co 1 1.25 60.70 0.246 91. 3C ( 1)C11-C14-C15 183. RY (60)Co 1 1.90 111.77 0.412 91. 3C ( 1)C11-C14-C15 184. RY (61)Co 1 0.40 25.63 0.090 91. 3C ( 1)C11-C14-C15 185. RY (62)Co 1 0.49 24.04 0.097 91. 3C ( 1)C11-C14-C15 186. RY (63)Co 1 1.23 153.28 0.388 91. 3C ( 1)C11-C14-C15 187. RY (64)Co 1 0.32 20.83 0.073 91. 3C ( 1)C11-C14-C15 189. RY (66)Co 1 0.32 12.86 0.058 91. 3C ( 1)C11-C14-C15 194. RY (71)Co 1 0.16 10.36 0.036 91. 3C ( 1)C11-C14-C15 195. RY (72)Co 1 0.21 11.05 0.043 91. 3C ( 1)C11-C14-C15 197. RY (74)Co 1 0.11 8.75 0.028 91. 3C ( 1)C11-C14-C15 199. RY (76)Co 1 1.14 14.10 0.113 91. 3C ( 1)C11-C14-C15 200. RY (77)Co 1 0.10 9.76 0.028 91. 3C ( 1)C11-C14-C15 201. RY (78)Co 1 0.31 9.42 0.048 91. 3C ( 1)C11-C14-C15 202. RY (79)Co 1 0.37 8.17 0.049 91. 3C ( 1)C11-C14-C15 203. RY (80)Co 1 0.72 8.69 0.071 91. 3C ( 1)C11-C14-C15 204. RY (81)Co 1 1.56 11.37 0.119 91. 3C ( 1)C11-C14-C15 205. RY (82)Co 1 0.15 10.71 0.036 91. 3C ( 1)C11-C14-C15 206. RY (83)Co 1 0.11 9.14 0.028 91. 3C ( 1)C11-C14-C15 207. RY (84)Co 1 0.14 12.40 0.037 91. 3C ( 1)C11-C14-C15 208. RY (85)Co 1 0.06 8.73 0.021 91. 3C ( 1)C11-C14-C15 209. RY ( 1) S 2 0.23 1.46 0.016 91. 3C ( 1)C11-C14-C15 212. RY ( 4) S 2 0.09 1.99 0.012 91. 3C ( 1)C11-C14-C15 214. RY ( 6) S 2 0.76 2.86 0.042 91. 3C ( 1)C11-C14-C15 216. RY ( 8) S 2 0.23 2.14 0.020 91. 3C ( 1)C11-C14-C15 218. RY (10) S 2 0.06 1.67 0.009 91. 3C ( 1)C11-C14-C15 219. RY (11) S 2 0.05 2.40 0.010 91. 3C ( 1)C11-C14-C15 222. RY (14) S 2 0.08 2.26 0.012 91. 3C ( 1)C11-C14-C15 224. RY (16) S 2 0.08 1.79 0.010 91. 3C ( 1)C11-C14-C15 226. RY (18) S 2 0.12 3.89 0.019 91. 3C ( 1)C11-C14-C15 227. RY (19) S 2 0.06 2.75 0.012 91. 3C ( 1)C11-C14-C15 229. RY (21) S 2 0.20 2.28 0.019 91. 3C ( 1)C11-C14-C15 230. RY (22) S 2 0.06 2.97 0.012 91. 3C ( 1)C11-C14-C15 243. RY (35) S 2 0.07 4.88 0.016 91. 3C ( 1)C11-C14-C15 244. RY (36) S 2 0.06 4.17 0.014 91. 3C ( 1)C11-C14-C15 453. RY ( 1) S 6 0.43 1.47 0.022 91. 3C ( 1)C11-C14-C15 456. RY ( 4) S 6 0.17 1.93 0.016 91. 3C ( 1)C11-C14-C15 457. RY ( 5) S 6 0.07 2.66 0.012 91. 3C ( 1)C11-C14-C15 458. RY ( 6) S 6 0.84 2.75 0.043 91. 3C ( 1)C11-C14-C15 460. RY ( 8) S 6 0.20 2.21 0.019 91. 3C ( 1)C11-C14-C15 463. RY (11) S 6 0.18 2.48 0.019 91. 3C ( 1)C11-C14-C15 464. RY (12) S 6 0.06 2.61 0.011 91. 3C ( 1)C11-C14-C15 465. RY (13) S 6 0.08 2.09 0.011 91. 3C ( 1)C11-C14-C15 468. RY (16) S 6 0.06 2.07 0.010 91. 3C ( 1)C11-C14-C15 472. RY (20) S 6 0.08 2.32 0.012 91. 3C ( 1)C11-C14-C15 474. RY (22) S 6 0.13 2.99 0.018 91. 3C ( 1)C11-C14-C15 476. RY (24) S 6 0.09 2.99 0.015 91. 3C ( 1)C11-C14-C15 478. RY (26) S 6 0.07 3.22 0.013 91. 3C ( 1)C11-C14-C15 514. RY ( 1) C 7 0.06 2.10 0.010 91. 3C ( 1)C11-C14-C15 519. RY ( 6) C 7 0.08 1.66 0.010 91. 3C ( 1)C11-C14-C15 566. RY ( 1) C 8 0.08 2.17 0.012 91. 3C ( 1)C11-C14-C15 567. RY ( 2) C 8 0.07 3.27 0.013 91. 3C ( 1)C11-C14-C15 570. RY ( 5) C 8 0.11 1.66 0.012 91. 3C ( 1)C11-C14-C15 618. RY ( 1) C 9 0.06 2.10 0.010 91. 3C ( 1)C11-C14-C15 623. RY ( 6) C 9 0.05 1.49 0.008 91. 3C ( 1)C11-C14-C15 625. RY ( 8) C 9 0.05 1.75 0.008 91. 3C ( 1)C11-C14-C15 670. RY ( 1) P 10 0.76 1.97 0.035 91. 3C ( 1)C11-C14-C15 673. RY ( 4) P 10 0.13 1.67 0.013 91. 3C ( 1)C11-C14-C15 674. RY ( 5) P 10 0.57 1.88 0.029 91. 3C ( 1)C11-C14-C15 675. RY ( 6) P 10 0.12 1.80 0.013 91. 3C ( 1)C11-C14-C15 677. RY ( 8) P 10 0.35 1.81 0.022 91. 3C ( 1)C11-C14-C15 687. RY (18) P 10 0.20 2.96 0.022 91. 3C ( 1)C11-C14-C15 730. RY (61) P 10 0.06 6.16 0.017 91. 3C ( 1)C11-C14-C15 1052. RY ( 4) H 18 0.07 2.14 0.011 91. 3C ( 1)C11-C14-C15 1110. RY ( 4) H 20 0.10 2.04 0.013 91. 3C ( 1)C11-C14-C15 1139. RY ( 4) H 21 0.07 1.73 0.010 92. 3Cn( 1)C11-C14-C15 93. BD*( 1)Co 1- S 2 1.07 0.25 0.015 92. 3Cn( 1)C11-C14-C15 94. BD*( 1)Co 1- S 6 25.73 0.25 0.072 92. 3Cn( 1)C11-C14-C15 95. BD*( 1)Co 1- P 10 13.22 0.26 0.052 92. 3Cn( 1)C11-C14-C15 96. BD*( 1) S 2- S 3 0.36 0.23 0.008 92. 3Cn( 1)C11-C14-C15 100. BD*( 1) C 7- P 10 0.34 0.32 0.009 92. 3Cn( 1)C11-C14-C15 108. BD*( 1) C 9- P 10 0.22 0.32 0.008 92. 3Cn( 1)C11-C14-C15 109. BD*( 1) C 9- H 22 0.06 0.47 0.005 92. 3Cn( 1)C11-C14-C15 126. RY ( 3)Co 1 0.18 1.58 0.015 92. 3Cn( 1)C11-C14-C15 127. RY ( 4)Co 1 0.05 2.14 0.010 92. 3Cn( 1)C11-C14-C15 129. RY ( 6)Co 1 0.07 2.65 0.012 92. 3Cn( 1)C11-C14-C15 130. RY ( 7)Co 1 0.13 1.74 0.013 92. 3Cn( 1)C11-C14-C15 131. RY ( 8)Co 1 0.07 2.05 0.011 92. 3Cn( 1)C11-C14-C15 139. RY (16)Co 1 0.11 2.52 0.015 92. 3Cn( 1)C11-C14-C15 143. RY (20)Co 1 0.06 2.62 0.011 92. 3Cn( 1)C11-C14-C15 150. RY (27)Co 1 0.06 3.74 0.014 92. 3Cn( 1)C11-C14-C15 154. RY (31)Co 1 0.12 3.61 0.018 92. 3Cn( 1)C11-C14-C15 402. RY (11) S 5 0.05 1.76 0.008 92. 3Cn( 1)C11-C14-C15 455. RY ( 3) S 6 0.06 1.38 0.008 92. 3Cn( 1)C11-C14-C15 478. RY (26) S 6 0.06 3.03 0.012 within unit 2 80. BD ( 1) C 11- C 12 119. BD*( 1) C 13- H 27 3.10 0.95 0.048 80. BD ( 1) C 11- C 12 122. BD*( 1) C 15- H 28 2.67 0.98 0.046 80. BD ( 1) C 11- C 12 123. 3C*( 1)C11-C14-C15 1.39 0.63 0.026 80. BD ( 1) C 11- C 12 837. RY ( 3) C 13 2.47 2.20 0.066 80. BD ( 1) C 11- C 12 940. RY ( 2) C 15 0.85 2.43 0.041 80. BD ( 1) C 11- C 12 941. RY ( 3) C 15 1.85 2.15 0.056 80. BD ( 1) C 11- C 12 1253. RY ( 2) H 25 1.06 3.29 0.053 80. BD ( 1) C 11- C 12 1281. RY ( 1) H 26 0.90 3.25 0.048 81. BD ( 1) C 11- C 15 117. BD*( 1) C 12- H 26 2.50 0.97 0.044 81. BD ( 1) C 11- C 15 121. BD*( 1) C 14- H 29 2.53 0.96 0.044 81. BD ( 1) C 11- C 15 785. RY ( 3) C 12 2.42 2.25 0.066 81. BD ( 1) C 11- C 15 888. RY ( 2) C 14 1.54 2.29 0.053 81. BD ( 1) C 11- C 15 889. RY ( 3) C 14 0.72 2.36 0.037 81. BD ( 1) C 11- C 15 1254. RY ( 3) H 25 1.06 3.57 0.055 81. BD ( 1) C 11- C 15 1340. RY ( 2) H 28 0.83 3.45 0.048 82. BD ( 1) C 11- H 25 115. BD*( 1) C 12- C 13 1.84 0.94 0.037 82. BD ( 1) C 11- H 25 120. BD*( 1) C 14- C 15 2.08 0.93 0.039 82. BD ( 1) C 11- H 25 784. RY ( 2) C 12 1.50 2.32 0.053 82. BD ( 1) C 11- H 25 788. RY ( 6) C 12 0.69 5.17 0.053 82. BD ( 1) C 11- H 25 940. RY ( 2) C 15 1.35 2.35 0.050 82. BD ( 1) C 11- H 25 945. RY ( 7) C 15 0.63 5.54 0.053 83. BD ( 1) C 12- C 13 114. BD*( 1) C 11- H 25 2.50 0.99 0.044 83. BD ( 1) C 12- C 13 121. BD*( 1) C 14- H 29 2.55 0.97 0.044 83. BD ( 1) C 12- C 13 733. RY ( 3) C 11 2.39 2.27 0.066 83. BD ( 1) C 12- C 13 889. RY ( 3) C 14 2.83 2.37 0.073 83. BD ( 1) C 12- C 13 1282. RY ( 2) H 26 0.72 3.54 0.045 83. BD ( 1) C 12- C 13 1312. RY ( 3) H 27 0.68 3.60 0.044 84. BD ( 2) C 12- C 13 123. 3C*( 1)C11-C14-C15 27.35 0.34 0.086 84. BD ( 2) C 12- C 13 731. RY ( 1) C 11 0.70 1.74 0.031 84. BD ( 2) C 12- C 13 735. RY ( 5) C 11 0.76 3.14 0.044 84. BD ( 2) C 12- C 13 786. RY ( 4) C 12 0.62 1.84 0.030 84. BD ( 2) C 12- C 13 792. RY (10) C 12 0.88 3.48 0.049 84. BD ( 2) C 12- C 13 838. RY ( 4) C 13 0.64 2.22 0.034 84. BD ( 2) C 12- C 13 887. RY ( 1) C 14 0.60 1.71 0.029 84. BD ( 2) C 12- C 13 891. RY ( 5) C 14 0.66 3.22 0.041 84. BD ( 2) C 12- C 13 1313. RY ( 4) H 27 0.52 2.82 0.034 85. BD ( 1) C 12- H 26 113. BD*( 1) C 11- C 15 1.66 0.95 0.035 85. BD ( 1) C 12- H 26 118. BD*( 1) C 13- C 14 2.14 0.94 0.040 85. BD ( 1) C 12- H 26 732. RY ( 2) C 11 1.35 2.35 0.050 85. BD ( 1) C 12- H 26 737. RY ( 7) C 11 0.83 5.42 0.060 85. BD ( 1) C 12- H 26 835. RY ( 1) C 13 0.78 1.77 0.033 85. BD ( 1) C 12- H 26 836. RY ( 2) C 13 1.00 2.29 0.043 85. BD ( 1) C 12- H 26 840. RY ( 6) C 13 0.65 5.41 0.053 86. BD ( 1) C 13- C 14 117. BD*( 1) C 12- H 26 2.70 0.98 0.046 86. BD ( 1) C 13- C 14 122. BD*( 1) C 15- H 28 2.64 0.99 0.046 86. BD ( 1) C 13- C 14 123. 3C*( 1)C11-C14-C15 1.51 0.64 0.028 86. BD ( 1) C 13- C 14 784. RY ( 2) C 12 1.22 2.41 0.049 86. BD ( 1) C 13- C 14 785. RY ( 3) C 12 2.01 2.26 0.060 86. BD ( 1) C 13- C 14 941. RY ( 3) C 15 2.51 2.16 0.066 86. BD ( 1) C 13- C 14 1310. RY ( 1) H 27 0.52 2.84 0.034 86. BD ( 1) C 13- C 14 1311. RY ( 2) H 27 0.67 2.49 0.036 86. BD ( 1) C 13- C 14 1369. RY ( 2) H 29 0.64 2.54 0.036 87. BD ( 1) C 13- H 27 112. BD*( 1) C 11- C 12 1.83 0.96 0.037 87. BD ( 1) C 13- H 27 120. BD*( 1) C 14- C 15 1.76 0.95 0.037 87. BD ( 1) C 13- H 27 784. RY ( 2) C 12 1.28 2.35 0.049 87. BD ( 1) C 13- H 27 788. RY ( 6) C 12 0.54 5.20 0.047 87. BD ( 1) C 13- H 27 848. RY (14) C 13 0.51 5.67 0.048 87. BD ( 1) C 13- H 27 888. RY ( 2) C 14 1.25 2.23 0.047 87. BD ( 1) C 13- H 27 892. RY ( 6) C 14 0.57 5.21 0.049 88. BD ( 1) C 14- C 15 114. BD*( 1) C 11- H 25 2.59 0.98 0.045 88. BD ( 1) C 14- C 15 119. BD*( 1) C 13- H 27 2.97 0.95 0.047 88. BD ( 1) C 14- C 15 732. RY ( 2) C 11 1.08 2.43 0.046 88. BD ( 1) C 14- C 15 733. RY ( 3) C 11 1.53 2.26 0.052 88. BD ( 1) C 14- C 15 837. RY ( 3) C 13 1.90 2.20 0.058 88. BD ( 1) C 14- C 15 1341. RY ( 3) H 28 0.82 3.55 0.048 88. BD ( 1) C 14- C 15 1368. RY ( 1) H 29 0.50 2.97 0.034 88. BD ( 1) C 14- C 15 1370. RY ( 3) H 29 0.56 3.67 0.041 89. BD ( 1) C 14- H 29 113. BD*( 1) C 11- C 15 1.72 0.95 0.036 89. BD ( 1) C 14- H 29 115. BD*( 1) C 12- C 13 2.00 0.94 0.039 89. BD ( 1) C 14- H 29 835. RY ( 1) C 13 0.72 1.77 0.032 89. BD ( 1) C 14- H 29 836. RY ( 2) C 13 0.95 2.29 0.042 89. BD ( 1) C 14- H 29 840. RY ( 6) C 13 0.65 5.41 0.053 89. BD ( 1) C 14- H 29 940. RY ( 2) C 15 1.44 2.36 0.052 89. BD ( 1) C 14- H 29 945. RY ( 7) C 15 0.85 5.55 0.061 90. BD ( 1) C 15- H 28 112. BD*( 1) C 11- C 12 2.03 0.93 0.039 90. BD ( 1) C 15- H 28 118. BD*( 1) C 13- C 14 1.90 0.93 0.038 90. BD ( 1) C 15- H 28 732. RY ( 2) C 11 1.12 2.35 0.046 90. BD ( 1) C 15- H 28 737. RY ( 7) C 11 0.61 5.42 0.051 90. BD ( 1) C 15- H 28 888. RY ( 2) C 14 0.84 2.21 0.038 90. BD ( 1) C 15- H 28 889. RY ( 3) C 14 0.62 2.28 0.033 90. BD ( 1) C 15- H 28 892. RY ( 6) C 14 0.61 5.19 0.050 91. 3C ( 1)C11-C14-C15 112. BD*( 1) C 11- C 12 1.29 0.78 0.028 91. 3C ( 1)C11-C14-C15 118. BD*( 1) C 13- C 14 1.41 0.78 0.030 91. 3C ( 1)C11-C14-C15 783. RY ( 1) C 12 0.51 1.78 0.027 92. 3Cn( 1)C11-C14-C15 112. BD*( 1) C 11- C 12 2.74 0.58 0.036 92. 3Cn( 1)C11-C14-C15 113. BD*( 1) C 11- C 15 3.30 0.60 0.040 92. 3Cn( 1)C11-C14-C15 116. BD*( 2) C 12- C 13 143.56 0.13 0.122 92. 3Cn( 1)C11-C14-C15 118. BD*( 1) C 13- C 14 3.61 0.58 0.041 92. 3Cn( 1)C11-C14-C15 120. BD*( 1) C 14- C 15 2.97 0.58 0.037 92. 3Cn( 1)C11-C14-C15 734. RY ( 4) C 11 2.62 1.63 0.058 92. 3Cn( 1)C11-C14-C15 736. RY ( 6) C 11 0.95 2.70 0.045 92. 3Cn( 1)C11-C14-C15 741. RY (11) C 11 0.74 2.37 0.037 92. 3Cn( 1)C11-C14-C15 747. RY (17) C 11 0.61 4.53 0.047 92. 3Cn( 1)C11-C14-C15 782. RY (52) C 11 0.68 9.31 0.071 92. 3Cn( 1)C11-C14-C15 784. RY ( 2) C 12 0.53 1.98 0.029 92. 3Cn( 1)C11-C14-C15 786. RY ( 4) C 12 1.19 1.70 0.040 92. 3Cn( 1)C11-C14-C15 796. RY (14) C 12 0.67 5.39 0.054 92. 3Cn( 1)C11-C14-C15 835. RY ( 1) C 13 2.17 1.41 0.049 92. 3Cn( 1)C11-C14-C15 838. RY ( 4) C 13 0.99 2.07 0.040 92. 3Cn( 1)C11-C14-C15 839. RY ( 5) C 13 0.59 3.26 0.039 92. 3Cn( 1)C11-C14-C15 848. RY (14) C 13 0.84 5.30 0.060 92. 3Cn( 1)C11-C14-C15 888. RY ( 2) C 14 0.98 1.86 0.038 92. 3Cn( 1)C11-C14-C15 889. RY ( 3) C 14 0.74 1.93 0.034 92. 3Cn( 1)C11-C14-C15 890. RY ( 4) C 14 2.72 1.87 0.064 92. 3Cn( 1)C11-C14-C15 893. RY ( 7) C 14 0.56 3.50 0.039 92. 3Cn( 1)C11-C14-C15 895. RY ( 9) C 14 0.74 2.98 0.042 92. 3Cn( 1)C11-C14-C15 896. RY (10) C 14 1.11 3.40 0.055 92. 3Cn( 1)C11-C14-C15 911. RY (25) C 14 0.73 7.29 0.065 92. 3Cn( 1)C11-C14-C15 919. RY (33) C 14 0.72 5.95 0.058 92. 3Cn( 1)C11-C14-C15 943. RY ( 5) C 15 3.52 2.74 0.088 92. 3Cn( 1)C11-C14-C15 944. RY ( 6) C 15 1.07 3.02 0.051 92. 3Cn( 1)C11-C14-C15 948. RY (10) C 15 0.66 2.97 0.040 92. 3Cn( 1)C11-C14-C15 954. RY (16) C 15 0.68 4.28 0.048 92. 3Cn( 1)C11-C14-C15 955. RY (17) C 15 0.84 3.92 0.051 92. 3Cn( 1)C11-C14-C15 1368. RY ( 1) H 29 0.79 2.54 0.040 92. 3Cn( 1)C11-C14-C15 1371. RY ( 4) H 29 0.60 3.40 0.040 NATURAL BOND ORBITALS (Summary): Principal Delocalizations NBO Occupancy Energy (geminal,vicinal,remote) =============================================================================== Molecular unit 1 (C3H9PS5Co) ------ Lewis -------------------------------------- 1. CR ( 1)Co 1 2.00000 -198.30421 2. CR ( 2)Co 1 2.00000 -111.50072 3. CR ( 3)Co 1 1.99999 -3.73450 4. CR ( 4)Co 1 2.00000 -27.97864 5. CR ( 5)Co 1 1.99996 -2.87955 6. CR ( 6)Co 1 2.00000 -27.98852 7. CR ( 7)Co 1 1.99993 -2.89658 8. CR ( 8)Co 1 2.00000 -27.97601 9. CR ( 9)Co 1 1.99997 -2.87484 10. CR ( 1) S 2 2.00000 -87.34503 11. CR ( 2) S 2 2.00000 -9.18083 12. CR ( 3) S 2 1.99999 -5.85470 13. CR ( 4) S 2 1.99999 -5.84531 14. CR ( 5) S 2 1.99999 -5.84745 15. CR ( 1) S 3 2.00000 -87.85771 16. CR ( 2) S 3 2.00000 -8.74533 17. CR ( 3) S 3 1.99999 -5.89019 18. CR ( 4) S 3 1.99999 -5.88382 19. CR ( 5) S 3 1.99999 -5.88619 20. CR ( 1) S 4 2.00000 -87.97546 21. CR ( 2) S 4 2.00000 -8.62260 22. CR ( 3) S 4 1.99999 -5.88102 23. CR ( 4) S 4 1.99999 -5.88288 24. CR ( 5) S 4 1.99999 -5.88998 25. CR ( 1) S 5 2.00000 -87.87396 26. CR ( 2) S 5 2.00000 -8.72787 27. CR ( 3) S 5 1.99999 -5.88969 28. CR ( 4) S 5 1.99999 -5.88233 29. CR ( 5) S 5 1.99999 -5.88641 30. CR ( 1) S 6 2.00000 -87.36062 31. CR ( 2) S 6 2.00000 -9.16505 32. CR ( 3) S 6 1.99999 -5.85467 33. CR ( 4) S 6 1.99999 -5.84545 34. CR ( 5) S 6 1.99999 -5.84703 35. CR ( 1) C 7 1.99997 -10.21158 36. CR ( 1) C 8 1.99997 -10.19765 37. CR ( 1) C 9 1.99997 -10.21390 38. CR ( 1) P 10 2.00000 -69.44407 39. CR ( 2) P 10 2.00000 -14.06014 40. CR ( 3) P 10 2.00000 -4.72894 41. CR ( 4) P 10 2.00000 -4.72828 42. CR ( 5) P 10 2.00000 -4.73043 48. LP ( 1)Co 1 1.97428 -0.24133 670(v),212(v),675(v),456(v) 213(v),119(r),121(r),133(g) 117(r),457(v),122(r),114(r) 93(g),94(g),116(r),783(r) 835(r),887(r),123(r) 1368(r),888(r),786(r) 734(r),836(r),1281(r) 784(r),942(r),1310(r) 1375(r),890(r),1288(r) 49. LP ( 2)Co 1 1.93900 -0.22118 116(r),95(g),783(r),835(r) 670(v),459(v),939(r),887(r) 675(v),213(v),454(v),99(v) 123(r),848(r),836(r),731(r) 122(r),842(r),894(r),114(r) 789(r),948(r),733(r),940(r) 741(r),838(r),844(r),865(r) 889(r),118(r),1314(r) 816(r),1285(r) 50. LP ( 3)Co 1 1.92494 -0.22053 123(r),939(r),676(v),731(r) 672(v),116(r),671(v),100(v) 96(v),93(g),215(v),887(r) 740(r),949(r),835(r),790(r) 783(r),751(r),971(r),732(r) 959(r),1339(r),785(r) 894(r),954(r),1372(r) 51. LP ( 1) S 2 1.97456 -0.48073 94(v),95(v),93(g),138(v) 183(v),204(v),100(r),135(v) 176(v),181(v),156(v),182(v) 148(v),186(v),199(v),179(v) 178(v),180(v),214(g),173(v) 203(v),731(r),783(r),887(r) 939(r),786(r),741(r),966(r) 792(r),890(r),949(r),942(r) 940(r),116(r),814(r),863(r) 732(r),754(r),761(r) 52. LP ( 2) S 2 1.90415 -0.22297 97(v),270(v),94(v),95(v) 123(r),113(r),118(r) 53. LP ( 1) S 3 1.99413 -0.49779 54. LP ( 2) S 3 1.87030 -0.24038 98(v),331(v),209(v),93(v) 274(g),122(r),123(r),120(r) 55. LP ( 1) S 4 1.99553 -0.50540 56. LP ( 2) S 4 1.89533 -0.24505 96(v),99(v),270(v),392(v) 271(v),393(v),335(g),337(g) 57. LP ( 1) S 5 1.99381 -0.49645 114(r) 58. LP ( 2) S 5 1.87039 -0.24004 97(v),331(v),453(v),94(v) 396(g),114(r),123(r) 59. LP ( 1) S 6 1.97410 -0.47932 93(v),95(v),94(g),108(r) 204(v),138(v),183(v),176(v) 181(v),135(v),139(v),156(v) 182(v),186(v),199(v),148(v) 179(v),178(v),180(v),214(r) 458(g),203(v),939(r),731(r) 887(r),783(r),890(r),966(r) 741(r),786(r),949(r),116(r) 732(r),896(r),814(r),942(r) 761(r),733(r),940(r),792(r) 863(r),734(r) 60. LP ( 2) S 6 1.90365 -0.22434 98(v),392(v),93(v),95(v) 116(r),115(r),123(r),113(r) 61. BD ( 1)Co 1- S 2 1.90100 -0.30226 95(g),94(g),93(g),183(g) 138(g),458(v),204(g),181(g) 176(g),182(g),186(g),199(g) 148(g),731(r),178(g),179(g) 124(g),677(v),180(g),129(g) 214(g),670(v),887(r),156(g) 139(g),939(r),173(g),203(g) 674(v),132(g),166(g),185(g) 127(g),140(g),100(v),453(v) 145(g),158(g),184(g),160(g) 135(g),128(g),189(g),147(g) 272(v),202(g),212(g),164(g) 187(g),153(g),201(g),675(v) 136(g),146(g),163(g),151(g) 456(v),940(r),149(g),161(g) 209(g),741(r),150(g),460(v) 457(v),219(g),131(g),172(g) 687(v),890(r),229(g),463(v) 570(r),673(v),966(r),732(r) 195(g),230(g),194(g),567(r) 168(g),177(g),949(r),175(g) 942(r),174(g),465(v),197(g) 792(r),207(g),205(g),476(v) 271(v),96(g),734(r),472(v) 671(v),814(r),733(r) 1252(r),863(r),1339(r) 754(r),902(r),786(r),955(r) 844(r),899(r),846(r),896(r) 793(r),920(r),798(r),867(r) 761(r),967(r),941(r),808(r) 864(r),848(r),122(r) 1375(r),950(r),1283(r) 970(r),795(r),854(r),756(r) 918(r),914(r),751(r),816(r) 117(r),947(r),1369(r) 847(r),865(r),951(r),912(r) 760(r),835(r),802(r),116(r) 917(r),909(r),954(r),953(r) 938(r),860(r),943(r) 1259(r),813(r),758(r) 1255(r),807(r),735(r) 757(r),834(r),919(r),893(r) 746(r),1346(r),960(r) 859(r),894(r),969(r) 1383(r),815(r),961(r) 747(r),842(r),789(r),119(r) 1288(r),805(r),841(r) 962(r),736(r) 62. BD ( 1)Co 1- S 6 1.90224 -0.30260 95(g),93(g),94(g),138(g) 183(g),214(v),181(g),204(g) 176(g),148(g),182(g),186(g) 731(r),199(g),670(v),178(g) 179(g),129(g),180(g),124(g) 677(v),458(g),156(g),783(r) 173(g),203(g),674(v),939(r) 132(g),185(g),145(g),166(g) 127(g),139(g),202(g),108(v) 140(g),160(g),158(g),209(v) 135(g),184(g),147(g),201(g) 128(g),187(g),189(g),150(g) 394(v),675(v),212(v),151(g) 456(g),136(g),453(g),164(g) 153(g),732(r),163(g),218(v) 161(g),149(g),174(g),123(r) 741(r),949(r),687(v),207(g) 172(g),570(r),393(v),195(g) 230(v),229(v),673(v),205(g) 786(r),99(g),177(g),457(g) 942(r),678(v),216(v),733(r) 478(g),567(r),519(r),966(r) 798(r),940(r),734(r) 1339(r),899(r),896(r) 754(r),792(r),814(r) 1252(r),1283(r),761(r) 844(r),863(r),864(r),793(r) 890(r),914(r),846(r),785(r) 967(r),114(r),760(r),808(r) 947(r),789(r),854(r),121(r) 1288(r),918(r),902(r) 920(r),848(r),803(r),867(r) 751(r),756(r),962(r),860(r) 747(r),847(r),938(r) 1259(r),933(r),117(r) 838(r),865(r),758(r),813(r) 796(r),815(r),782(r),955(r) 941(r),943(r),912(r),746(r) 802(r),934(r),836(r),954(r) 1258(r),757(r),910(r) 742(r),841(r),909(r),748(r) 1289(r),1369(r),735(r) 795(r),784(r),736(r),807(r) 1298(r),1346(r),743(r) 906(r),970(r),916(r),805(r) 884(r),744(r),1270(r) 762(r),843(r),883(r),959(r) 797(r),893(r) 63. BD ( 1)Co 1- P 10 1.86892 -0.32168 94(g),93(g),95(g),138(g) 183(g),214(v),458(v),181(g) 204(g),176(g),182(g),186(g) 199(g),124(g),148(g),178(g) 179(g),180(g),156(g),887(r) 677(g),173(g),783(r),203(g) 127(g),139(g),129(g),566(v) 453(v),135(g),209(v),185(g) 670(g),147(g),514(v),618(v) 166(g),160(g),101(v),140(g) 109(v),96(v),99(v),108(g) 100(g),158(g),212(v),202(g) 145(g),184(g),150(g),104(g) 189(g),187(g),201(g),128(g) 456(v),105(v),136(g),161(g) 218(v),164(g),741(r),163(g) 149(g),151(g),153(g),570(v) 674(g),172(g),457(v),949(r) 174(g),836(r),207(g),168(g) 205(g),890(r),786(r),146(g) 731(r),675(g),464(v),230(v) 939(r),460(v),155(g),177(g) 195(g),476(v),197(g),175(g) 966(r),194(g),226(v),200(g) 142(g),792(r),229(v) 1110(r),472(v),463(v) 206(g),220(v),132(g),116(r) 215(v),863(r),848(r),896(r) 838(r),942(r),754(r),864(r) 732(r),940(r),899(r),734(r) 846(r),1283(r),867(r) 854(r),814(r),894(r) 1339(r),761(r),912(r) 798(r),123(r),808(r),119(r) 1252(r),793(r),844(r) 790(r),920(r),758(r) 1375(r),795(r),918(r) 938(r),967(r),756(r),760(r) 1288(r),955(r),954(r) 733(r),859(r),1369(r) 1314(r),747(r),736(r) 970(r),919(r),909(r),815(r) 962(r),813(r),114(r),947(r) 865(r),944(r),860(r),950(r) 934(r),811(r),802(r),812(r) 902(r),968(r),782(r),914(r) 858(r),746(r),842(r),122(r) 757(r),778(r),969(r),789(r) 1317(r),807(r),943(r) 961(r),1298(r),983(r) 898(r),1383(r),1255(r) 64. BD ( 1) S 2- S 3 1.98218 -0.49980 124(v),125(v),130(v),333(v) 132(v),215(g),274(g),783(r) 733(r),890(r),949(r),835(r) 889(r),123(r),1341(r) 966(r),838(r) 65. BD ( 1) S 3- S 4 1.98723 -0.49520 211(v),395(v),210(v),98(g) 96(g) 66. BD ( 1) S 4- S 5 1.98706 -0.49488 454(v),273(v),455(v),97(g) 99(g),460(v) 67. BD ( 1) S 5- S 6 1.98192 -0.50011 124(v),125(v),333(v),130(v) 132(v),459(g),396(g),785(r) 887(r),736(r) 68. BD ( 1) C 7- P 10 1.97765 -0.50547 108(g),104(g),566(v),620(v) 107(v),110(v),618(v),567(v) 95(g),993(v),619(v),939(r) 69. BD ( 1) C 7- H 16 1.98680 -0.48756 1049(v),95(v),1020(v) 673(v) 70. BD ( 1) C 7- H 17 1.98495 -0.48745 104(v),992(v),1050(v) 672(v),118(r) 71. BD ( 1) C 7- H 18 1.98106 -0.48104 108(v),673(v),992(v) 72. BD ( 1) C 8- P 10 1.97789 -0.49816 618(v),132(v),100(g),111(v) 514(v),102(v),108(g),619(v) 515(v),687(g),1080(v),95(g) 835(r) 73. BD ( 1) C 8- H 19 1.98423 -0.47597 95(v),1107(v),1136(v) 670(v),100(v) 74. BD ( 1) C 8- H 20 1.98393 -0.46683 108(v),1079(v),1136(v) 672(v),670(v) 75. BD ( 1) C 8- H 21 1.98262 -0.46974 100(v),1108(v),672(v) 1079(v) 76. BD ( 1) C 9- P 10 1.97743 -0.50632 100(g),566(v),104(g),106(v) 103(v),514(v),515(v),95(g) 130(v),568(v),516(v) 1167(v),567(v),1224(v) 116(r),731(r) 77. BD ( 1) C 9- H 22 1.98695 -0.48935 95(v),1223(v),1194(v) 672(v) 78. BD ( 1) C 9- H 23 1.98201 -0.48373 100(v),673(v),1166(v) 1223(v) 79. BD ( 1) C 9- H 24 1.98540 -0.49032 104(v),1166(v),1195(v) 115(r) ------ non-Lewis ---------------------------------- 93. BD*( 1)Co 1- S 2 0.49388 0.11244 94. BD*( 1)Co 1- S 6 0.50289 0.11324 95. BD*( 1)Co 1- P 10 0.48385 0.12146 96. BD*( 1) S 2- S 3 0.06965 0.09481 97. BD*( 1) S 3- S 4 0.11647 0.05435 98. BD*( 1) S 4- S 5 0.11697 0.05471 99. BD*( 1) S 5- S 6 0.06916 0.09662 100. BD*( 1) C 7- P 10 0.05847 0.18142 101. BD*( 1) C 7- H 16 0.01023 0.33186 102. BD*( 1) C 7- H 17 0.00551 0.33474 103. BD*( 1) C 7- H 18 0.00567 0.34294 104. BD*( 1) C 8- P 10 0.04571 0.18724 105. BD*( 1) C 8- H 19 0.00870 0.33654 106. BD*( 1) C 8- H 20 0.00669 0.36672 107. BD*( 1) C 8- H 21 0.00520 0.35708 108. BD*( 1) C 9- P 10 0.05798 0.18176 109. BD*( 1) C 9- H 22 0.01027 0.33116 110. BD*( 1) C 9- H 23 0.00498 0.33484 111. BD*( 1) C 9- H 24 0.00559 0.33378 124. RY ( 1)Co 1 0.01741 1.51533 125. RY ( 2)Co 1 0.00757 1.51803 126. RY ( 3)Co 1 0.00535 1.43777 127. RY ( 4)Co 1 0.00483 2.00163 128. RY ( 5)Co 1 0.00446 1.35285 129. RY ( 6)Co 1 0.00239 2.51671 130. RY ( 7)Co 1 0.00204 1.59986 131. RY ( 8)Co 1 0.00184 1.91463 132. RY ( 9)Co 1 0.00168 2.19861 133. RY (10)Co 1 0.00154 2.25230 134. RY (11)Co 1 0.00142 1.74833 135. RY (12)Co 1 0.00109 2.54284 136. RY (13)Co 1 0.00083 1.88292 137. RY (14)Co 1 0.00070 1.68519 138. RY (15)Co 1 0.00058 3.93902 139. RY (16)Co 1 0.00053 2.38117 140. RY (17)Co 1 0.00036 2.69339 141. RY (18)Co 1 0.00027 2.99224 142. RY (19)Co 1 0.00024 2.79765 143. RY (20)Co 1 0.00015 2.48151 144. RY (21)Co 1 0.00015 2.74263 145. RY (22)Co 1 0.00010 2.67529 146. RY (23)Co 1 0.00008 2.67786 147. RY (24)Co 1 0.00007 3.63365 148. RY (25)Co 1 0.00005 5.30573 149. RY (26)Co 1 0.00004 3.09176 150. RY (27)Co 1 0.00003 3.60219 151. RY (28)Co 1 0.00002 3.18191 152. RY (29)Co 1 0.00002 3.44338 153. RY (30)Co 1 0.00002 3.76537 154. RY (31)Co 1 0.00002 3.47637 155. RY (32)Co 1 0.00001 3.36928 156. RY (33)Co 1 0.00001 4.99750 157. RY (34)Co 1 0.00001 4.44294 158. RY (35)Co 1 0.00000 7.08852 159. RY (36)Co 1 0.00000 6.46747 160. RY (37)Co 1 0.00000 5.25380 161. RY (38)Co 1 0.00000 6.20197 162. RY (39)Co 1 0.00001 4.36173 163. RY (40)Co 1 0.00001 4.87228 164. RY (41)Co 1 0.00000 7.70567 165. RY (42)Co 1 0.00000 4.81901 166. RY (43)Co 1 0.00000 10.15926 167. RY (44)Co 1 0.00000 13.83701 168. RY (45)Co 1 0.00000 11.00516 169. RY (46)Co 1 0.00000 6.74492 170. RY (47)Co 1 0.00000 10.01590 171. RY (48)Co 1 0.00000 6.56402 172. RY (49)Co 1 0.00000 7.29099 173. RY (50)Co 1 0.00000 6.23319 174. RY (51)Co 1 0.00000 5.69492 175. RY (52)Co 1 0.00000 6.95273 176. RY (53)Co 1 0.00000 110.04931 177. RY (54)Co 1 0.00000 23.55096 178. RY (55)Co 1 0.00000 119.09787 179. RY (56)Co 1 0.00000 51.38326 180. RY (57)Co 1 0.00000 121.32101 181. RY (58)Co 1 0.00000 246.68351 182. RY (59)Co 1 0.00000 60.36430 183. RY (60)Co 1 0.00000 111.43821 184. RY (61)Co 1 0.00000 25.30272 185. RY (62)Co 1 0.00000 23.70319 186. RY (63)Co 1 0.00000 152.95290 187. RY (64)Co 1 0.00000 20.49952 188. RY (65)Co 1 0.00000 22.62277 189. RY (66)Co 1 0.00000 12.53107 190. RY (67)Co 1 0.00000 15.19763 191. RY (68)Co 1 0.00000 12.59353 192. RY (69)Co 1 0.00000 8.04160 193. RY (70)Co 1 0.00000 13.02818 194. RY (71)Co 1 0.00000 10.02783 195. RY (72)Co 1 0.00000 10.72218 196. RY (73)Co 1 0.00000 9.70396 197. RY (74)Co 1 0.00000 8.41361 198. RY (75)Co 1 0.00000 9.25384 199. RY (76)Co 1 0.00000 13.77066 200. RY (77)Co 1 0.00000 9.42428 201. RY (78)Co 1 0.00000 9.08836 202. RY (79)Co 1 0.00000 7.84102 203. RY (80)Co 1 0.00000 8.35932 204. RY (81)Co 1 0.00000 11.04173 205. RY (82)Co 1 0.00000 10.37792 206. RY (83)Co 1 0.00000 8.80473 207. RY (84)Co 1 0.00000 12.06922 208. RY (85)Co 1 0.00000 8.40067 209. RY ( 1) S 2 0.00724 1.12421 210. RY ( 2) S 2 0.00360 1.08400 211. RY ( 3) S 2 0.00321 1.34436 212. RY ( 4) S 2 0.00229 1.65337 213. RY ( 5) S 2 0.00134 2.04963 214. RY ( 6) S 2 0.00105 2.53108 215. RY ( 7) S 2 0.00077 2.34090 216. RY ( 8) S 2 0.00053 1.80452 217. RY ( 9) S 2 0.00047 1.62585 218. RY (10) S 2 0.00023 1.33412 219. RY (11) S 2 0.00021 2.07009 220. RY (12) S 2 0.00013 2.46279 221. RY (13) S 2 0.00008 1.66907 222. RY (14) S 2 0.00008 1.92681 223. RY (15) S 2 0.00005 1.85796 224. RY (16) S 2 0.00004 1.46100 225. RY (17) S 2 0.00003 1.88924 226. RY (18) S 2 0.00003 3.56203 227. RY (19) S 2 0.00002 2.42052 228. RY (20) S 2 0.00001 2.39437 229. RY (21) S 2 0.00001 1.94908 230. RY (22) S 2 0.00001 2.64187 231. RY (23) S 2 0.00001 2.77483 232. RY (24) S 2 0.00001 3.17312 233. RY (25) S 2 0.00001 3.05933 234. RY (26) S 2 0.00000 4.53543 235. RY (27) S 2 0.00000 5.18702 236. RY (28) S 2 0.00000 5.55522 237. RY (29) S 2 0.00000 4.11855 238. RY (30) S 2 0.00000 4.82574 239. RY (31) S 2 0.00000 5.71407 240. RY (32) S 2 0.00000 5.45644 241. RY (33) S 2 0.00000 4.58584 242. RY (34) S 2 0.00000 5.33291 243. RY (35) S 2 0.00000 4.55036 244. RY (36) S 2 0.00000 3.84174 245. RY (37) S 2 0.00000 4.36380 246. RY (38) S 2 0.00000 4.45256 247. RY (39) S 2 0.00000 3.88888 248. RY (40) S 2 0.00000 2.68792 249. RY (41) S 2 0.00000 104.65602 250. RY (42) S 2 0.00000 388.53553 251. RY (43) S 2 0.00000 29.32000 252. RY (44) S 2 0.00000 27.12842 253. RY (45) S 2 0.00000 15.19946 254. RY (46) S 2 0.00000 22.74494 255. RY (47) S 2 0.00000 14.95532 256. RY (48) S 2 0.00000 6.79297 257. RY (49) S 2 0.00000 6.91408 258. RY (50) S 2 0.00000 6.04560 259. RY (51) S 2 0.00000 10.96830 260. RY (52) S 2 0.00000 8.20630 261. RY (53) S 2 0.00000 8.80301 262. RY (54) S 2 0.00000 5.30455 263. RY (55) S 2 0.00000 6.13789 264. RY (56) S 2 0.00000 5.44359 265. RY (57) S 2 0.00000 4.32474 266. RY (58) S 2 0.00000 7.53581 267. RY (59) S 2 0.00000 6.54153 268. RY (60) S 2 0.00000 4.38314 269. RY (61) S 2 0.00000 6.72247 270. RY ( 1) S 3 0.01931 0.72244 271. RY ( 2) S 3 0.01042 0.68644 272. RY ( 3) S 3 0.00629 0.58883 273. RY ( 4) S 3 0.00311 0.84878 274. RY ( 5) S 3 0.00082 1.65738 275. RY ( 6) S 3 0.00042 1.04280 276. RY ( 7) S 3 0.00036 1.66867 277. RY ( 8) S 3 0.00029 0.79550 278. RY ( 9) S 3 0.00014 1.82614 279. RY (10) S 3 0.00011 1.64601 280. RY (11) S 3 0.00004 1.70803 281. RY (12) S 3 0.00003 1.88844 282. RY (13) S 3 0.00003 1.88062 283. RY (14) S 3 0.00002 2.31782 284. RY (15) S 3 0.00001 3.52320 285. RY (16) S 3 0.00001 3.25048 286. RY (17) S 3 0.00001 3.44756 287. RY (18) S 3 0.00001 2.60392 288. RY (19) S 3 0.00000 2.63004 289. RY (20) S 3 0.00000 3.83875 290. RY (21) S 3 0.00000 4.04892 291. RY (22) S 3 0.00000 4.68155 292. RY (23) S 3 0.00000 4.59550 293. RY (24) S 3 0.00000 4.00023 294. RY (25) S 3 0.00000 5.71008 295. RY (26) S 3 0.00000 6.44319 296. RY (27) S 3 0.00000 4.44348 297. RY (28) S 3 0.00000 3.40383 298. RY (29) S 3 0.00000 4.06235 299. RY (30) S 3 0.00000 5.73085 300. RY (31) S 3 0.00000 4.39448 301. RY (32) S 3 0.00000 5.40405 302. RY (33) S 3 0.00000 4.61447 303. RY (34) S 3 0.00000 4.64714 304. RY (35) S 3 0.00000 5.43785 305. RY (36) S 3 0.00000 3.80681 306. RY (37) S 3 0.00000 4.95441 307. RY (38) S 3 0.00000 3.89778 308. RY (39) S 3 0.00000 4.40945 309. RY (40) S 3 0.00000 3.10884 310. RY (41) S 3 0.00000 2.95910 311. RY (42) S 3 0.00000 3.82661 312. RY (43) S 3 0.00000 4.42583 313. RY (44) S 3 0.00000 3.99592 314. RY (45) S 3 0.00000 5.16565 315. RY (46) S 3 0.00000 2.87953 316. RY (47) S 3 0.00000 69.89405 317. RY (48) S 3 0.00000 367.95164 318. RY (49) S 3 0.00000 53.57287 319. RY (50) S 3 0.00000 28.64587 320. RY (51) S 3 0.00000 49.12964 321. RY (52) S 3 0.00000 24.46513 322. RY (53) S 3 0.00000 12.51969 323. RY (54) S 3 0.00000 7.56991 324. RY (55) S 3 0.00000 10.48174 325. RY (56) S 3 0.00000 5.69020 326. RY (57) S 3 0.00000 7.22786 327. RY (58) S 3 0.00000 6.34157 328. RY (59) S 3 0.00000 4.72090 329. RY (60) S 3 0.00000 5.69377 330. RY (61) S 3 0.00000 5.14460 331. RY ( 1) S 4 0.01597 0.70470 332. RY ( 2) S 4 0.00839 0.68969 333. RY ( 3) S 4 0.00412 0.88021 334. RY ( 4) S 4 0.00297 0.76604 335. RY ( 5) S 4 0.00062 1.65578 336. RY ( 6) S 4 0.00047 0.80432 337. RY ( 7) S 4 0.00036 0.84506 338. RY ( 8) S 4 0.00024 1.97770 339. RY ( 9) S 4 0.00010 2.08519 340. RY (10) S 4 0.00005 1.97397 341. RY (11) S 4 0.00004 1.46119 342. RY (12) S 4 0.00002 1.94424 343. RY (13) S 4 0.00001 2.41134 344. RY (14) S 4 0.00001 2.16909 345. RY (15) S 4 0.00000 1.81744 346. RY (16) S 4 0.00000 3.53986 347. RY (17) S 4 0.00001 3.24980 348. RY (18) S 4 0.00000 7.67322 349. RY (19) S 4 0.00000 4.09770 350. RY (20) S 4 0.00000 4.77361 351. RY (21) S 4 0.00000 6.56894 352. RY (22) S 4 0.00000 4.64140 353. RY (23) S 4 0.00000 4.27772 354. RY (24) S 4 0.00000 5.64650 355. RY (25) S 4 0.00000 5.06610 356. RY (26) S 4 0.00000 4.34280 357. RY (27) S 4 0.00000 4.90996 358. RY (28) S 4 0.00000 4.38044 359. RY (29) S 4 0.00000 3.98202 360. RY (30) S 4 0.00000 4.45547 361. RY (31) S 4 0.00000 4.09798 362. RY (32) S 4 0.00000 5.10271 363. RY (33) S 4 0.00000 5.09835 364. RY (34) S 4 0.00000 3.99865 365. RY (35) S 4 0.00000 3.49010 366. RY (36) S 4 0.00000 3.16450 367. RY (37) S 4 0.00000 4.27792 368. RY (38) S 4 0.00000 4.90422 369. RY (39) S 4 0.00000 5.21069 370. RY (40) S 4 0.00000 2.67932 371. RY (41) S 4 0.00000 3.51723 372. RY (42) S 4 0.00000 3.14274 373. RY (43) S 4 0.00000 3.10075 374. RY (44) S 4 0.00000 5.69350 375. RY (45) S 4 0.00000 3.96179 376. RY (46) S 4 0.00000 3.86957 377. RY (47) S 4 0.00000 3.87253 378. RY (48) S 4 0.00000 3.94469 379. RY (49) S 4 0.00000 64.81191 380. RY (50) S 4 0.00000 387.16844 381. RY (51) S 4 0.00000 38.28483 382. RY (52) S 4 0.00000 24.10570 383. RY (53) S 4 0.00000 32.95301 384. RY (54) S 4 0.00000 19.91848 385. RY (55) S 4 0.00000 17.10559 386. RY (56) S 4 0.00000 15.27242 387. RY (57) S 4 0.00000 8.08100 388. RY (58) S 4 0.00000 5.86011 389. RY (59) S 4 0.00000 13.85574 390. RY (60) S 4 0.00000 5.36657 391. RY (61) S 4 0.00000 10.16717 392. RY ( 1) S 5 0.01929 0.72276 393. RY ( 2) S 5 0.01050 0.67406 394. RY ( 3) S 5 0.00628 0.58778 395. RY ( 4) S 5 0.00313 0.82803 396. RY ( 5) S 5 0.00078 1.64132 397. RY ( 6) S 5 0.00042 0.97756 398. RY ( 7) S 5 0.00037 1.66229 399. RY ( 8) S 5 0.00029 0.82817 400. RY ( 9) S 5 0.00013 1.77801 401. RY (10) S 5 0.00010 1.67430 402. RY (11) S 5 0.00004 1.61858 403. RY (12) S 5 0.00003 1.77922 404. RY (13) S 5 0.00002 1.83924 405. RY (14) S 5 0.00002 2.36950 406. RY (15) S 5 0.00001 3.76094 407. RY (16) S 5 0.00001 2.85587 408. RY (17) S 5 0.00001 2.89765 409. RY (18) S 5 0.00001 2.94681 410. RY (19) S 5 0.00000 4.40177 411. RY (20) S 5 0.00000 4.12235 412. RY (21) S 5 0.00000 5.19878 413. RY (22) S 5 0.00000 5.45556 414. RY (23) S 5 0.00000 4.85555 415. RY (24) S 5 0.00000 3.71930 416. RY (25) S 5 0.00000 3.70398 417. RY (26) S 5 0.00000 4.75863 418. RY (27) S 5 0.00000 5.19289 419. RY (28) S 5 0.00000 3.51267 420. RY (29) S 5 0.00000 4.11947 421. RY (30) S 5 0.00000 4.31199 422. RY (31) S 5 0.00000 6.64621 423. RY (32) S 5 0.00000 4.79936 424. RY (33) S 5 0.00000 3.93629 425. RY (34) S 5 0.00000 4.42647 426. RY (35) S 5 0.00000 4.66850 427. RY (36) S 5 0.00000 4.78369 428. RY (37) S 5 0.00000 3.90518 429. RY (38) S 5 0.00000 4.34007 430. RY (39) S 5 0.00000 3.46516 431. RY (40) S 5 0.00000 3.46494 432. RY (41) S 5 0.00000 5.22985 433. RY (42) S 5 0.00000 3.33118 434. RY (43) S 5 0.00000 2.82664 435. RY (44) S 5 0.00000 4.52069 436. RY (45) S 5 0.00000 3.72115 437. RY (46) S 5 0.00000 3.00536 438. RY (47) S 5 0.00000 70.52846 439. RY (48) S 5 0.00000 404.68501 440. RY (49) S 5 0.00000 29.10415 441. RY (50) S 5 0.00000 21.27660 442. RY (51) S 5 0.00000 17.75076 443. RY (52) S 5 0.00000 34.34384 444. RY (53) S 5 0.00000 21.55378 445. RY (54) S 5 0.00000 9.89911 446. RY (55) S 5 0.00000 11.78950 447. RY (56) S 5 0.00000 5.76872 448. RY (57) S 5 0.00000 9.63143 449. RY (58) S 5 0.00000 6.76240 450. RY (59) S 5 0.00000 7.23765 451. RY (60) S 5 0.00000 5.44832 452. RY (61) S 5 0.00000 4.92041 453. RY ( 1) S 6 0.00732 1.14103 454. RY ( 2) S 6 0.00350 1.17779 455. RY ( 3) S 6 0.00309 1.23829 456. RY ( 4) S 6 0.00228 1.59705 457. RY ( 5) S 6 0.00127 2.33104 458. RY ( 6) S 6 0.00105 2.41888 459. RY ( 7) S 6 0.00068 2.23914 460. RY ( 8) S 6 0.00060 1.87860 461. RY ( 9) S 6 0.00045 1.51904 462. RY (10) S 6 0.00024 1.65608 463. RY (11) S 6 0.00019 2.14729 464. RY (12) S 6 0.00013 2.27476 465. RY (13) S 6 0.00010 1.76034 466. RY (14) S 6 0.00007 2.45780 467. RY (15) S 6 0.00005 1.54670 468. RY (16) S 6 0.00004 1.73353 469. RY (17) S 6 0.00004 1.96385 470. RY (18) S 6 0.00003 2.38752 471. RY (19) S 6 0.00002 3.66435 472. RY (20) S 6 0.00001 1.98482 473. RY (21) S 6 0.00001 1.87252 474. RY (22) S 6 0.00001 2.65562 475. RY (23) S 6 0.00001 3.55120 476. RY (24) S 6 0.00001 2.65482 477. RY (25) S 6 0.00000 2.61080 478. RY (26) S 6 0.00000 2.89302 479. RY (27) S 6 0.00000 6.52594 480. RY (28) S 6 0.00000 5.90985 481. RY (29) S 6 0.00000 4.20443 482. RY (30) S 6 0.00000 4.42746 483. RY (31) S 6 0.00000 4.25236 484. RY (32) S 6 0.00000 4.75820 485. RY (33) S 6 0.00000 5.18723 486. RY (34) S 6 0.00000 4.83106 487. RY (35) S 6 0.00000 4.03493 488. RY (36) S 6 0.00000 4.64001 489. RY (37) S 6 0.00000 5.42831 490. RY (38) S 6 0.00000 4.07202 491. RY (39) S 6 0.00000 4.34865 492. RY (40) S 6 0.00000 4.52033 493. RY (41) S 6 0.00000 4.40273 494. RY (42) S 6 0.00000 70.01180 495. RY (43) S 6 0.00000 390.64467 496. RY (44) S 6 0.00000 53.74441 497. RY (45) S 6 0.00000 36.79823 498. RY (46) S 6 0.00000 19.79324 499. RY (47) S 6 0.00000 9.18689 500. RY (48) S 6 0.00000 18.27814 501. RY (49) S 6 0.00000 8.73109 502. RY (50) S 6 0.00000 9.52960 503. RY (51) S 6 0.00000 9.59186 504. RY (52) S 6 0.00000 7.03462 505. RY (53) S 6 0.00000 8.62923 506. RY (54) S 6 0.00000 4.92920 507. RY (55) S 6 0.00000 7.54053 508. RY (56) S 6 0.00000 6.50714 509. RY (57) S 6 0.00000 5.28903 510. RY (58) S 6 0.00000 8.56322 511. RY (59) S 6 0.00000 4.78271 512. RY (60) S 6 0.00000 4.65223 513. RY (61) S 6 0.00000 6.66132 514. RY ( 1) C 7 0.00237 1.76383 515. RY ( 2) C 7 0.00090 3.17477 516. RY ( 3) C 7 0.00080 1.29274 517. RY ( 4) C 7 0.00043 1.62363 518. RY ( 5) C 7 0.00022 1.64757 519. RY ( 6) C 7 0.00015 1.32958 520. RY ( 7) C 7 0.00011 1.16316 521. RY ( 8) C 7 0.00007 1.83017 522. RY ( 9) C 7 0.00005 2.94311 523. RY (10) C 7 0.00004 1.72057 524. RY (11) C 7 0.00002 1.79841 525. RY (12) C 7 0.00001 2.56723 526. RY (13) C 7 0.00001 2.54051 527. RY (14) C 7 0.00001 2.34455 528. RY (15) C 7 0.00001 2.77802 529. RY (16) C 7 0.00001 5.86507 530. RY (17) C 7 0.00001 4.45881 531. RY (18) C 7 0.00000 6.68558 532. RY (19) C 7 0.00000 6.86132 533. RY (20) C 7 0.00000 6.09512 534. RY (21) C 7 0.00000 8.51843 535. RY (22) C 7 0.00000 7.96338 536. RY (23) C 7 0.00000 7.35692 537. RY (24) C 7 0.00000 6.48314 538. RY (25) C 7 0.00000 7.47539 539. RY (26) C 7 0.00000 6.44564 540. RY (27) C 7 0.00000 6.36015 541. RY (28) C 7 0.00000 6.04356 542. RY (29) C 7 0.00000 5.78166 543. RY (30) C 7 0.00000 5.13077 544. RY (31) C 7 0.00000 8.41637 545. RY (32) C 7 0.00000 5.87654 546. RY (33) C 7 0.00000 4.30709 547. RY (34) C 7 0.00000 3.63278 548. RY (35) C 7 0.00000 3.98421 549. RY (36) C 7 0.00000 4.50272 550. RY (37) C 7 0.00000 3.84543 551. RY (38) C 7 0.00000 4.12098 552. RY (39) C 7 0.00000 3.70587 553. RY (40) C 7 0.00000 105.98116 554. RY (41) C 7 0.00000 25.04306 555. RY (42) C 7 0.00000 7.09077 556. RY (43) C 7 0.00000 8.50284 557. RY (44) C 7 0.00000 9.27480 558. RY (45) C 7 0.00000 8.00854 559. RY (46) C 7 0.00000 7.13394 560. RY (47) C 7 0.00000 8.93608 561. RY (48) C 7 0.00000 7.88453 562. RY (49) C 7 0.00000 7.17949 563. RY (50) C 7 0.00000 7.23795 564. RY (51) C 7 0.00000 8.31556 565. RY (52) C 7 0.00000 6.84326 566. RY ( 1) C 8 0.00330 1.83996 567. RY ( 2) C 8 0.00106 2.93641 568. RY ( 3) C 8 0.00094 1.18389 569. RY ( 4) C 8 0.00027 1.99827 570. RY ( 5) C 8 0.00023 1.32754 571. RY ( 6) C 8 0.00018 1.52195 572. RY ( 7) C 8 0.00011 2.09613 573. RY ( 8) C 8 0.00009 1.21271 574. RY ( 9) C 8 0.00007 1.88113 575. RY (10) C 8 0.00005 1.98388 576. RY (11) C 8 0.00003 2.75750 577. RY (12) C 8 0.00002 2.66981 578. RY (13) C 8 0.00002 2.58802 579. RY (14) C 8 0.00001 3.63064 580. RY (15) C 8 0.00001 3.05114 581. RY (16) C 8 0.00001 6.89823 582. RY (17) C 8 0.00000 2.30305 583. RY (18) C 8 0.00000 7.80446 584. RY (19) C 8 0.00000 6.48042 585. RY (20) C 8 0.00000 6.68527 586. RY (21) C 8 0.00000 7.91181 587. RY (22) C 8 0.00000 6.64732 588. RY (23) C 8 0.00000 6.49939 589. RY (24) C 8 0.00000 7.59412 590. RY (25) C 8 0.00000 6.52166 591. RY (26) C 8 0.00000 5.57825 592. RY (27) C 8 0.00000 6.18203 593. RY (28) C 8 0.00000 6.83260 594. RY (29) C 8 0.00000 5.44632 595. RY (30) C 8 0.00000 8.37353 596. RY (31) C 8 0.00000 7.22937 597. RY (32) C 8 0.00000 6.72377 598. RY (33) C 8 0.00000 4.72477 599. RY (34) C 8 0.00000 4.13637 600. RY (35) C 8 0.00000 4.53671 601. RY (36) C 8 0.00000 4.53109 602. RY (37) C 8 0.00000 3.75247 603. RY (38) C 8 0.00000 3.82706 604. RY (39) C 8 0.00000 3.33373 605. RY (40) C 8 0.00000 118.10954 606. RY (41) C 8 0.00000 7.93785 607. RY (42) C 8 0.00000 7.95799 608. RY (43) C 8 0.00000 7.83385 609. RY (44) C 8 0.00000 7.94821 610. RY (45) C 8 0.00000 7.62060 611. RY (46) C 8 0.00000 12.55939 612. RY (47) C 8 0.00000 8.10309 613. RY (48) C 8 0.00000 6.65474 614. RY (49) C 8 0.00000 9.40768 615. RY (50) C 8 0.00000 7.63850 616. RY (51) C 8 0.00000 7.37602 617. RY (52) C 8 0.00000 7.02713 618. RY ( 1) C 9 0.00228 1.76369 619. RY ( 2) C 9 0.00091 3.00139 620. RY ( 3) C 9 0.00078 1.39756 621. RY ( 4) C 9 0.00042 1.55201 622. RY ( 5) C 9 0.00020 1.62320 623. RY ( 6) C 9 0.00013 1.15681 624. RY ( 7) C 9 0.00011 1.61447 625. RY ( 8) C 9 0.00006 1.42205 626. RY ( 9) C 9 0.00005 2.81513 627. RY (10) C 9 0.00004 2.16194 628. RY (11) C 9 0.00002 1.83040 629. RY (12) C 9 0.00002 2.87738 630. RY (13) C 9 0.00001 2.46851 631. RY (14) C 9 0.00001 3.15737 632. RY (15) C 9 0.00001 2.53512 633. RY (16) C 9 0.00001 5.38731 634. RY (17) C 9 0.00000 3.92263 635. RY (18) C 9 0.00000 4.01676 636. RY (19) C 9 0.00000 7.87941 637. RY (20) C 9 0.00000 7.52304 638. RY (21) C 9 0.00000 9.68408 639. RY (22) C 9 0.00000 7.62972 640. RY (23) C 9 0.00000 6.54921 641. RY (24) C 9 0.00000 6.28619 642. RY (25) C 9 0.00000 5.94002 643. RY (26) C 9 0.00000 6.39533 644. RY (27) C 9 0.00000 7.32568 645. RY (28) C 9 0.00000 6.28420 646. RY (29) C 9 0.00000 6.29017 647. RY (30) C 9 0.00000 7.85391 648. RY (31) C 9 0.00000 6.56860 649. RY (32) C 9 0.00000 5.07050 650. RY (33) C 9 0.00000 5.71617 651. RY (34) C 9 0.00000 5.03277 652. RY (35) C 9 0.00000 4.15875 653. RY (36) C 9 0.00000 4.04425 654. RY (37) C 9 0.00000 3.77359 655. RY (38) C 9 0.00000 4.32618 656. RY (39) C 9 0.00000 4.02376 657. RY (40) C 9 0.00000 98.08705 658. RY (41) C 9 0.00000 8.15964 659. RY (42) C 9 0.00000 33.42447 660. RY (43) C 9 0.00000 7.11082 661. RY (44) C 9 0.00000 7.35179 662. RY (45) C 9 0.00000 7.35844 663. RY (46) C 9 0.00000 6.81232 664. RY (47) C 9 0.00000 7.95855 665. RY (48) C 9 0.00000 7.64650 666. RY (49) C 9 0.00000 8.76145 667. RY (50) C 9 0.00000 6.44617 668. RY (51) C 9 0.00000 7.44079 669. RY (52) C 9 0.00000 7.92779 670. RY ( 1) P 10 0.00787 1.64250 671. RY ( 2) P 10 0.00716 1.38450 672. RY ( 3) P 10 0.00625 1.25684 673. RY ( 4) P 10 0.00582 1.33855 674. RY ( 5) P 10 0.00509 1.54729 675. RY ( 6) P 10 0.00331 1.46438 676. RY ( 7) P 10 0.00300 1.49573 677. RY ( 8) P 10 0.00208 1.47940 678. RY ( 9) P 10 0.00132 2.01816 679. RY (10) P 10 0.00106 1.63691 680. RY (11) P 10 0.00043 2.77963 681. RY (12) P 10 0.00032 2.98689 682. RY (13) P 10 0.00029 2.52475 683. RY (14) P 10 0.00022 3.02340 684. RY (15) P 10 0.00020 2.95357 685. RY (16) P 10 0.00019 2.98956 686. RY (17) P 10 0.00015 2.54519 687. RY (18) P 10 0.00012 2.62505 688. RY (19) P 10 0.00007 3.00444 689. RY (20) P 10 0.00006 2.90033 690. RY (21) P 10 0.00003 4.04361 691. RY (22) P 10 0.00002 4.61805 692. RY (23) P 10 0.00002 3.67671 693. RY (24) P 10 0.00002 4.30077 694. RY (25) P 10 0.00001 5.14539 695. RY (26) P 10 0.00001 3.42666 696. RY (27) P 10 0.00001 4.09630 697. RY (28) P 10 0.00001 4.33078 698. RY (29) P 10 0.00000 4.45490 699. RY (30) P 10 0.00000 5.03122 700. RY (31) P 10 0.00000 3.89869 701. RY (32) P 10 0.00000 5.50443 702. RY (33) P 10 0.00000 5.99081 703. RY (34) P 10 0.00000 4.82683 704. RY (35) P 10 0.00000 5.47180 705. RY (36) P 10 0.00000 5.10482 706. RY (37) P 10 0.00000 131.98082 707. RY (38) P 10 0.00000 289.50223 708. RY (39) P 10 0.00000 10.02868 709. RY (40) P 10 0.00000 6.58516 710. RY (41) P 10 0.00000 13.68412 711. RY (42) P 10 0.00000 7.57692 712. RY (43) P 10 0.00000 6.79303 713. RY (44) P 10 0.00000 8.89347 714. RY (45) P 10 0.00000 7.95622 715. RY (46) P 10 0.00000 6.43265 716. RY (47) P 10 0.00000 6.49107 717. RY (48) P 10 0.00000 4.84424 718. RY (49) P 10 0.00000 9.88706 719. RY (50) P 10 0.00000 5.76586 720. RY (51) P 10 0.00000 10.57168 721. RY (52) P 10 0.00000 5.19157 722. RY (53) P 10 0.00000 8.19906 723. RY (54) P 10 0.00000 4.59814 724. RY (55) P 10 0.00000 6.73942 725. RY (56) P 10 0.00000 5.29395 726. RY (57) P 10 0.00000 3.86508 727. RY (58) P 10 0.00000 4.85715 728. RY (59) P 10 0.00000 5.48884 729. RY (60) P 10 0.00000 5.20912 730. RY (61) P 10 0.00000 5.82958 991. RY ( 1) H 16 0.00118 1.16331 992. RY ( 2) H 16 0.00072 2.70469 993. RY ( 3) H 16 0.00040 2.85382 994. RY ( 4) H 16 0.00021 1.62750 995. RY ( 5) H 16 0.00005 2.64667 996. RY ( 6) H 16 0.00001 4.18623 997. RY ( 7) H 16 0.00001 4.42110 998. RY ( 8) H 16 0.00001 3.13638 999. RY ( 9) H 16 0.00000 8.03373 1000. RY (10) H 16 0.00000 4.77370 1001. RY (11) H 16 0.00000 7.94708 1002. RY (12) H 16 0.00000 7.70807 1003. RY (13) H 16 0.00000 8.66327 1004. RY (14) H 16 0.00000 6.98755 1005. RY (15) H 16 0.00000 6.29587 1006. RY (16) H 16 0.00000 7.37402 1007. RY (17) H 16 0.00000 6.62318 1008. RY (18) H 16 0.00000 6.99311 1009. RY (19) H 16 0.00000 6.21224 1010. RY (20) H 16 0.00000 5.73133 1011. RY (21) H 16 0.00000 5.34333 1012. RY (22) H 16 0.00000 6.07778 1013. RY (23) H 16 0.00000 5.65308 1014. RY (24) H 16 0.00000 9.20745 1015. RY (25) H 16 0.00000 8.78286 1016. RY (26) H 16 0.00000 8.21397 1017. RY (27) H 16 0.00000 8.23797 1018. RY (28) H 16 0.00000 7.96022 1019. RY (29) H 16 0.00000 7.91153 1020. RY ( 1) H 17 0.00065 2.88420 1021. RY ( 2) H 17 0.00052 3.00016 1022. RY ( 3) H 17 0.00027 2.18830 1023. RY ( 4) H 17 0.00012 1.68670 1024. RY ( 5) H 17 0.00007 2.80439 1025. RY ( 6) H 17 0.00003 3.63626 1026. RY ( 7) H 17 0.00002 4.20281 1027. RY ( 8) H 17 0.00001 5.46052 1028. RY ( 9) H 17 0.00001 5.77444 1029. RY (10) H 17 0.00000 4.35620 1030. RY (11) H 17 0.00000 8.19853 1031. RY (12) H 17 0.00000 6.79138 1032. RY (13) H 17 0.00000 6.73966 1033. RY (14) H 17 0.00000 7.68804 1034. RY (15) H 17 0.00000 6.13334 1035. RY (16) H 17 0.00000 6.97400 1036. RY (17) H 17 0.00000 6.80359 1037. RY (18) H 17 0.00000 6.14669 1038. RY (19) H 17 0.00000 4.95849 1039. RY (20) H 17 0.00000 6.08305 1040. RY (21) H 17 0.00000 8.00860 1041. RY (22) H 17 0.00000 4.61544 1042. RY (23) H 17 0.00000 9.53837 1043. RY (24) H 17 0.00000 8.72463 1044. RY (25) H 17 0.00000 9.41272 1045. RY (26) H 17 0.00000 8.82475 1046. RY (27) H 17 0.00000 7.58434 1047. RY (28) H 17 0.00000 7.35441 1048. RY (29) H 17 0.00000 7.49008 1049. RY ( 1) H 18 0.00071 2.71890 1050. RY ( 2) H 18 0.00062 2.40364 1051. RY ( 3) H 18 0.00037 2.33918 1052. RY ( 4) H 18 0.00012 1.80872 1053. RY ( 5) H 18 0.00006 3.10920 1054. RY ( 6) H 18 0.00003 3.81827 1055. RY ( 7) H 18 0.00001 5.14631 1056. RY ( 8) H 18 0.00001 3.91937 1057. RY ( 9) H 18 0.00001 5.40120 1058. RY (10) H 18 0.00000 5.65280 1059. RY (11) H 18 0.00000 7.48948 1060. RY (12) H 18 0.00000 7.06545 1061. RY (13) H 18 0.00000 6.44926 1062. RY (14) H 18 0.00000 7.89140 1063. RY (15) H 18 0.00000 6.53772 1064. RY (16) H 18 0.00000 6.56838 1065. RY (17) H 18 0.00000 6.49190 1066. RY (18) H 18 0.00000 4.39897 1067. RY (19) H 18 0.00000 4.98043 1068. RY (20) H 18 0.00000 9.52922 1069. RY (21) H 18 0.00000 4.68128 1070. RY (22) H 18 0.00000 8.98652 1071. RY (23) H 18 0.00000 8.84847 1072. RY (24) H 18 0.00000 9.52373 1073. RY (25) H 18 0.00000 8.55770 1074. RY (26) H 18 0.00000 7.70274 1075. RY (27) H 18 0.00000 7.36468 1076. RY (28) H 18 0.00000 7.23256 1077. RY (29) H 18 0.00000 7.83561 1078. RY ( 1) H 19 0.00110 1.05903 1079. RY ( 2) H 19 0.00068 2.83974 1080. RY ( 3) H 19 0.00034 3.22697 1081. RY ( 4) H 19 0.00021 1.66439 1082. RY ( 5) H 19 0.00006 2.39148 1083. RY ( 6) H 19 0.00002 4.22517 1084. RY ( 7) H 19 0.00001 4.20955 1085. RY ( 8) H 19 0.00001 4.09293 1086. RY ( 9) H 19 0.00000 5.33325 1087. RY (10) H 19 0.00000 6.09286 1088. RY (11) H 19 0.00000 7.23825 1089. RY (12) H 19 0.00000 7.20790 1090. RY (13) H 19 0.00000 7.48657 1091. RY (14) H 19 0.00000 8.31481 1092. RY (15) H 19 0.00000 7.65306 1093. RY (16) H 19 0.00000 7.06942 1094. RY (17) H 19 0.00000 6.90381 1095. RY (18) H 19 0.00000 7.11621 1096. RY (19) H 19 0.00000 6.35655 1097. RY (20) H 19 0.00000 3.71717 1098. RY (21) H 19 0.00000 6.17909 1099. RY (22) H 19 0.00000 5.42929 1100. RY (23) H 19 0.00000 7.33483 1101. RY (24) H 19 0.00000 9.21961 1102. RY (25) H 19 0.00000 8.79258 1103. RY (26) H 19 0.00000 9.01977 1104. RY (27) H 19 0.00000 8.50192 1105. RY (28) H 19 0.00000 7.34200 1106. RY (29) H 19 0.00000 7.03190 1107. RY ( 1) H 20 0.00078 2.59537 1108. RY ( 2) H 20 0.00069 2.57538 1109. RY ( 3) H 20 0.00042 2.11943 1110. RY ( 4) H 20 0.00022 1.71167 1111. RY ( 5) H 20 0.00004 3.66827 1112. RY ( 6) H 20 0.00003 5.26027 1113. RY ( 7) H 20 0.00002 4.08125 1114. RY ( 8) H 20 0.00002 4.14968 1115. RY ( 9) H 20 0.00000 4.50256 1116. RY (10) H 20 0.00000 5.01194 1117. RY (11) H 20 0.00000 4.63377 1118. RY (12) H 20 0.00000 10.12110 1119. RY (13) H 20 0.00000 4.80804 1120. RY (14) H 20 0.00000 6.67713 1121. RY (15) H 20 0.00000 7.03926 1122. RY (16) H 20 0.00000 7.77809 1123. RY (17) H 20 0.00000 6.60796 1124. RY (18) H 20 0.00000 5.29133 1125. RY (19) H 20 0.00000 6.85182 1126. RY (20) H 20 0.00000 5.98224 1127. RY (21) H 20 0.00000 5.76863 1128. RY (22) H 20 0.00000 8.07592 1129. RY (23) H 20 0.00000 9.34561 1130. RY (24) H 20 0.00000 8.37962 1131. RY (25) H 20 0.00000 8.21743 1132. RY (26) H 20 0.00000 8.66467 1133. RY (27) H 20 0.00000 8.69580 1134. RY (28) H 20 0.00000 8.10586 1135. RY (29) H 20 0.00000 7.78815 1136. RY ( 1) H 21 0.00078 2.64988 1137. RY ( 2) H 21 0.00057 2.63433 1138. RY ( 3) H 21 0.00033 2.24806 1139. RY ( 4) H 21 0.00017 1.39827 1140. RY ( 5) H 21 0.00006 2.99542 1141. RY ( 6) H 21 0.00003 4.01541 1142. RY ( 7) H 21 0.00002 5.43511 1143. RY ( 8) H 21 0.00001 3.69425 1144. RY ( 9) H 21 0.00000 5.06603 1145. RY (10) H 21 0.00000 5.75824 1146. RY (11) H 21 0.00000 4.91931 1147. RY (12) H 21 0.00000 5.04234 1148. RY (13) H 21 0.00000 8.55136 1149. RY (14) H 21 0.00000 7.19611 1150. RY (15) H 21 0.00000 6.38283 1151. RY (16) H 21 0.00000 6.49203 1152. RY (17) H 21 0.00000 7.17288 1153. RY (18) H 21 0.00000 6.50044 1154. RY (19) H 21 0.00000 3.88701 1155. RY (20) H 21 0.00000 6.82140 1156. RY (21) H 21 0.00000 8.96990 1157. RY (22) H 21 0.00000 9.62584 1158. RY (23) H 21 0.00000 9.09958 1159. RY (24) H 21 0.00000 8.35975 1160. RY (25) H 21 0.00000 9.06885 1161. RY (26) H 21 0.00000 6.95069 1162. RY (27) H 21 0.00000 7.55333 1163. RY (28) H 21 0.00000 7.87637 1164. RY (29) H 21 0.00000 7.64827 1165. RY ( 1) H 22 0.00115 1.18713 1166. RY ( 2) H 22 0.00073 2.68301 1167. RY ( 3) H 22 0.00041 2.86410 1168. RY ( 4) H 22 0.00020 1.59984 1169. RY ( 5) H 22 0.00005 2.48225 1170. RY ( 6) H 22 0.00002 4.57264 1171. RY ( 7) H 22 0.00001 4.31170 1172. RY ( 8) H 22 0.00001 3.36645 1173. RY ( 9) H 22 0.00000 7.84903 1174. RY (10) H 22 0.00000 5.04443 1175. RY (11) H 22 0.00000 8.36899 1176. RY (12) H 22 0.00000 8.02586 1177. RY (13) H 22 0.00000 8.39272 1178. RY (14) H 22 0.00000 7.36518 1179. RY (15) H 22 0.00000 6.62984 1180. RY (16) H 22 0.00000 6.81115 1181. RY (17) H 22 0.00000 7.58068 1182. RY (18) H 22 0.00000 6.99205 1183. RY (19) H 22 0.00000 5.27835 1184. RY (20) H 22 0.00000 5.49526 1185. RY (21) H 22 0.00000 5.50049 1186. RY (22) H 22 0.00000 6.06272 1187. RY (23) H 22 0.00000 5.40575 1188. RY (24) H 22 0.00000 9.06832 1189. RY (25) H 22 0.00000 8.34342 1190. RY (26) H 22 0.00000 8.97670 1191. RY (27) H 22 0.00000 7.99412 1192. RY (28) H 22 0.00000 7.58307 1193. RY (29) H 22 0.00000 7.72989 1194. RY ( 1) H 23 0.00072 2.62465 1195. RY ( 2) H 23 0.00062 2.53770 1196. RY ( 3) H 23 0.00031 2.40632 1197. RY ( 4) H 23 0.00013 2.00151 1198. RY ( 5) H 23 0.00008 2.87154 1199. RY ( 6) H 23 0.00003 3.74195 1200. RY ( 7) H 23 0.00002 4.07036 1201. RY ( 8) H 23 0.00001 5.72503 1202. RY ( 9) H 23 0.00000 4.73483 1203. RY (10) H 23 0.00000 6.05864 1204. RY (11) H 23 0.00000 4.56418 1205. RY (12) H 23 0.00000 7.93721 1206. RY (13) H 23 0.00000 7.13279 1207. RY (14) H 23 0.00000 6.57982 1208. RY (15) H 23 0.00000 7.61107 1209. RY (16) H 23 0.00000 6.11633 1210. RY (17) H 23 0.00000 6.15424 1211. RY (18) H 23 0.00000 6.29884 1212. RY (19) H 23 0.00000 5.66145 1213. RY (20) H 23 0.00000 6.05295 1214. RY (21) H 23 0.00000 5.27311 1215. RY (22) H 23 0.00000 9.59054 1216. RY (23) H 23 0.00000 8.90198 1217. RY (24) H 23 0.00000 9.14679 1218. RY (25) H 23 0.00000 8.54197 1219. RY (26) H 23 0.00000 8.62016 1220. RY (27) H 23 0.00000 8.68084 1221. RY (28) H 23 0.00000 7.58119 1222. RY (29) H 23 0.00000 7.48111 1223. RY ( 1) H 24 0.00065 2.87099 1224. RY ( 2) H 24 0.00050 3.08146 1225. RY ( 3) H 24 0.00028 2.15429 1226. RY ( 4) H 24 0.00013 1.23953 1227. RY ( 5) H 24 0.00007 2.83815 1228. RY ( 6) H 24 0.00002 3.68138 1229. RY ( 7) H 24 0.00002 4.47910 1230. RY ( 8) H 24 0.00001 5.71589 1231. RY ( 9) H 24 0.00001 5.49574 1232. RY (10) H 24 0.00000 4.62352 1233. RY (11) H 24 0.00000 7.89323 1234. RY (12) H 24 0.00000 6.70701 1235. RY (13) H 24 0.00000 6.60894 1236. RY (14) H 24 0.00000 8.69573 1237. RY (15) H 24 0.00000 6.89725 1238. RY (16) H 24 0.00000 5.80968 1239. RY (17) H 24 0.00000 7.14505 1240. RY (18) H 24 0.00000 5.14822 1241. RY (19) H 24 0.00000 7.15571 1242. RY (20) H 24 0.00000 6.03799 1243. RY (21) H 24 0.00000 6.61877 1244. RY (22) H 24 0.00000 4.54722 1245. RY (23) H 24 0.00000 8.36832 1246. RY (24) H 24 0.00000 9.04082 1247. RY (25) H 24 0.00000 8.15984 1248. RY (26) H 24 0.00000 8.70933 1249. RY (27) H 24 0.00000 8.42782 1250. RY (28) H 24 0.00000 7.76211 1251. RY (29) H 24 0.00000 8.15148 ------------------------------- Total Lewis 146.61529 ( 98.4068%) Valence non-Lewis 2.07786 ( 1.3946%) Rydberg non-Lewis 0.29587 ( 0.1986%) ------------------------------- Total unit 1 148.98903 (100.0000%) Charge unit 1 0.01097 Molecular unit 2 (C5H5) ------ Lewis -------------------------------------- 43. CR ( 1) C 11 1.99997 -10.21823 44. CR ( 1) C 12 1.99997 -10.22004 45. CR ( 1) C 13 1.99997 -10.23287 46. CR ( 1) C 14 1.99997 -10.21945 47. CR ( 1) C 15 1.99997 -10.22130 80. BD ( 1) C 11- C 12 1.97189 -0.56704 93(r),95(r),119(v),122(v) 837(v),941(v),123(g) 1253(v),1281(v),940(v) 133(r),127(r),128(r),143(r) 147(r),142(r),461(r),137(r) 81. BD ( 1) C 11- C 15 1.97525 -0.56827 95(r),121(v),117(v),785(v) 888(v),1254(v),1340(v) 889(v),127(r),128(r),94(r) 132(r),133(r) 82. BD ( 1) C 11- H 25 1.98199 -0.48625 95(r),120(v),115(v),784(v) 940(v),788(v),945(v),93(r) 94(r),138(r),125(r),163(r) 83. BD ( 1) C 12- C 13 1.97529 -0.57498 93(r),889(v),121(v),114(v) 733(v),1282(v),94(r) 1312(v),128(r),124(r) 129(r),95(r),137(r),126(r) 141(r) 84. BD ( 2) C 12- C 13 1.58692 -0.28283 93(r),123(v),94(r),138(r) 183(r),104(r),181(r),204(r) 176(r),792(g),186(r),182(r) 199(r),458(r),214(r),735(v) 178(r),156(r),731(v),179(r) 180(r),891(v),139(r),838(g) 173(r),786(g),887(v),145(r) 148(r),1313(v),147(r) 203(r),100(r),124(r),674(r) 185(r),128(r),166(r),163(r) 160(r),189(r),142(r),201(r) 184(r),209(r),153(r),202(r) 218(r),187(r),677(r),158(r) 675(r),465(r),212(r),149(r) 130(r),151(r),222(r),174(r) 219(r),168(r),161(r),207(r) 126(r),215(r),164(r),229(r) 1226(r),132(r),1110(r) 670(r),460(r),140(r),129(r) 150(r),172(r),99(r),177(r) 195(r),210(r),194(r),474(r) 453(r),205(r),175(r),216(r) 200(r),230(r),1197(r) 687(r),1052(r),463(r) 135(r),146(r),95(r),154(r) 155(r),171(r),141(r),456(r) 472(r),206(r),144(r),459(r) 570(r),143(r),690(r) 1139(r),131(r),127(r) 197(r) 85. BD ( 1) C 12- H 26 1.98272 -0.49261 93(r),118(v),113(v),732(v) 836(v),737(v),835(v),840(v) 95(r),94(r),132(r),150(r) 173(r) 86. BD ( 1) C 13- C 14 1.97096 -0.57644 94(r),117(v),122(v),941(v) 785(v),93(r),123(g),784(v) 1311(v),1369(v),1310(v) 128(r),129(r),124(r),677(r) 154(r),137(r),140(r),688(r) 130(r) 87. BD ( 1) C 13- H 27 1.98192 -0.50894 112(v),120(v),93(r),784(v) 888(v),94(r),892(v),788(v) 848(g),104(r),95(r),138(r) 133(r),674(r),204(r),677(r) 183(r),176(r) 88. BD ( 1) C 14- C 15 1.97544 -0.56537 94(r),119(v),114(v),95(r) 837(v),733(v),732(v) 1341(v),1370(v),1368(v) 133(r),127(r),128(r),132(r) 134(r),144(r),137(r) 89. BD ( 1) C 14- H 29 1.98303 -0.49444 94(r),115(v),113(v),940(v) 836(v),945(v),835(v),840(v) 95(r),93(r),138(r) 90. BD ( 1) C 15- H 28 1.98202 -0.48775 112(v),118(v),95(r),732(v) 888(v),94(r),889(v),892(v) 737(v),93(r),125(r),153(r) 138(r),97(r) 91. 3C ( 1) C 11- C 14- C 15 1.74282 -0.33187 95(r),94(r),138(r),183(r) 181(r),204(r),118(g),176(r) 112(g),182(r),186(r),199(r) 148(r),178(r),173(r),139(r) 179(r),180(r),156(r),458(r) 124(r),214(r),670(r),203(r) 93(r),166(r),674(r),783(v) 185(r),150(r),160(r),135(r) 453(r),145(r),184(r),202(r) 677(r),127(r),189(r),187(r) 158(r),201(r),147(r),133(r) 128(r),151(r),132(r),163(r) 164(r),209(r),153(r),216(r) 149(r),195(r),168(r),229(r) 460(r),687(r),99(r),140(r) 463(r),456(r),174(r),161(r) 194(r),177(r),205(r),175(r) 207(r),146(r),474(r),155(r) 673(r),675(r),108(r),172(r) 226(r),570(r),197(r),206(r) 200(r),1110(r),212(r) 476(r),222(r),472(r),519(r) 566(r),465(r),224(r),457(r) 243(r),567(r),1052(r) 478(r),1139(r),230(r) 227(r),208(r),618(r),464(r) 157(r),162(r),730(r),514(r) 468(r),244(r),130(r),154(r) 218(r),623(r),219(r),625(r) 92. 3Cn( 1) C 11- C 14- C 15 1.07601 -0.13765 116(v),94(r),95(r),118(g) 943(g),113(g),120(g),112(g) 890(g),734(g),835(v),786(v) 896(g),93(r),944(g),838(v) 888(g),736(g),848(v),955(g) 1368(v),895(g),741(g) 889(g),911(g),919(g),782(g) 954(g),796(v),948(g),747(g) 1371(v),839(v),893(g) 784(v),96(r),100(r),108(r) 126(r),130(r),154(r),139(r) 129(r),131(r),143(r),150(r) 109(r),478(r),455(r),127(r) 402(r) ------ non-Lewis ---------------------------------- 112. BD*( 1) C 11- C 12 0.01587 0.44653 113. BD*( 1) C 11- C 15 0.01934 0.45888 114. BD*( 1) C 11- H 25 0.01602 0.41034 115. BD*( 1) C 12- C 13 0.02063 0.44966 116. BD*( 2) C 12- C 13 0.41812 -0.00726 117. BD*( 1) C 12- H 26 0.01406 0.39874 118. BD*( 1) C 13- C 14 0.01803 0.44350 119. BD*( 1) C 13- H 27 0.01679 0.38233 120. BD*( 1) C 14- C 15 0.01837 0.44598 121. BD*( 1) C 14- H 29 0.01429 0.39411 122. BD*( 1) C 15- H 28 0.01554 0.40944 123. 3C*( 1) C 11- C 14- C 15 0.14427 0.05859 731. RY ( 1) C 11 0.00543 1.46115 732. RY ( 2) C 11 0.00397 1.86174 733. RY ( 3) C 11 0.00332 1.69836 734. RY ( 4) C 11 0.00207 1.48953 735. RY ( 5) C 11 0.00099 2.86201 736. RY ( 6) C 11 0.00072 2.56189 737. RY ( 7) C 11 0.00049 4.92875 738. RY ( 8) C 11 0.00035 3.43007 739. RY ( 9) C 11 0.00024 2.07919 740. RY (10) C 11 0.00019 2.56662 741. RY (11) C 11 0.00013 2.23647 742. RY (12) C 11 0.00006 3.29047 743. RY (13) C 11 0.00006 3.66365 744. RY (14) C 11 0.00005 3.75389 745. RY (15) C 11 0.00003 4.48365 746. RY (16) C 11 0.00003 2.96533 747. RY (17) C 11 0.00003 4.38873 748. RY (18) C 11 0.00002 3.88174 749. RY (19) C 11 0.00001 4.18571 750. RY (20) C 11 0.00001 5.43318 751. RY (21) C 11 0.00001 4.72732 752. RY (22) C 11 0.00001 4.63813 753. RY (23) C 11 0.00000 6.53997 754. RY (24) C 11 0.00000 5.25478 755. RY (25) C 11 0.00000 6.10195 756. RY (26) C 11 0.00000 5.16716 757. RY (27) C 11 0.00000 5.15775 758. RY (28) C 11 0.00000 5.72912 759. RY (29) C 11 0.00000 5.74953 760. RY (30) C 11 0.00000 4.48763 761. RY (31) C 11 0.00000 4.74628 762. RY (32) C 11 0.00000 4.95366 763. RY (33) C 11 0.00000 6.66882 764. RY (34) C 11 0.00000 111.83081 765. RY (35) C 11 0.00000 7.14386 766. RY (36) C 11 0.00000 9.22745 767. RY (37) C 11 0.00000 14.33441 768. RY (38) C 11 0.00000 8.09007 769. RY (39) C 11 0.00000 12.39887 770. RY (40) C 11 0.00000 9.34332 771. RY (41) C 11 0.00000 6.73633 772. RY (42) C 11 0.00000 7.19610 773. RY (43) C 11 0.00000 7.03148 774. RY (44) C 11 0.00000 6.54074 775. RY (45) C 11 0.00000 6.90282 776. RY (46) C 11 0.00000 7.19797 777. RY (47) C 11 0.00000 8.27031 778. RY (48) C 11 0.00000 7.07052 779. RY (49) C 11 0.00000 5.41191 780. RY (50) C 11 0.00000 6.56727 781. RY (51) C 11 0.00000 6.63724 782. RY (52) C 11 0.00000 9.17514 783. RY ( 1) C 12 0.00504 1.44990 784. RY ( 2) C 12 0.00358 1.83743 785. RY ( 3) C 12 0.00302 1.68212 786. RY ( 4) C 12 0.00158 1.55940 787. RY ( 5) C 12 0.00075 3.03697 788. RY ( 6) C 12 0.00046 4.68708 789. RY ( 7) C 12 0.00036 3.22638 790. RY ( 8) C 12 0.00025 2.84336 791. RY ( 9) C 12 0.00020 2.63575 792. RY (10) C 12 0.00012 3.19344 793. RY (11) C 12 0.00009 1.72786 794. RY (12) C 12 0.00007 2.98833 795. RY (13) C 12 0.00005 2.96600 796. RY (14) C 12 0.00004 5.25512 797. RY (15) C 12 0.00003 2.91745 798. RY (16) C 12 0.00002 4.09308 799. RY (17) C 12 0.00002 4.39612 800. RY (18) C 12 0.00002 3.84440 801. RY (19) C 12 0.00001 4.17624 802. RY (20) C 12 0.00000 3.63491 803. RY (21) C 12 0.00001 6.11665 804. RY (22) C 12 0.00001 4.02388 805. RY (23) C 12 0.00000 6.84170 806. RY (24) C 12 0.00000 6.01952 807. RY (25) C 12 0.00000 6.90415 808. RY (26) C 12 0.00000 6.33195 809. RY (27) C 12 0.00000 4.70691 810. RY (28) C 12 0.00000 5.19470 811. RY (29) C 12 0.00000 6.29043 812. RY (30) C 12 0.00000 6.14050 813. RY (31) C 12 0.00000 4.74963 814. RY (32) C 12 0.00000 4.30405 815. RY (33) C 12 0.00000 4.90814 816. RY (34) C 12 0.00000 8.38060 817. RY (35) C 12 0.00000 85.57838 818. RY (36) C 12 0.00000 45.55793 819. RY (37) C 12 0.00000 8.64638 820. RY (38) C 12 0.00000 6.88054 821. RY (39) C 12 0.00000 6.60304 822. RY (40) C 12 0.00000 7.88498 823. RY (41) C 12 0.00000 9.32562 824. RY (42) C 12 0.00000 8.43147 825. RY (43) C 12 0.00000 9.07758 826. RY (44) C 12 0.00000 6.71141 827. RY (45) C 12 0.00000 6.65246 828. RY (46) C 12 0.00000 6.25086 829. RY (47) C 12 0.00000 6.58778 830. RY (48) C 12 0.00000 7.48529 831. RY (49) C 12 0.00000 6.38214 832. RY (50) C 12 0.00000 6.66465 833. RY (51) C 12 0.00000 5.79996 834. RY (52) C 12 0.00000 7.42745 835. RY ( 1) C 13 0.00433 1.27336 836. RY ( 2) C 13 0.00332 1.79757 837. RY ( 3) C 13 0.00283 1.63676 838. RY ( 4) C 13 0.00117 1.93294 839. RY ( 5) C 13 0.00087 3.12206 840. RY ( 6) C 13 0.00046 4.91473 841. RY ( 7) C 13 0.00033 3.56358 842. RY ( 8) C 13 0.00028 2.42005 843. RY ( 9) C 13 0.00016 2.35373 844. RY (10) C 13 0.00009 3.34820 845. RY (11) C 13 0.00007 2.44981 846. RY (12) C 13 0.00007 3.34997 847. RY (13) C 13 0.00005 3.22287 848. RY (14) C 13 0.00004 5.16445 849. RY (15) C 13 0.00003 4.04038 850. RY (16) C 13 0.00002 4.39498 851. RY (17) C 13 0.00002 3.44153 852. RY (18) C 13 0.00002 4.49629 853. RY (19) C 13 0.00001 2.99119 854. RY (20) C 13 0.00001 4.53719 855. RY (21) C 13 0.00001 5.21982 856. RY (22) C 13 0.00000 8.09504 857. RY (23) C 13 0.00000 6.00239 858. RY (24) C 13 0.00000 6.05498 859. RY (25) C 13 0.00000 5.87308 860. RY (26) C 13 0.00000 4.54904 861. RY (27) C 13 0.00000 5.18695 862. RY (28) C 13 0.00000 5.16370 863. RY (29) C 13 0.00000 4.19179 864. RY (30) C 13 0.00000 4.44753 865. RY (31) C 13 0.00000 6.28607 866. RY (32) C 13 0.00000 5.63221 867. RY (33) C 13 0.00000 4.40350 868. RY (34) C 13 0.00000 102.59334 869. RY (35) C 13 0.00000 16.82111 870. RY (36) C 13 0.00000 7.57892 871. RY (37) C 13 0.00000 6.81742 872. RY (38) C 13 0.00000 11.95478 873. RY (39) C 13 0.00000 6.71537 874. RY (40) C 13 0.00000 13.74261 875. RY (41) C 13 0.00000 8.57187 876. RY (42) C 13 0.00000 7.29850 877. RY (43) C 13 0.00000 7.98466 878. RY (44) C 13 0.00000 7.87111 879. RY (45) C 13 0.00000 6.63959 880. RY (46) C 13 0.00000 6.78333 881. RY (47) C 13 0.00000 7.58315 882. RY (48) C 13 0.00000 8.30222 883. RY (49) C 13 0.00000 7.40790 884. RY (50) C 13 0.00000 7.38369 885. RY (51) C 13 0.00000 6.09244 886. RY (52) C 13 0.00000 6.51707 887. RY ( 1) C 14 0.00502 1.42246 888. RY ( 2) C 14 0.00353 1.72308 889. RY ( 3) C 14 0.00334 1.79240 890. RY ( 4) C 14 0.00195 1.73285 891. RY ( 5) C 14 0.00092 2.93781 892. RY ( 6) C 14 0.00044 4.70284 893. RY ( 7) C 14 0.00036 3.36554 894. RY ( 8) C 14 0.00025 2.52458 895. RY ( 9) C 14 0.00019 2.83816 896. RY (10) C 14 0.00011 3.25933 897. RY (11) C 14 0.00008 2.32197 898. RY (12) C 14 0.00006 2.74499 899. RY (13) C 14 0.00005 2.90969 900. RY (14) C 14 0.00004 3.94681 901. RY (15) C 14 0.00003 3.74381 902. RY (16) C 14 0.00002 4.20477 903. RY (17) C 14 0.00002 3.68389 904. RY (18) C 14 0.00001 3.88670 905. RY (19) C 14 0.00001 4.05540 906. RY (20) C 14 0.00001 5.14151 907. RY (21) C 14 0.00000 6.68670 908. RY (22) C 14 0.00000 6.19762 909. RY (23) C 14 0.00000 6.69526 910. RY (24) C 14 0.00000 7.40404 911. RY (25) C 14 0.00000 7.15088 912. RY (26) C 14 0.00000 5.27778 913. RY (27) C 14 0.00000 5.00385 914. RY (28) C 14 0.00000 5.54421 915. RY (29) C 14 0.00000 4.28971 916. RY (30) C 14 0.00000 6.43558 917. RY (31) C 14 0.00000 3.35185 918. RY (32) C 14 0.00000 5.57803 919. RY (33) C 14 0.00000 5.80990 920. RY (34) C 14 0.00001 5.03449 921. RY (35) C 14 0.00000 115.91884 922. RY (36) C 14 0.00000 20.53642 923. RY (37) C 14 0.00000 6.88141 924. RY (38) C 14 0.00000 6.92569 925. RY (39) C 14 0.00000 7.74086 926. RY (40) C 14 0.00000 7.75694 927. RY (41) C 14 0.00000 7.06669 928. RY (42) C 14 0.00000 7.33092 929. RY (43) C 14 0.00000 6.87906 930. RY (44) C 14 0.00000 7.70495 931. RY (45) C 14 0.00000 6.23755 932. RY (46) C 14 0.00000 7.07695 933. RY (47) C 14 0.00000 7.58043 934. RY (48) C 14 0.00000 6.52747 935. RY (49) C 14 0.00000 7.16746 936. RY (50) C 14 0.00000 6.54404 937. RY (51) C 14 0.00000 6.28381 938. RY (52) C 14 0.00000 5.38655 939. RY ( 1) C 15 0.00554 1.38850 940. RY ( 2) C 15 0.00404 1.86166 941. RY ( 3) C 15 0.00323 1.58018 942. RY ( 4) C 15 0.00146 1.54293 943. RY ( 5) C 15 0.00078 2.60386 944. RY ( 6) C 15 0.00066 2.88153 945. RY ( 7) C 15 0.00049 5.05415 946. RY ( 8) C 15 0.00032 3.64603 947. RY ( 9) C 15 0.00020 1.91774 948. RY (10) C 15 0.00014 2.83523 949. RY (11) C 15 0.00012 2.53307 950. RY (12) C 15 0.00006 3.56393 951. RY (13) C 15 0.00006 3.66988 952. RY (14) C 15 0.00004 3.88024 953. RY (15) C 15 0.00003 4.42003 954. RY (16) C 15 0.00003 4.14288 955. RY (17) C 15 0.00002 3.78563 956. RY (18) C 15 0.00001 4.79166 957. RY (19) C 15 0.00001 2.85972 958. RY (20) C 15 0.00001 6.26408 959. RY (21) C 15 0.00001 3.83205 960. RY (22) C 15 0.00001 5.03206 961. RY (23) C 15 0.00000 6.63900 962. RY (24) C 15 0.00000 4.98038 963. RY (25) C 15 0.00000 6.18927 964. RY (26) C 15 0.00000 8.18862 965. RY (27) C 15 0.00000 5.73731 966. RY (28) C 15 0.00000 5.55179 967. RY (29) C 15 0.00000 4.47723 968. RY (30) C 15 0.00000 5.38874 969. RY (31) C 15 0.00000 4.49244 970. RY (32) C 15 0.00000 5.11408 971. RY (33) C 15 0.00000 5.41046 972. RY (34) C 15 0.00000 118.96316 973. RY (35) C 15 0.00000 16.03246 974. RY (36) C 15 0.00000 8.55057 975. RY (37) C 15 0.00000 6.77122 976. RY (38) C 15 0.00000 7.39589 977. RY (39) C 15 0.00000 6.85721 978. RY (40) C 15 0.00000 7.12707 979. RY (41) C 15 0.00000 6.18076 980. RY (42) C 15 0.00000 7.07259 981. RY (43) C 15 0.00000 7.32724 982. RY (44) C 15 0.00000 6.61623 983. RY (45) C 15 0.00000 7.85025 984. RY (46) C 15 0.00000 7.91575 985. RY (47) C 15 0.00000 6.58044 986. RY (48) C 15 0.00000 7.09057 987. RY (49) C 15 0.00000 6.49785 988. RY (50) C 15 0.00000 6.90160 989. RY (51) C 15 0.00000 6.37572 990. RY (52) C 15 0.00000 5.97786 1252. RY ( 1) H 25 0.00135 1.21445 1253. RY ( 2) H 25 0.00052 2.72107 1254. RY ( 3) H 25 0.00049 2.99875 1255. RY ( 4) H 25 0.00032 2.83091 1256. RY ( 5) H 25 0.00014 3.62122 1257. RY ( 6) H 25 0.00004 4.31346 1258. RY ( 7) H 25 0.00003 5.69259 1259. RY ( 8) H 25 0.00002 4.80805 1260. RY ( 9) H 25 0.00002 5.65948 1261. RY (10) H 25 0.00001 6.60444 1262. RY (11) H 25 0.00001 3.95963 1263. RY (12) H 25 0.00000 6.22204 1264. RY (13) H 25 0.00000 5.86683 1265. RY (14) H 25 0.00000 5.07112 1266. RY (15) H 25 0.00000 7.75188 1267. RY (16) H 25 0.00000 6.54962 1268. RY (17) H 25 0.00000 7.32235 1269. RY (18) H 25 0.00000 7.15946 1270. RY (19) H 25 0.00000 7.90435 1271. RY (20) H 25 0.00000 7.67064 1272. RY (21) H 25 0.00000 8.51216 1273. RY (22) H 25 0.00000 9.07184 1274. RY (23) H 25 0.00000 7.99023 1275. RY (24) H 25 0.00000 8.42046 1276. RY (25) H 25 0.00000 8.62188 1277. RY (26) H 25 0.00000 7.18084 1278. RY (27) H 25 0.00000 8.19986 1279. RY (28) H 25 0.00000 8.55428 1280. RY (29) H 25 0.00000 7.63769 1281. RY ( 1) H 26 0.00057 2.68013 1282. RY ( 2) H 26 0.00040 2.96494 1283. RY ( 3) H 26 0.00035 2.08617 1284. RY ( 4) H 26 0.00026 2.87979 1285. RY ( 5) H 26 0.00017 2.48458 1286. RY ( 6) H 26 0.00003 4.94798 1287. RY ( 7) H 26 0.00003 4.98773 1288. RY ( 8) H 26 0.00002 4.84503 1289. RY ( 9) H 26 0.00001 5.36030 1290. RY (10) H 26 0.00001 4.99630 1291. RY (11) H 26 0.00001 4.94956 1292. RY (12) H 26 0.00000 7.52171 1293. RY (13) H 26 0.00000 6.07629 1294. RY (14) H 26 0.00000 7.44800 1295. RY (15) H 26 0.00000 6.68392 1296. RY (16) H 26 0.00000 7.50356 1297. RY (17) H 26 0.00000 7.29620 1298. RY (18) H 26 0.00000 7.36697 1299. RY (19) H 26 0.00000 7.78735 1300. RY (20) H 26 0.00000 4.99405 1301. RY (21) H 26 0.00000 9.20394 1302. RY (22) H 26 0.00000 9.10070 1303. RY (23) H 26 0.00000 8.28705 1304. RY (24) H 26 0.00000 8.26708 1305. RY (25) H 26 0.00000 8.14179 1306. RY (26) H 26 0.00000 7.66187 1307. RY (27) H 26 0.00000 8.35269 1308. RY (28) H 26 0.00000 7.97935 1309. RY (29) H 26 0.00000 7.44688 1310. RY ( 1) H 27 0.00065 2.26149 1311. RY ( 2) H 27 0.00049 1.91757 1312. RY ( 3) H 27 0.00047 3.02629 1313. RY ( 4) H 27 0.00029 2.53606 1314. RY ( 5) H 27 0.00017 3.58014 1315. RY ( 6) H 27 0.00004 6.47503 1316. RY ( 7) H 27 0.00002 3.62158 1317. RY ( 8) H 27 0.00002 5.05351 1318. RY ( 9) H 27 0.00001 6.65893 1319. RY (10) H 27 0.00001 4.89038 1320. RY (11) H 27 0.00001 3.35104 1321. RY (12) H 27 0.00000 7.87301 1322. RY (13) H 27 0.00000 7.37669 1323. RY (14) H 27 0.00000 6.72868 1324. RY (15) H 27 0.00000 6.56157 1325. RY (16) H 27 0.00000 6.70506 1326. RY (17) H 27 0.00000 9.58917 1327. RY (18) H 27 0.00000 6.44782 1328. RY (19) H 27 0.00000 5.43744 1329. RY (20) H 27 0.00000 5.57934 1330. RY (21) H 27 0.00000 9.19993 1331. RY (22) H 27 0.00000 9.01360 1332. RY (23) H 27 0.00000 8.75778 1333. RY (24) H 27 0.00000 7.48088 1334. RY (25) H 27 0.00000 7.49249 1335. RY (26) H 27 0.00000 8.42702 1336. RY (27) H 27 0.00000 8.59962 1337. RY (28) H 27 0.00000 8.32077 1338. RY (29) H 27 0.00000 8.15772 1339. RY ( 1) H 28 0.00111 1.28332 1340. RY ( 2) H 28 0.00050 2.88435 1341. RY ( 3) H 28 0.00049 2.98275 1342. RY ( 4) H 28 0.00032 2.69377 1343. RY ( 5) H 28 0.00013 3.53605 1344. RY ( 6) H 28 0.00004 4.05717 1345. RY ( 7) H 28 0.00003 5.37925 1346. RY ( 8) H 28 0.00002 4.88688 1347. RY ( 9) H 28 0.00002 5.47991 1348. RY (10) H 28 0.00001 6.39780 1349. RY (11) H 28 0.00000 5.73262 1350. RY (12) H 28 0.00000 3.85944 1351. RY (13) H 28 0.00000 8.02292 1352. RY (14) H 28 0.00000 3.66541 1353. RY (15) H 28 0.00000 7.78191 1354. RY (16) H 28 0.00000 7.00303 1355. RY (17) H 28 0.00000 6.82277 1356. RY (18) H 28 0.00000 7.34034 1357. RY (19) H 28 0.00000 9.32234 1358. RY (20) H 28 0.00000 6.42601 1359. RY (21) H 28 0.00000 9.15952 1360. RY (22) H 28 0.00000 9.01425 1361. RY (23) H 28 0.00000 7.29586 1362. RY (24) H 28 0.00000 7.81355 1363. RY (25) H 28 0.00000 8.76073 1364. RY (26) H 28 0.00000 8.08593 1365. RY (27) H 28 0.00000 8.59753 1366. RY (28) H 28 0.00000 8.04112 1367. RY (29) H 28 0.00000 7.68314 1368. RY ( 1) H 29 0.00060 2.39965 1369. RY ( 2) H 29 0.00039 1.96633 1370. RY ( 3) H 29 0.00037 3.10422 1371. RY ( 4) H 29 0.00023 3.26445 1372. RY ( 5) H 29 0.00020 2.38805 1373. RY ( 6) H 29 0.00003 4.48178 1374. RY ( 7) H 29 0.00003 5.46918 1375. RY ( 8) H 29 0.00002 4.78767 1376. RY ( 9) H 29 0.00001 6.23646 1377. RY (10) H 29 0.00001 3.40787 1378. RY (11) H 29 0.00000 7.56241 1379. RY (12) H 29 0.00000 7.18417 1380. RY (13) H 29 0.00000 7.09745 1381. RY (14) H 29 0.00000 7.19559 1382. RY (15) H 29 0.00000 7.22245 1383. RY (16) H 29 0.00000 6.69670 1384. RY (17) H 29 0.00000 5.67912 1385. RY (18) H 29 0.00000 8.64742 1386. RY (19) H 29 0.00000 5.45731 1387. RY (20) H 29 0.00000 7.15342 1388. RY (21) H 29 0.00000 5.53985 1389. RY (22) H 29 0.00000 9.19468 1390. RY (23) H 29 0.00000 9.25084 1391. RY (24) H 29 0.00000 8.14687 1392. RY (25) H 29 0.00000 8.21544 1393. RY (26) H 29 0.00000 8.48016 1394. RY (27) H 29 0.00000 8.20308 1395. RY (28) H 29 0.00000 7.20241 1396. RY (29) H 29 0.00000 8.58467 ------------------------------- Total Lewis 34.18611 ( 97.6440%) Valence non-Lewis 0.73132 ( 2.0888%) Rydberg non-Lewis 0.09354 ( 0.2672%) ------------------------------- Total unit 2 35.01097 (100.0000%) Charge unit 2 -0.01097 $CHOOSE LONE 1 3 2 2 3 2 4 2 5 2 6 2 END BOND S 1 2 S 1 6 S 1 10 S 2 3 S 3 4 S 4 5 S 5 6 S 7 10 S 7 16 S 7 17 S 7 18 S 8 10 S 8 19 S 8 20 S 8 21 S 9 10 S 9 22 S 9 23 S 9 24 S 11 12 S 11 15 S 11 25 D 12 13 S 12 26 S 13 14 S 13 27 S 14 15 S 14 29 S 15 28 END 3C D 11 14 15 END $END Checkpoint NBOs sorted by occupancy: Sort Occ Energy Orig Label ----------------------------------------------------------- 1. 2.00000 -198.30421 1. CR ( 1)Co 1 2. 2.00000 -111.50072 2. CR ( 2)Co 1 3. 2.00000 -27.97864 4. CR ( 4)Co 1 4. 2.00000 -27.98852 6. CR ( 6)Co 1 5. 2.00000 -27.97601 8. CR ( 8)Co 1 6. 2.00000 -87.34503 10. CR ( 1) S 2 7. 2.00000 -87.85771 15. CR ( 1) S 3 8. 2.00000 -87.97546 20. CR ( 1) S 4 9. 2.00000 -87.87396 25. CR ( 1) S 5 10. 2.00000 -87.36062 30. CR ( 1) S 6 11. 2.00000 -69.44407 38. CR ( 1) P 10 12. 2.00000 -9.18083 11. CR ( 2) S 2 13. 2.00000 -8.74533 16. CR ( 2) S 3 14. 2.00000 -8.62260 21. CR ( 2) S 4 15. 2.00000 -8.72787 26. CR ( 2) S 5 16. 2.00000 -9.16505 31. CR ( 2) S 6 17. 2.00000 -14.06014 39. CR ( 2) P 10 18. 2.00000 -4.72894 40. CR ( 3) P 10 19. 2.00000 -4.72828 41. CR ( 4) P 10 20. 2.00000 -4.73043 42. CR ( 5) P 10 21. 1.99999 -5.85470 12. CR ( 3) S 2 22. 1.99999 -5.84531 13. CR ( 4) S 2 23. 1.99999 -5.84745 14. CR ( 5) S 2 24. 1.99999 -5.88998 24. CR ( 5) S 4 25. 1.99999 -5.85467 32. CR ( 3) S 6 26. 1.99999 -5.89019 17. CR ( 3) S 3 27. 1.99999 -5.88382 18. CR ( 4) S 3 28. 1.99999 -5.88619 19. CR ( 5) S 3 29. 1.99999 -5.88102 22. CR ( 3) S 4 30. 1.99999 -5.88288 23. CR ( 4) S 4 31. 1.99999 -5.88969 27. CR ( 3) S 5 32. 1.99999 -5.84545 33. CR ( 4) S 6 33. 1.99999 -5.84703 34. CR ( 5) S 6 34. 1.99999 -5.88233 28. CR ( 4) S 5 35. 1.99999 -5.88641 29. CR ( 5) S 5 36. 1.99999 -3.73450 3. CR ( 3)Co 1 37. 1.99997 -10.21158 35. CR ( 1) C 7 38. 1.99997 -10.19765 36. CR ( 1) C 8 39. 1.99997 -10.21390 37. CR ( 1) C 9 40. 1.99997 -10.21823 43. CR ( 1) C 11 41. 1.99997 -10.22004 44. CR ( 1) C 12 42. 1.99997 -10.23287 45. CR ( 1) C 13 43. 1.99997 -10.21945 46. CR ( 1) C 14 44. 1.99997 -10.22130 47. CR ( 1) C 15 45. 1.99997 -2.87484 9. CR ( 9)Co 1 46. 1.99996 -2.87955 5. CR ( 5)Co 1 47. 1.99993 -2.89658 7. CR ( 7)Co 1 48. 1.99553 -0.50540 55. LP ( 1) S 4 49. 1.99413 -0.49779 53. LP ( 1) S 3 50. 1.99381 -0.49645 57. LP ( 1) S 5 51. 1.98723 -0.49520 65. BD ( 1) S 3- S 4 52. 1.98706 -0.49488 66. BD ( 1) S 4- S 5 53. 1.98695 -0.48935 77. BD ( 1) C 9- H 22 54. 1.98680 -0.48756 69. BD ( 1) C 7- H 16 55. 1.98540 -0.49032 79. BD ( 1) C 9- H 24 56. 1.98495 -0.48745 70. BD ( 1) C 7- H 17 57. 1.98423 -0.47597 73. BD ( 1) C 8- H 19 58. 1.98393 -0.46683 74. BD ( 1) C 8- H 20 59. 1.98303 -0.49444 89. BD ( 1) C 14- H 29 60. 1.98272 -0.49261 85. BD ( 1) C 12- H 26 61. 1.98262 -0.46974 75. BD ( 1) C 8- H 21 62. 1.98218 -0.49980 64. BD ( 1) S 2- S 3 63. 1.98202 -0.48775 90. BD ( 1) C 15- H 28 64. 1.98201 -0.48373 78. BD ( 1) C 9- H 23 65. 1.98199 -0.48625 82. BD ( 1) C 11- H 25 66. 1.98192 -0.50011 67. BD ( 1) S 5- S 6 67. 1.98192 -0.50894 87. BD ( 1) C 13- H 27 68. 1.98106 -0.48104 71. BD ( 1) C 7- H 18 69. 1.97789 -0.49816 72. BD ( 1) C 8- P 10 70. 1.97765 -0.50547 68. BD ( 1) C 7- P 10 71. 1.97743 -0.50632 76. BD ( 1) C 9- P 10 72. 1.97544 -0.56537 88. BD ( 1) C 14- C 15 73. 1.97529 -0.57498 83. BD ( 1) C 12- C 13 74. 1.97525 -0.56827 81. BD ( 1) C 11- C 15 75. 1.97456 -0.48073 51. LP ( 1) S 2 76. 1.97428 -0.24133 48. LP ( 1)Co 1 77. 1.97410 -0.47932 59. LP ( 1) S 6 78. 1.97189 -0.56704 80. BD ( 1) C 11- C 12 79. 1.97096 -0.57644 86. BD ( 1) C 13- C 14 80. 1.93900 -0.22118 49. LP ( 2)Co 1 81. 1.92494 -0.22053 50. LP ( 3)Co 1 82. 1.90415 -0.22297 52. LP ( 2) S 2 83. 1.90365 -0.22434 60. LP ( 2) S 6 84. 1.90224 -0.30260 62. BD ( 1)Co 1- S 6 85. 1.90100 -0.30226 61. BD ( 1)Co 1- S 2 86. 1.89533 -0.24505 56. LP ( 2) S 4 87. 1.87039 -0.24004 58. LP ( 2) S 5 88. 1.87030 -0.24038 54. LP ( 2) S 3 89. 1.86892 -0.32168 63. BD ( 1)Co 1- P 10 90. 1.74282 -0.33187 91. 3C ( 1) C 11- C 14- C 15 91. 1.58692 -0.28283 84. BD ( 2) C 12- C 13 92. 1.07601 -0.13765 92. 3Cn( 1) C 11- C 14- C 15 93. 0.50289 0.11324 94. BD*( 1)Co 1- S 6 94. 0.49388 0.11244 93. BD*( 1)Co 1- S 2 95. 0.48385 0.12146 95. BD*( 1)Co 1- P 10 96. 0.41812 -0.00726 116. BD*( 2) C 12- C 13 97. 0.14427 0.05859 123. 3C*( 1) C 11- C 14- C 15 98. 0.11697 0.05471 98. BD*( 1) S 4- S 5 99. 0.11647 0.05435 97. BD*( 1) S 3- S 4 100. 0.06965 0.09481 96. BD*( 1) S 2- S 3 101. 0.06916 0.09662 99. BD*( 1) S 5- S 6 102. 0.05847 0.18142 100. BD*( 1) C 7- P 10 103. 0.05798 0.18176 108. BD*( 1) C 9- P 10 104. 0.04571 0.18724 104. BD*( 1) C 8- P 10 105. 0.02063 0.44966 115. BD*( 1) C 12- C 13 106. 0.01934 0.45888 113. BD*( 1) C 11- C 15 107. 0.01931 0.72244 270. RY ( 1) S 3 108. 0.01929 0.72276 392. RY ( 1) S 5 109. 0.01837 0.44598 120. BD*( 1) C 14- C 15 110. 0.01803 0.44350 118. BD*( 1) C 13- C 14 111. 0.01741 1.51533 124. RY ( 1)Co 1 112. 0.01679 0.38233 119. BD*( 1) C 13- H 27 113. 0.01602 0.41034 114. BD*( 1) C 11- H 25 114. 0.01597 0.70470 331. RY ( 1) S 4 115. 0.01587 0.44653 112. BD*( 1) C 11- C 12 116. 0.01554 0.40944 122. BD*( 1) C 15- H 28 117. 0.01429 0.39411 121. BD*( 1) C 14- H 29 118. 0.01406 0.39874 117. BD*( 1) C 12- H 26 119. 0.01050 0.67406 393. RY ( 2) S 5 120. 0.01042 0.68644 271. RY ( 2) S 3 121. 0.01027 0.33116 109. BD*( 1) C 9- H 22 122. 0.01023 0.33186 101. BD*( 1) C 7- H 16 123. 0.00870 0.33654 105. BD*( 1) C 8- H 19 124. 0.00839 0.68969 332. RY ( 2) S 4 125. 0.00787 1.64250 670. RY ( 1) P 10 126. 0.00757 1.51803 125. RY ( 2)Co 1 127. 0.00732 1.14103 453. RY ( 1) S 6 128. 0.00724 1.12421 209. RY ( 1) S 2 129. 0.00716 1.38450 671. RY ( 2) P 10 130. 0.00669 0.36672 106. BD*( 1) C 8- H 20 131. 0.00629 0.58883 272. RY ( 3) S 3 132. 0.00628 0.58778 394. RY ( 3) S 5 133. 0.00625 1.25684 672. RY ( 3) P 10 134. 0.00582 1.33855 673. RY ( 4) P 10 135. 0.00567 0.34294 103. BD*( 1) C 7- H 18 136. 0.00559 0.33378 111. BD*( 1) C 9- H 24 137. 0.00554 1.38850 939. RY ( 1) C 15 138. 0.00551 0.33474 102. BD*( 1) C 7- H 17 139. 0.00543 1.46115 731. RY ( 1) C 11 140. 0.00535 1.43777 126. RY ( 3)Co 1 141. 0.00520 0.35708 107. BD*( 1) C 8- H 21 142. 0.00509 1.54729 674. RY ( 5) P 10 143. 0.00504 1.44990 783. RY ( 1) C 12 144. 0.00502 1.42246 887. RY ( 1) C 14 145. 0.00498 0.33484 110. BD*( 1) C 9- H 23 146. 0.00483 2.00163 127. RY ( 4)Co 1 147. 0.00446 1.35285 128. RY ( 5)Co 1 148. 0.00433 1.27336 835. RY ( 1) C 13 149. 0.00412 0.88021 333. RY ( 3) S 4 150. 0.00404 1.86166 940. RY ( 2) C 15 151. 0.00397 1.86174 732. RY ( 2) C 11 152. 0.00360 1.08400 210. RY ( 2) S 2 153. 0.00358 1.83743 784. RY ( 2) C 12 154. 0.00353 1.72308 888. RY ( 2) C 14 155. 0.00350 1.17779 454. RY ( 2) S 6 156. 0.00334 1.79240 889. RY ( 3) C 14 157. 0.00332 1.79757 836. RY ( 2) C 13 158. 0.00332 1.69836 733. RY ( 3) C 11 159. 0.00331 1.46438 675. RY ( 6) P 10 160. 0.00330 1.83996 566. RY ( 1) C 8 161. 0.00323 1.58018 941. RY ( 3) C 15 162. 0.00321 1.34436 211. RY ( 3) S 2 163. 0.00313 0.82803 395. RY ( 4) S 5 164. 0.00311 0.84878 273. RY ( 4) S 3 165. 0.00309 1.23829 455. RY ( 3) S 6 166. 0.00302 1.68212 785. RY ( 3) C 12 167. 0.00300 1.49573 676. RY ( 7) P 10 168. 0.00297 0.76604 334. RY ( 4) S 4 169. 0.00283 1.63676 837. RY ( 3) C 13 170. 0.00239 2.51671 129. RY ( 6)Co 1 171. 0.00237 1.76383 514. RY ( 1) C 7 172. 0.00229 1.65337 212. RY ( 4) S 2 173. 0.00228 1.59705 456. RY ( 4) S 6 174. 0.00228 1.76369 618. RY ( 1) C 9 175. 0.00208 1.47940 677. RY ( 8) P 10 176. 0.00207 1.48953 734. RY ( 4) C 11 177. 0.00204 1.59986 130. RY ( 7)Co 1 178. 0.00195 1.73285 890. RY ( 4) C 14 179. 0.00184 1.91463 131. RY ( 8)Co 1 180. 0.00168 2.19861 132. RY ( 9)Co 1 181. 0.00158 1.55940 786. RY ( 4) C 12 182. 0.00154 2.25230 133. RY (10)Co 1 183. 0.00146 1.54293 942. RY ( 4) C 15 184. 0.00142 1.74833 134. RY (11)Co 1 185. 0.00135 1.21445 1252. RY ( 1) H 25 186. 0.00134 2.04963 213. RY ( 5) S 2 187. 0.00132 2.01816 678. RY ( 9) P 10 188. 0.00127 2.33104 457. RY ( 5) S 6 189. 0.00118 1.16331 991. RY ( 1) H 16 190. 0.00117 1.93294 838. RY ( 4) C 13 191. 0.00115 1.18713 1165. RY ( 1) H 22 192. 0.00111 1.28332 1339. RY ( 1) H 28 193. 0.00110 1.05903 1078. RY ( 1) H 19 194. 0.00109 2.54284 135. RY (12)Co 1 195. 0.00106 2.93641 567. RY ( 2) C 8 196. 0.00106 1.63691 679. RY (10) P 10 197. 0.00105 2.53108 214. RY ( 6) S 2 198. 0.00105 2.41888 458. RY ( 6) S 6 199. 0.00099 2.86201 735. RY ( 5) C 11 200. 0.00094 1.18389 568. RY ( 3) C 8 201. 0.00092 2.93781 891. RY ( 5) C 14 202. 0.00091 3.00139 619. RY ( 2) C 9 203. 0.00090 3.17477 515. RY ( 2) C 7 204. 0.00087 3.12206 839. RY ( 5) C 13 205. 0.00083 1.88292 136. RY (13)Co 1 206. 0.00082 1.65738 274. RY ( 5) S 3 207. 0.00080 1.29274 516. RY ( 3) C 7 208. 0.00078 2.59537 1107. RY ( 1) H 20 209. 0.00078 1.64132 396. RY ( 5) S 5 210. 0.00078 1.39756 620. RY ( 3) C 9 211. 0.00078 2.60386 943. RY ( 5) C 15 212. 0.00078 2.64988 1136. RY ( 1) H 21 213. 0.00077 2.34090 215. RY ( 7) S 2 214. 0.00075 3.03697 787. RY ( 5) C 12 215. 0.00073 2.68301 1166. RY ( 2) H 22 216. 0.00072 2.56189 736. RY ( 6) C 11 217. 0.00072 2.62465 1194. RY ( 1) H 23 218. 0.00072 2.70469 992. RY ( 2) H 16 219. 0.00071 2.71890 1049. RY ( 1) H 18 220. 0.00070 1.68519 137. RY (14)Co 1 221. 0.00069 2.57538 1108. RY ( 2) H 20 222. 0.00068 2.83974 1079. RY ( 2) H 19 223. 0.00068 2.23914 459. RY ( 7) S 6 224. 0.00066 2.88153 944. RY ( 6) C 15 225. 0.00065 2.88420 1020. RY ( 1) H 17 226. 0.00065 2.87099 1223. RY ( 1) H 24 227. 0.00065 2.26149 1310. RY ( 1) H 27 228. 0.00062 2.53770 1195. RY ( 2) H 23 229. 0.00062 1.65578 335. RY ( 5) S 4 230. 0.00062 2.40364 1050. RY ( 2) H 18 231. 0.00060 1.87860 460. RY ( 8) S 6 232. 0.00060 2.39965 1368. RY ( 1) H 29 233. 0.00058 3.93902 138. RY (15)Co 1 234. 0.00057 2.63433 1137. RY ( 2) H 21 235. 0.00057 2.68013 1281. RY ( 1) H 26 236. 0.00053 1.80452 216. RY ( 8) S 2 237. 0.00053 2.38117 139. RY (16)Co 1 238. 0.00052 3.00016 1021. RY ( 2) H 17 239. 0.00052 2.72107 1253. RY ( 2) H 25 240. 0.00050 2.88435 1340. RY ( 2) H 28 241. 0.00050 3.08146 1224. RY ( 2) H 24 242. 0.00049 5.05415 945. RY ( 7) C 15 243. 0.00049 2.98275 1341. RY ( 3) H 28 244. 0.00049 1.91757 1311. RY ( 2) H 27 245. 0.00049 4.92875 737. RY ( 7) C 11 246. 0.00049 2.99875 1254. RY ( 3) H 25 247. 0.00047 0.80432 336. RY ( 6) S 4 248. 0.00047 1.62585 217. RY ( 9) S 2 249. 0.00047 3.02629 1312. RY ( 3) H 27 250. 0.00046 4.91473 840. RY ( 6) C 13 251. 0.00046 4.68708 788. RY ( 6) C 12 252. 0.00045 1.51904 461. RY ( 9) S 6 253. 0.00044 4.70284 892. RY ( 6) C 14 254. 0.00043 1.62363 517. RY ( 4) C 7 255. 0.00043 2.77963 680. RY (11) P 10 256. 0.00042 1.04280 275. RY ( 6) S 3 257. 0.00042 0.97756 397. RY ( 6) S 5 258. 0.00042 1.55201 621. RY ( 4) C 9 259. 0.00042 2.11943 1109. RY ( 3) H 20 260. 0.00041 2.86410 1167. RY ( 3) H 22 261. 0.00040 2.85382 993. RY ( 3) H 16 262. 0.00040 2.96494 1282. RY ( 2) H 26 263. 0.00039 1.96633 1369. RY ( 2) H 29 264. 0.00037 3.10422 1370. RY ( 3) H 29 265. 0.00037 1.66229 398. RY ( 7) S 5 266. 0.00037 2.33918 1051. RY ( 3) H 18 267. 0.00036 1.66867 276. RY ( 7) S 3 268. 0.00036 3.36554 893. RY ( 7) C 14 269. 0.00036 0.84506 337. RY ( 7) S 4 270. 0.00036 2.69339 140. RY (17)Co 1 271. 0.00036 3.22638 789. RY ( 7) C 12 272. 0.00035 2.08617 1283. RY ( 3) H 26 273. 0.00035 3.43007 738. RY ( 8) C 11 274. 0.00034 3.22697 1080. RY ( 3) H 19 275. 0.00033 2.24806 1138. RY ( 3) H 21 276. 0.00033 3.56358 841. RY ( 7) C 13 277. 0.00032 3.64603 946. RY ( 8) C 15 278. 0.00032 2.83091 1255. RY ( 4) H 25 279. 0.00032 2.98689 681. RY (12) P 10 280. 0.00032 2.69377 1342. RY ( 4) H 28 281. 0.00031 2.40632 1196. RY ( 3) H 23 282. 0.00029 0.82817 399. RY ( 8) S 5 283. 0.00029 2.53606 1313. RY ( 4) H 27 284. 0.00029 0.79550 277. RY ( 8) S 3 285. 0.00029 2.52475 682. RY (13) P 10 286. 0.00028 2.15429 1225. RY ( 3) H 24 287. 0.00028 2.42005 842. RY ( 8) C 13 288. 0.00027 2.18830 1022. RY ( 3) H 17 289. 0.00027 2.99224 141. RY (18)Co 1 290. 0.00027 1.99827 569. RY ( 4) C 8 291. 0.00025 2.84336 790. RY ( 8) C 12 292. 0.00026 2.87979 1284. RY ( 4) H 26 293. 0.00025 2.52458 894. RY ( 8) C 14 294. 0.00024 2.07919 739. RY ( 9) C 11 295. 0.00024 2.79765 142. RY (19)Co 1 296. 0.00024 1.97770 338. RY ( 8) S 4 297. 0.00024 1.65608 462. RY (10) S 6 298. 0.00023 1.32754 570. RY ( 5) C 8 299. 0.00023 3.26445 1371. RY ( 4) H 29 300. 0.00023 1.33412 218. RY (10) S 2 301. 0.00022 3.02340 683. RY (14) P 10 302. 0.00022 1.71167 1110. RY ( 4) H 20 303. 0.00022 1.64757 518. RY ( 5) C 7 304. 0.00021 1.62750 994. RY ( 4) H 16 305. 0.00021 2.07009 219. RY (11) S 2 306. 0.00021 1.66439 1081. RY ( 4) H 19 307. 0.00020 1.62320 622. RY ( 5) C 9 308. 0.00020 1.91774 947. RY ( 9) C 15 309. 0.00020 2.95357 684. RY (15) P 10 310. 0.00020 1.59984 1168. RY ( 4) H 22 311. 0.00020 2.63575 791. RY ( 9) C 12 312. 0.00020 2.38805 1372. RY ( 5) H 29 313. 0.00019 2.56662 740. RY (10) C 11 314. 0.00019 2.83816 895. RY ( 9) C 14 315. 0.00019 2.14729 463. RY (11) S 6 316. 0.00019 2.98956 685. RY (16) P 10 317. 0.00018 1.52195 571. RY ( 6) C 8 318. 0.00017 3.58014 1314. RY ( 5) H 27 319. 0.00017 2.48458 1285. RY ( 5) H 26 320. 0.00017 1.39827 1139. RY ( 4) H 21 321. 0.00016 2.35373 843. RY ( 9) C 13 322. 0.00015 1.32958 519. RY ( 6) C 7 323. 0.00015 2.54519 686. RY (17) P 10 324. 0.00015 2.48151 143. RY (20)Co 1 325. 0.00015 2.74263 144. RY (21)Co 1 326. 0.00014 1.82614 278. RY ( 9) S 3 327. 0.00014 2.83523 948. RY (10) C 15 328. 0.00014 3.62122 1256. RY ( 5) H 25 329. 0.00013 2.27476 464. RY (12) S 6 330. 0.00013 2.46279 220. RY (12) S 2 331. 0.00013 1.15681 623. RY ( 6) C 9 332. 0.00013 2.23647 741. RY (11) C 11 333. 0.00013 2.00151 1197. RY ( 4) H 23 334. 0.00013 3.53605 1343. RY ( 5) H 28 335. 0.00013 1.77801 400. RY ( 9) S 5 336. 0.00013 1.23953 1226. RY ( 4) H 24 337. 0.00012 1.80872 1052. RY ( 4) H 18 338. 0.00012 3.19344 792. RY (10) C 12 339. 0.00012 2.53307 949. RY (11) C 15 340. 0.00012 1.68670 1023. RY ( 4) H 17 341. 0.00012 2.62505 687. RY (18) P 10 342. 0.00011 1.64601 279. RY (10) S 3 343. 0.00011 1.16316 520. RY ( 7) C 7 344. 0.00011 2.09613 572. RY ( 7) C 8 345. 0.00011 1.61447 624. RY ( 7) C 9 346. 0.00011 3.25933 896. RY (10) C 14 347. 0.00010 2.67529 145. RY (22)Co 1 348. 0.00010 2.08519 339. RY ( 9) S 4 349. 0.00010 1.67430 401. RY (10) S 5 350. 0.00010 1.76034 465. RY (13) S 6 351. 0.00009 1.72786 793. RY (11) C 12 352. 0.00009 3.34820 844. RY (10) C 13 353. 0.00009 1.21271 573. RY ( 8) C 8 354. 0.00008 2.67786 146. RY (23)Co 1 355. 0.00008 2.32197 897. RY (11) C 14 356. 0.00008 1.66907 221. RY (13) S 2 357. 0.00008 1.92681 222. RY (14) S 2 358. 0.00007 2.45780 466. RY (14) S 6 359. 0.00007 2.80439 1024. RY ( 5) H 17 360. 0.00008 2.87154 1198. RY ( 5) H 23 361. 0.00007 2.83815 1227. RY ( 5) H 24 362. 0.00007 1.88113 574. RY ( 9) C 8 363. 0.00007 2.44981 845. RY (11) C 13 364. 0.00007 3.63365 147. RY (24)Co 1 365. 0.00007 1.83017 521. RY ( 8) C 7 366. 0.00007 3.00444 688. RY (19) P 10 367. 0.00007 2.98833 794. RY (12) C 12 368. 0.00007 3.34997 846. RY (12) C 13 369. 0.00006 1.42205 625. RY ( 8) C 9 370. 0.00006 3.29047 742. RY (12) C 11 371. 0.00006 3.56393 950. RY (12) C 15 372. 0.00006 2.74499 898. RY (12) C 14 373. 0.00006 2.39148 1082. RY ( 5) H 19 374. 0.00006 2.99542 1140. RY ( 5) H 21 375. 0.00006 2.90033 689. RY (20) P 10 376. 0.00006 3.66365 743. RY (13) C 11 377. 0.00006 3.10920 1053. RY ( 5) H 18 378. 0.00005 2.81513 626. RY ( 9) C 9 379. 0.00005 2.90969 899. RY (13) C 14 380. 0.00006 3.66988 951. RY (13) C 15 381. 0.00005 5.30573 148. RY (25)Co 1 382. 0.00005 1.85796 223. RY (15) S 2 383. 0.00005 1.54670 467. RY (15) S 6 384. 0.00005 2.64667 995. RY ( 5) H 16 385. 0.00005 2.48225 1169. RY ( 5) H 22 386. 0.00005 2.94311 522. RY ( 9) C 7 387. 0.00005 2.96600 795. RY (13) C 12 388. 0.00005 3.22287 847. RY (13) C 13 389. 0.00005 1.97397 340. RY (10) S 4 390. 0.00005 1.98388 575. RY (10) C 8 391. 0.00005 3.75389 744. RY (14) C 11 392. 0.00004 1.73353 468. RY (16) S 6 393. 0.00004 3.66827 1111. RY ( 5) H 20 394. 0.00004 1.46100 224. RY (16) S 2 395. 0.00004 5.16445 848. RY (14) C 13 396. 0.00004 4.31346 1257. RY ( 6) H 25 397. 0.00004 1.70803 280. RY (11) S 3 398. 0.00004 1.61858 402. RY (11) S 5 399. 0.00004 2.16194 627. RY (10) C 9 400. 0.00004 3.88024 952. RY (14) C 15 401. 0.00004 4.05717 1344. RY ( 6) H 28 402. 0.00004 3.94681 900. RY (14) C 14 403. 0.00004 3.09176 149. RY (26)Co 1 404. 0.00004 1.96385 469. RY (17) S 6 405. 0.00004 1.46119 341. RY (11) S 4 406. 0.00004 1.72057 523. RY (10) C 7 407. 0.00004 5.25512 796. RY (14) C 12 408. 0.00004 6.47503 1315. RY ( 6) H 27 409. 0.00003 1.88924 225. RY (17) S 2 410. 0.00003 1.88844 281. RY (12) S 3 411. 0.00003 5.26027 1112. RY ( 6) H 20 412. 0.00003 3.74381 901. RY (15) C 14 413. 0.00003 4.94798 1286. RY ( 6) H 26 414. 0.00003 4.48365 745. RY (15) C 11 415. 0.00003 3.56203 226. RY (18) S 2 416. 0.00003 2.96533 746. RY (16) C 11 417. 0.00003 4.42003 953. RY (15) C 15 418. 0.00003 3.81827 1054. RY ( 6) H 18 419. 0.00003 5.69259 1258. RY ( 7) H 25 420. 0.00003 1.88062 282. RY (13) S 3 421. 0.00003 2.91745 797. RY (15) C 12 422. 0.00003 3.60219 150. RY (27)Co 1 423. 0.00003 1.77922 403. RY (12) S 5 424. 0.00003 2.75750 576. RY (11) C 8 425. 0.00003 4.04361 690. RY (21) P 10 426. 0.00003 4.01541 1141. RY ( 6) H 21 427. 0.00003 3.74195 1199. RY ( 6) H 23 428. 0.00003 4.48178 1373. RY ( 6) H 29 429. 0.00003 4.04038 849. RY (15) C 13 430. 0.00002 1.83924 404. RY (13) S 5 431. 0.00003 2.38752 470. RY (18) S 6 432. 0.00003 4.38873 747. RY (17) C 11 433. 0.00003 4.14288 954. RY (16) C 15 434. 0.00003 4.98773 1287. RY ( 7) H 26 435. 0.00003 5.37925 1345. RY ( 7) H 28 436. 0.00003 5.46918 1374. RY ( 7) H 29 437. 0.00003 3.63626 1025. RY ( 6) H 17 438. 0.00002 4.09308 798. RY (16) C 12 439. 0.00002 4.39498 850. RY (16) C 13 440. 0.00002 4.20477 902. RY (16) C 14 441. 0.00002 3.18191 151. RY (28)Co 1 442. 0.00002 3.44338 152. RY (29)Co 1 443. 0.00002 3.76537 153. RY (30)Co 1 444. 0.00002 3.66435 471. RY (19) S 6 445. 0.00002 1.79841 524. RY (11) C 7 446. 0.00002 4.61805 691. RY (22) P 10 447. 0.00002 3.67671 692. RY (23) P 10 448. 0.00002 3.44153 851. RY (17) C 13 449. 0.00002 3.78563 955. RY (17) C 15 450. 0.00002 3.68138 1228. RY ( 6) H 24 451. 0.00002 3.62158 1316. RY ( 7) H 27 452. 0.00002 2.42052 227. RY (19) S 2 453. 0.00002 1.94424 342. RY (12) S 4 454. 0.00002 2.66981 577. RY (12) C 8 455. 0.00002 1.83040 628. RY (11) C 9 456. 0.00002 4.39612 799. RY (17) C 12 457. 0.00002 3.68389 903. RY (17) C 14 458. 0.00002 4.08125 1113. RY ( 7) H 20 459. 0.00002 4.80805 1259. RY ( 8) H 25 460. 0.00002 4.88688 1346. RY ( 8) H 28 461. 0.00002 3.47637 154. RY (31)Co 1 462. 0.00002 4.20281 1026. RY ( 7) H 17 463. 0.00002 5.43511 1142. RY ( 7) H 21 464. 0.00002 4.84503 1288. RY ( 8) H 26 465. 0.00002 5.05351 1317. RY ( 8) H 27 466. 0.00002 4.78767 1375. RY ( 8) H 29 467. 0.00002 2.31782 283. RY (14) S 3 468. 0.00002 2.36950 405. RY (14) S 5 469. 0.00002 2.87738 629. RY (12) C 9 470. 0.00002 4.30077 693. RY (24) P 10 471. 0.00002 3.88174 748. RY (18) C 11 472. 0.00002 4.22517 1083. RY ( 6) H 19 473. 0.00002 5.47991 1347. RY ( 9) H 28 474. 0.00001 2.39437 228. RY (20) S 2 475. 0.00001 3.52320 284. RY (15) S 3 476. 0.00001 2.56723 525. RY (12) C 7 477. 0.00002 2.58802 578. RY (13) C 8 478. 0.00002 3.84440 800. RY (18) C 12 479. 0.00002 4.49629 852. RY (18) C 13 480. 0.00001 3.36928 155. RY (32)Co 1 481. 0.00001 4.99750 156. RY (33)Co 1 482. 0.00001 2.41134 343. RY (13) S 4 483. 0.00001 3.76094 406. RY (15) S 5 484. 0.00001 1.98482 472. RY (20) S 6 485. 0.00001 2.46851 630. RY (13) C 9 486. 0.00001 3.88670 904. RY (18) C 14 487. 0.00002 4.14968 1114. RY ( 8) H 20 488. 0.00002 4.57264 1170. RY ( 6) H 22 489. 0.00002 4.07036 1200. RY ( 7) H 23 490. 0.00002 4.47910 1229. RY ( 7) H 24 491. 0.00002 5.65948 1260. RY ( 9) H 25 492. 0.00001 5.14631 1055. RY ( 7) H 18 493. 0.00001 2.54051 526. RY (13) C 7 494. 0.00001 2.99119 853. RY (19) C 13 495. 0.00001 4.79166 956. RY (18) C 15 496. 0.00001 1.94908 229. RY (21) S 2 497. 0.00001 5.14539 694. RY (25) P 10 498. 0.00001 4.18571 749. RY (19) C 11 499. 0.00001 2.85972 957. RY (19) C 15 500. 0.00001 4.18623 996. RY ( 6) H 16 501. 0.00001 3.91937 1056. RY ( 8) H 18 502. 0.00001 5.36030 1289. RY ( 9) H 26 503. 0.00001 6.65893 1318. RY ( 9) H 27 504. 0.00001 4.44294 157. RY (34)Co 1 505. 0.00001 3.25048 285. RY (16) S 3 506. 0.00001 2.85587 407. RY (16) S 5 507. 0.00001 1.87252 473. 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RY (19) H 18 1165. 0.00000 9.52922 1068. RY (20) H 18 1166. 0.00000 4.68128 1069. RY (21) H 18 1167. 0.00000 6.09286 1087. RY (10) H 19 1168. 0.00000 8.98652 1070. RY (22) H 18 1169. 0.00000 8.84847 1071. RY (23) H 18 1170. 0.00000 9.52373 1072. RY (24) H 18 1171. 0.00000 8.55770 1073. RY (25) H 18 1172. 0.00000 7.70274 1074. RY (26) H 18 1173. 0.00000 7.36468 1075. RY (27) H 18 1174. 0.00000 7.23256 1076. RY (28) H 18 1175. 0.00000 7.83561 1077. RY (29) H 18 1176. 0.00000 7.23825 1088. RY (11) H 19 1177. 0.00000 7.20790 1089. RY (12) H 19 1178. 0.00000 7.48657 1090. RY (13) H 19 1179. 0.00000 8.31481 1091. RY (14) H 19 1180. 0.00000 7.65306 1092. RY (15) H 19 1181. 0.00000 7.06942 1093. RY (16) H 19 1182. 0.00000 6.90381 1094. RY (17) H 19 1183. 0.00000 7.11621 1095. RY (18) H 19 1184. 0.00000 6.35655 1096. RY (19) H 19 1185. 0.00000 3.71717 1097. RY (20) H 19 1186. 0.00000 6.17909 1098. RY (21) H 19 1187. 0.00000 5.42929 1099. RY (22) H 19 1188. 0.00000 7.33483 1100. RY (23) H 19 1189. 0.00000 4.63377 1117. RY (11) H 20 1190. 0.00000 10.12110 1118. RY (12) H 20 1191. 0.00000 4.80804 1119. RY (13) H 20 1192. 0.00000 5.06603 1144. RY ( 9) H 21 1193. 0.00000 5.75824 1145. RY (10) H 21 1194. 0.00000 4.91931 1146. RY (11) H 21 1195. 0.00000 5.04234 1147. RY (12) H 21 1196. 0.00001 3.36645 1172. RY ( 8) H 22 1197. 0.00001 5.72503 1201. RY ( 8) H 23 1198. 0.00001 5.49574 1231. RY ( 9) H 24 1199. 0.00001 4.89038 1319. RY (10) H 27 1200. 0.00001 3.40787 1377. RY (10) H 29 1201. 0.00001 3.95963 1262. RY (11) H 25 1202. 0.00000 7.84903 1173. RY ( 9) H 22 1203. 0.00000 5.04443 1174. RY (10) H 22 1204. 0.00000 4.73483 1202. RY ( 9) H 23 1205. 0.00000 6.05864 1203. RY (10) H 23 1206. 0.00000 4.62352 1232. RY (10) H 24 1207. 0.00000 9.21961 1101. RY (24) H 19 1208. 0.00000 8.79258 1102. RY (25) H 19 1209. 0.00000 9.01977 1103. RY (26) H 19 1210. 0.00000 8.50192 1104. RY (27) H 19 1211. 0.00000 7.34200 1105. RY (28) H 19 1212. 0.00000 7.03190 1106. RY (29) H 19 1213. 0.00000 6.67713 1120. RY (14) H 20 1214. 0.00000 7.03926 1121. RY (15) H 20 1215. 0.00000 7.77809 1122. RY (16) H 20 1216. 0.00000 6.60796 1123. RY (17) H 20 1217. 0.00000 5.29133 1124. RY (18) H 20 1218. 0.00000 6.85182 1125. RY (19) H 20 1219. 0.00000 5.98224 1126. RY (20) H 20 1220. 0.00000 5.76863 1127. RY (21) H 20 1221. 0.00000 8.07592 1128. RY (22) H 20 1222. 0.00000 9.34561 1129. RY (23) H 20 1223. 0.00000 8.37962 1130. RY (24) H 20 1224. 0.00000 8.21743 1131. RY (25) H 20 1225. 0.00000 8.66467 1132. RY (26) H 20 1226. 0.00000 8.69580 1133. RY (27) H 20 1227. 0.00000 8.10586 1134. RY (28) H 20 1228. 0.00000 7.78815 1135. RY (29) H 20 1229. 0.00000 8.55136 1148. RY (13) H 21 1230. 0.00000 7.19611 1149. RY (14) H 21 1231. 0.00000 6.38283 1150. RY (15) H 21 1232. 0.00000 6.49203 1151. RY (16) H 21 1233. 0.00000 7.17288 1152. RY (17) H 21 1234. 0.00000 6.50044 1153. RY (18) H 21 1235. 0.00000 3.88701 1154. RY (19) H 21 1236. 0.00000 6.82140 1155. RY (20) H 21 1237. 0.00000 8.96990 1156. RY (21) H 21 1238. 0.00000 9.62584 1157. RY (22) H 21 1239. 0.00000 9.09958 1158. RY (23) H 21 1240. 0.00000 8.35975 1159. RY (24) H 21 1241. 0.00000 9.06885 1160. RY (25) H 21 1242. 0.00000 6.95069 1161. RY (26) H 21 1243. 0.00000 7.55333 1162. RY (27) H 21 1244. 0.00000 7.87637 1163. RY (28) H 21 1245. 0.00000 7.64827 1164. RY (29) H 21 1246. 0.00000 8.36899 1175. RY (11) H 22 1247. 0.00000 8.02586 1176. RY (12) H 22 1248. 0.00000 8.39272 1177. RY (13) H 22 1249. 0.00000 7.36518 1178. RY (14) H 22 1250. 0.00000 6.62984 1179. RY (15) H 22 1251. 0.00000 6.81115 1180. RY (16) H 22 1252. 0.00000 7.58068 1181. RY (17) H 22 1253. 0.00000 6.99205 1182. RY (18) H 22 1254. 0.00000 5.27835 1183. RY (19) H 22 1255. 0.00000 5.49526 1184. RY (20) H 22 1256. 0.00000 5.50049 1185. RY (21) H 22 1257. 0.00000 6.06272 1186. RY (22) H 22 1258. 0.00000 5.40575 1187. RY (23) H 22 1259. 0.00000 4.56418 1204. RY (11) H 23 1260. 0.00000 9.06832 1188. RY (24) H 22 1261. 0.00000 8.34342 1189. RY (25) H 22 1262. 0.00000 8.97670 1190. RY (26) H 22 1263. 0.00000 7.99412 1191. RY (27) H 22 1264. 0.00000 7.58307 1192. RY (28) H 22 1265. 0.00000 7.72989 1193. RY (29) H 22 1266. 0.00000 7.93721 1205. RY (12) H 23 1267. 0.00000 7.13279 1206. RY (13) H 23 1268. 0.00000 6.57982 1207. RY (14) H 23 1269. 0.00000 7.61107 1208. RY (15) H 23 1270. 0.00000 6.11633 1209. RY (16) H 23 1271. 0.00000 6.15424 1210. RY (17) H 23 1272. 0.00000 6.29884 1211. RY (18) H 23 1273. 0.00000 5.66145 1212. RY (19) H 23 1274. 0.00000 6.05295 1213. RY (20) H 23 1275. 0.00000 5.27311 1214. RY (21) H 23 1276. 0.00000 9.59054 1215. RY (22) H 23 1277. 0.00000 8.90198 1216. RY (23) H 23 1278. 0.00000 9.14679 1217. RY (24) H 23 1279. 0.00000 8.54197 1218. RY (25) H 23 1280. 0.00000 8.62016 1219. RY (26) H 23 1281. 0.00000 8.68084 1220. RY (27) H 23 1282. 0.00000 7.58119 1221. RY (28) H 23 1283. 0.00000 7.48111 1222. RY (29) H 23 1284. 0.00000 7.89323 1233. RY (11) H 24 1285. 0.00000 6.70701 1234. RY (12) H 24 1286. 0.00000 6.60894 1235. RY (13) H 24 1287. 0.00000 8.69573 1236. RY (14) H 24 1288. 0.00000 6.89725 1237. RY (15) H 24 1289. 0.00000 5.80968 1238. RY (16) H 24 1290. 0.00000 7.14505 1239. RY (17) H 24 1291. 0.00000 5.14822 1240. RY (18) H 24 1292. 0.00000 7.15571 1241. RY (19) H 24 1293. 0.00000 6.03799 1242. RY (20) H 24 1294. 0.00000 6.61877 1243. RY (21) H 24 1295. 0.00000 4.54722 1244. RY (22) H 24 1296. 0.00000 6.22204 1263. RY (12) H 25 1297. 0.00000 5.86683 1264. RY (13) H 25 1298. 0.00000 5.07112 1265. RY (14) H 25 1299. 0.00001 4.94956 1291. RY (11) H 26 1300. 0.00001 3.35104 1320. RY (11) H 27 1301. 0.00000 7.52171 1292. RY (12) H 26 1302. 0.00000 6.07629 1293. RY (13) H 26 1303. 0.00000 7.87301 1321. RY (12) H 27 1304. 0.00000 8.36832 1245. RY (23) H 24 1305. 0.00000 9.04082 1246. RY (24) H 24 1306. 0.00000 8.15984 1247. RY (25) H 24 1307. 0.00000 8.70933 1248. RY (26) H 24 1308. 0.00000 8.42782 1249. RY (27) H 24 1309. 0.00000 7.76211 1250. RY (28) H 24 1310. 0.00000 8.15148 1251. RY (29) H 24 1311. 0.00000 7.75188 1266. RY (15) H 25 1312. 0.00000 6.54962 1267. RY (16) H 25 1313. 0.00000 7.32235 1268. RY (17) H 25 1314. 0.00000 7.15946 1269. RY (18) H 25 1315. 0.00000 7.90435 1270. RY (19) H 25 1316. 0.00000 7.67064 1271. RY (20) H 25 1317. 0.00000 8.51216 1272. RY (21) H 25 1318. 0.00000 9.07184 1273. RY (22) H 25 1319. 0.00000 7.99023 1274. RY (23) H 25 1320. 0.00000 8.42046 1275. RY (24) H 25 1321. 0.00000 8.62188 1276. RY (25) H 25 1322. 0.00000 7.18084 1277. RY (26) H 25 1323. 0.00000 8.19986 1278. RY (27) H 25 1324. 0.00000 8.55428 1279. RY (28) H 25 1325. 0.00000 7.63769 1280. RY (29) H 25 1326. 0.00000 7.44800 1294. RY (14) H 26 1327. 0.00000 6.68392 1295. RY (15) H 26 1328. 0.00000 7.50356 1296. RY (16) H 26 1329. 0.00000 7.29620 1297. RY (17) H 26 1330. 0.00000 7.36697 1298. RY (18) H 26 1331. 0.00000 7.78735 1299. RY (19) H 26 1332. 0.00000 4.99405 1300. RY (20) H 26 1333. 0.00000 9.20394 1301. RY (21) H 26 1334. 0.00000 9.10070 1302. RY (22) H 26 1335. 0.00000 8.28705 1303. RY (23) H 26 1336. 0.00000 8.26708 1304. RY (24) H 26 1337. 0.00000 8.14179 1305. RY (25) H 26 1338. 0.00000 7.66187 1306. RY (26) H 26 1339. 0.00000 8.35269 1307. RY (27) H 26 1340. 0.00000 7.97935 1308. RY (28) H 26 1341. 0.00000 7.44688 1309. RY (29) H 26 1342. 0.00000 7.37669 1322. RY (13) H 27 1343. 0.00000 6.72868 1323. RY (14) H 27 1344. 0.00000 6.56157 1324. RY (15) H 27 1345. 0.00000 6.70506 1325. RY (16) H 27 1346. 0.00000 9.58917 1326. RY (17) H 27 1347. 0.00000 6.44782 1327. RY (18) H 27 1348. 0.00000 5.43744 1328. RY (19) H 27 1349. 0.00000 5.57934 1329. RY (20) H 27 1350. 0.00000 5.73262 1349. RY (11) H 28 1351. 0.00000 3.85944 1350. RY (12) H 28 1352. 0.00000 8.02292 1351. RY (13) H 28 1353. 0.00000 3.66541 1352. RY (14) H 28 1354. 0.00000 9.19993 1330. RY (21) H 27 1355. 0.00000 9.01360 1331. RY (22) H 27 1356. 0.00000 8.75778 1332. RY (23) H 27 1357. 0.00000 7.48088 1333. RY (24) H 27 1358. 0.00000 7.49249 1334. RY (25) H 27 1359. 0.00000 8.42702 1335. RY (26) H 27 1360. 0.00000 8.59962 1336. RY (27) H 27 1361. 0.00000 8.32077 1337. RY (28) H 27 1362. 0.00000 8.15772 1338. RY (29) H 27 1363. 0.00000 7.78191 1353. RY (15) H 28 1364. 0.00000 7.00303 1354. RY (16) H 28 1365. 0.00000 6.82277 1355. RY (17) H 28 1366. 0.00000 7.34034 1356. RY (18) H 28 1367. 0.00000 9.32234 1357. RY (19) H 28 1368. 0.00000 6.42601 1358. RY (20) H 28 1369. 0.00000 9.15952 1359. RY (21) H 28 1370. 0.00000 9.01425 1360. RY (22) H 28 1371. 0.00000 7.29586 1361. RY (23) H 28 1372. 0.00000 7.81355 1362. RY (24) H 28 1373. 0.00000 8.76073 1363. RY (25) H 28 1374. 0.00000 8.08593 1364. RY (26) H 28 1375. 0.00000 8.59753 1365. RY (27) H 28 1376. 0.00000 8.04112 1366. RY (28) H 28 1377. 0.00000 7.68314 1367. RY (29) H 28 1378. 0.00000 7.56241 1378. RY (11) H 29 1379. 0.00000 7.18417 1379. RY (12) H 29 1380. 0.00000 7.09745 1380. RY (13) H 29 1381. 0.00000 7.19559 1381. RY (14) H 29 1382. 0.00000 7.22245 1382. RY (15) H 29 1383. 0.00000 6.69670 1383. RY (16) H 29 1384. 0.00000 5.67912 1384. RY (17) H 29 1385. 0.00000 8.64742 1385. RY (18) H 29 1386. 0.00000 5.45731 1386. RY (19) H 29 1387. 0.00000 7.15342 1387. RY (20) H 29 1388. 0.00000 5.53985 1388. RY (21) H 29 1389. 0.00000 9.19468 1389. RY (22) H 29 1390. 0.00000 9.25084 1390. RY (23) H 29 1391. 0.00000 8.14687 1391. RY (24) H 29 1392. 0.00000 8.21544 1392. RY (25) H 29 1393. 0.00000 8.48016 1393. RY (26) H 29 1394. 0.00000 8.20308 1394. RY (27) H 29 1395. 0.00000 7.20241 1395. RY (28) H 29 1396. 0.00000 8.58467 1396. RY (29) H 29 Checkpoint orbital transformation(s) sent to host program NBO analysis completed in 48097.54 CPU seconds (7335 wall seconds) Maximum scratch memory used by NBO was 16981107 words (129.56 MB) Maximum scratch memory used by G16NBO was 2941355 words (22.44 MB) Opening RunExU unformatted file "/rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EUF" Read unf file /rds/general/user/rzepa/ephemeral/1669385.pbs-7/Gau-3876816.EUF: Label Gaussian matrix elements IVers= 2 NLab= 2 Version=ES64L-G16RevC.01 Title CMPSCO NAtoms= 29 NBasis= 1396 NBsUse= 1396 ICharg= 0 Multip= 1 NE= 184 Len12L=8 Len4L=8 IOpCl= 0 ICGU=111 GAUSSIAN SCALARS NI= 1 NR= 1 NTot= 1 LenBuf= 2 NRI=1 N= 1000 ALPHA ORBITAL ENERGIES NI= 0 NR= 1 NTot= 1396 LenBuf= 4000 NRI=1 N= 1396 ALPHA MO COEFFICIENTS NI= 0 NR= 1 NTot= 1948816 LenBuf= 4000 NRI=1 N= 1396 1396 Store file 10524 Len= 1948816. NPA CHARGES NI= 0 NR= 1 NTot= 29 LenBuf= 4000 NRI=1 N= 29 Recovered energy= -4028.48638363 dipole= 3.076962586982 0.206719410245 0.011736979924 Unable to Open any file for archive entry. 1\1\GINC-CX3-4-11\SP\RMN15L\def2QZVPP\C8H14Co1P1S5\RZEPA\08-Feb-2026\0 \\# pop(savenbos,nbo7read) def2qzvpp mn15l\\CMPSCO\\0,1\Co,0,0.568154, 0.559254,0.012705\S,0,-0.526815,-0.431015,-1.70112\S,0,-2.474975,0.129 266,-1.581886\S,0,-3.270681,-0.980542,-0.043992\S,0,-2.490721,-0.01969 6,1.5984\S,0,-0.528468,-0.537763,1.669116\C,0,2.95481,-1.227649,1.5231 85\C,0,1.38742,-2.787247,-0.276717\C,0,3.239276,-0.930656,-1.35773\P,0 ,2.010097,-1.098114,-0.026531\C,0,-0.06184,2.426577,0.648849\C,0,1.200 611,2.095285,1.254296\C,0,2.141899,1.900342,0.202937\C,0,1.474998,2.08 3436,-1.052115\C,0,0.113894,2.430699,-0.761532\H,0,3.69949,-2.037011,1 .457631\H,0,3.463813,-0.27962,1.750393\H,0,2.252311,-1.450775,2.342458 \H,0,2.208261,-3.497918,-0.087733\H,0,0.551338,-2.987477,0.407976\H,0, 1.03383,-2.902809,-1.310623\H,0,3.922423,-1.79513,-1.364257\H,0,2.7002 23,-0.88862,-2.318765\H,0,3.823543,-0.006016,-1.245231\H,0,-1.003459,2 .581125,1.172499\H,0,1.391428,1.968806,2.318211\H,0,3.186669,1.619703, 0.333544\H,0,-0.675826,2.578826,-1.495861\H,0,1.914487,1.960048,-2.040 633\\Version=ES64L-G16RevC.01\State=1-A\HF=-4028.4863836\RMSD=5.539e-0 9\Dipole=3.0769626,0.2067194,0.011737\Quadrupole=3.6553394,1.7291432,- 5.3844826,-5.1683069,-0.0216471,0.2959382\PG=C01 [X(C8H14Co1P1S5)]\\@ The archive entry for this job was punched. ABALONE: AN EXPRESSION OF DISBELIEF. Writing WrtUnf raw file "Rawbinaryarray.baf" Gaussian matrix elements Version 2 NLab=11 Len12L=4 Len4L=4 Write SHELL TO ATOM MAP from file 0 offset 0 length 436 to matrix element file. Write SHELL TYPES from file 0 offset 0 length 436 to matrix element file. Write NUMBER OF PRIMITIVES PER SHELL from file 0 offset 0 length 436 to matrix element file. Write PRIMITIVE EXPONENTS from file 0 offset 0 length 718 to matrix element file. Write CONTRACTION COEFFICIENTS from file 0 offset 0 length 718 to matrix element file. Write P(S=P) CONTRACTION COEFFICIENTS from file 0 offset 0 length 718 to matrix element file. Write COORDINATES OF EACH SHELL from file 0 offset 0 length 1308 to matrix element file. Write BONDS PER ATOM from file 0 offset 0 length 29 to matrix element file. Write BONDED ATOMS from file 0 offset 0 length 68 to matrix element file. Write BOND TYPES from file 0 offset 0 length 68 to matrix element file. Write ONIOM CHARGE/MULT from file 0 offset 0 length 32 to matrix element file. Write ONIOM ATOM LAYERS from file 0 offset 0 length 29 to matrix element file. Write ONIOM ATOM MODIFIERS from file 0 offset 0 length 29 to matrix element file. Write ONIOM ATOM TYPES from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK ATOMS from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK CHARGES from file 0 offset 0 length 29 to matrix element file. Write ONIOM LINK DISTANCES from file 0 offset 0 length 116 to matrix element file. Write SYMINF INTS from file 0 offset 0 length 26 to matrix element file. Write ROTTR TO SO from file 0 offset 0 length 12 to matrix element file. Write GAUSSIAN SCALARS from file 501 offset 0 to matrix element file. Write OPTIMIZATION FLAGS from file 0 offset 0 length 29 to matrix element file. Write INTEGER ISO from file 0 offset 0 length 29 to matrix element file. Write INTEGER SPIN from file 0 offset 0 length 29 to matrix element file. Write REAL ZEFFECTIVE from file 0 offset 0 length 29 to matrix element file. Write REAL QUADRUPOLEMOMENT from file 0 offset 0 length 29 to matrix element file. Write REAL GFACTOR from file 0 offset 0 length 29 to matrix element file. Write REAL ZNUCLEAR from file 0 offset 0 length 29 to matrix element file. Write MULLIKEN CHARGES from file 0 offset 0 length 29 to matrix element file. Write NUCLEAR GRADIENT from file 10584 offset 0 length 87 to matrix element file. Array NUCLEAR FORCE CONSTANTS on file 10585 does not exist. Write ELECTRIC DIPOLE MOMENT from file 0 offset 0 length 3 to matrix element file. Write NON-ADIABATIC COUPLING from file 10810 offset 0 length 87 to matrix element file. Write FINITE EM FIELD from file 10521 offset 0 length 35 to matrix element file. Write OVERLAP from file 10514 offset 0 length 975106 to matrix element file. Write CORE HAMILTONIAN ALPHA from file 10515 offset 0 length 975106 to matrix element file. Write CORE HAMILTONIAN BETA from file 10515 offset 975106 length 975106 to matrix element file. Write KINETIC ENERGY from file 10516 offset 0 length 975106 to matrix element file. Write ORTHOGONAL BASIS from file 10685 offset 0 length 1948816 to matrix element file. Write DIPOLE INTEGRALS from file 10518 offset 0 length 2925318 to matrix element file. Array DIP VEL INTEGRALS on file 10572 does not exist. Array R X DEL INTEGRALS on file 10572 does not exist. Write ALPHA ORBITAL ENERGIES from file 0 offset 0 length 1396 to matrix element file. Write ALPHA MO COEFFICIENTS from file 10524 offset 0 length 1948816 to matrix element file. Write ALPHA DENSITY MATRIX from file 0 offset 0 length 975106 to matrix element file. Write ALPHA FOCK MATRIX from file 10536 offset 0 length 975106 to matrix element file. Write ENERGY-WEIGHTED DENSITY from file 10571 offset 0 length 975106 to matrix element file. Write ALPHA SCF DENSITY MATRIX from file 0 offset 0 length 975106 to matrix element file. No 2e integrals to process. Job cpu time: 11 days 22 hours 2 minutes 54.1 seconds. Elapsed time: 0 days 2 hours 22 minutes 4.5 seconds. File lengths (MBytes): RWF= 1120 Int= 0 D2E= 0 Chk= 112 Scr= 16 Normal termination of Gaussian 16 at Sun Feb 8 10:59:11 2026.