Gaussian 09 GINC-KIMIK2107 CBGUSER 000138254 EM64L-G09RevD.01 12-Jul-2017 Gaussian 09 24-Apr-2013 EM64L-G09RevD.01 (6D, 10F) SDD RPBEPBE SDD FOpt #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 72.0642 0 1 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; g09 /mnt/data/applications/G09/g09/l1.exe "/scratch/Gau-25981.inp" -scrdir="/scratch/" chk=000138254.chk nprocshared=8 mem=21GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 1/7=-1,14=-1,18=20,19=15,26=3,38=1/1,3 2/9=110,12=2,15=1,17=6,18=5,40=1/2 3/5=17,6=7,11=2,16=1,24=10,25=1,30=1,71=1,74=1009/1,2,3 4//1 5/5=2,38=5/2 6/7=3,28=1,40=-1,79=1/1,7 7/30=1/1,2,3,16 1/7=-1,14=-1,18=20,19=15,26=3/3(2) 2/9=110,15=1/2 99//99 2/9=110,15=1/2 3/5=17,6=7,11=2,16=1,25=1,30=1,71=1,74=1009/1,2,3 4/5=5,16=3,69=1/1 5/5=2,38=5/2 7/30=1/1,2,3,16 1/7=-1,14=-1,18=20,19=15,26=3/3(-5) 2/9=110,15=1/2 6/7=3,19=2,28=1,40=-1,79=1/1,7 99/9=1/99 000138254 1 2 3 4 5 6 7 8 9 10 11 12 12 12 12 12 12 12 1 1 1 1 1 1 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 1 1 1 1 1 1 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 (Enter /mnt/data/applications/G09/g09/l101.exe) Initialization pass. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 1 1 1 1 2 2 2 3 4 5 6 2 3 7 8 9 10 11 4 5 6 12 1.5193 1.4682 1.0956 1.0956 1.0955 1.0956 1.0945 1.2006 1.3722 1.2 1.065 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 2 2 2 3 3 7 1 1 1 9 9 10 1 1 1 1 1 1 2 2 2 2 2 2 3 7 8 7 8 8 9 10 11 10 11 11 111.2806 109.3839 109.3829 109.7838 109.7844 107.1314 111.1752 111.1758 110.3302 107.8147 108.1125 108.1092 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A13 A14 A15 A16 A17 A18 A19 A20 1 3 4 5 1 3 4 5 3 4 5 6 3 4 5 6 4 5 6 12 4 5 6 12 9 9 9 9 9 9 9 9 -1 -1 -1 -1 -2 -2 -2 -2 180.1289 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 179.9606 180.0045 179.9971 179.895 180.0056 179.9462 179.9928 D1 D2 D3 D4 D5 D6 D7 D8 D9 3 3 3 7 7 7 8 8 8 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 2 9 10 11 9 10 11 9 10 11 -60.0632 60.0636 179.9983 61.4103 -178.4628 -58.5281 178.4631 -61.4101 58.5246 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 3.00e-01 1.00e-07 1.00e-06 50 100 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. 1 Symmetry operations used in ECPInt. ECPInt: NShTT= 1176 NPrTT= 6030 LenC2= 1133 LenP2D= 4362. LDataN: DoStor=T MaxTD1= 2 Len= 12 NBasis= 72 RedAO= T EigKep= 2.02D-03 NBF= 72 NBsUse= 72 1.00D-06 EigRej= -1.00D+00 NBFU= 72 Using GEDIIS/GDIIS optimizer. local minimum Step number 8 out of a maximum of 50 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00511 0.00566 0.02474 0.02844 0.04219 0.04733 0.04757 0.05394 0.05661 0.05734 0.06000 0.08873 0.10129 0.14172 0.15998 0.16000 0.16027 0.16177 0.22722 0.31175 0.33948 0.34175 0.34183 0.34265 0.34438 0.35416 0.37897 0.49965 1.02980 1.04763 RFO step: Lambda=-1.42060000D-07. 1 2 0.00056266 0.00000050 0.00000047 0.00000008 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 D1 D2 D3 D4 D5 D6 D7 D8 D9 2.93599 2.77838 2.09470 2.09470 2.08514 2.08514 2.08743 2.34534 2.59551 2.34355 2.03002 1.97346 1.91192 1.91192 1.90406 1.90412 1.85455 1.93392 1.93392 1.92093 1.88750 1.89321 1.89320 3.12711 3.14395 3.14339 3.14292 3.14982 3.14044 3.14049 3.13931 -1.04761 1.04769 -3.14156 1.08004 -3.10785 -1.01391 3.10785 -1.08004 1.01390 0.00013 -0.00006 -0.00002 -0.00002 -0.00002 -0.00002 -0.00002 -0.00009 0.00016 -0.00007 -0.00002 0.00000 -0.00004 -0.00003 0.00003 0.00002 0.00002 -0.00001 -0.00001 -0.00003 0.00001 0.00002 0.00002 0.00002 0.00000 -0.00008 0.00001 -0.00002 -0.00002 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 0.00001 0.00001 -0.00001 -0.00001 -0.00001 -0.00007 0.00004 0.00000 0.00000 0.00001 0.00001 0.00001 0.00000 0.00002 0.00000 0.00000 -0.00004 0.00002 0.00002 0.00000 0.00000 0.00002 0.00002 0.00002 0.00004 -0.00002 -0.00003 -0.00003 0.00005 -0.00001 -0.00007 0.00006 -0.00003 -0.00004 -0.00001 0.00001 0.00000 0.00000 0.00000 -0.00002 -0.00003 -0.00002 0.00002 0.00002 0.00002 0.00054 -0.00022 -0.00005 -0.00005 -0.00009 -0.00009 -0.00009 -0.00008 0.00028 -0.00006 -0.00007 0.00014 -0.00027 -0.00028 0.00028 0.00020 -0.00008 -0.00008 -0.00007 -0.00024 0.00010 0.00015 0.00016 0.00041 0.00003 -0.00150 0.00103 -0.00027 -0.00063 0.00010 0.00009 -0.00004 -0.00002 -0.00003 0.00021 0.00024 0.00023 -0.00020 -0.00018 -0.00019 0.00048 -0.00019 -0.00005 -0.00005 -0.00008 -0.00008 -0.00007 -0.00008 0.00030 -0.00006 -0.00006 0.00010 -0.00026 -0.00026 0.00027 0.00020 -0.00006 -0.00006 -0.00006 -0.00020 0.00008 0.00013 0.00013 0.00046 0.00002 -0.00157 0.00108 -0.00030 -0.00067 0.00010 0.00010 -0.00004 -0.00002 -0.00003 0.00019 0.00021 0.00021 -0.00018 -0.00016 -0.00017 2.93647 2.77819 2.09465 2.09464 2.08507 2.08507 2.08736 2.34526 2.59581 2.34349 2.02996 1.97356 1.91167 1.91166 1.90433 1.90432 1.85449 1.93386 1.93386 1.92073 1.88758 1.89334 1.89333 3.12757 3.14397 3.14182 3.14400 3.14952 3.13977 3.14059 3.13940 -1.04764 1.04767 -3.14158 1.08023 -3.10764 -1.01370 3.10768 -1.08019 1.01374 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000159 0.000043 0.001679 0.000563 0.002500 0.001667 0.010000 0.006667 YES YES YES YES -1.815810e-07 Optimization completed. -- Stationary point found. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 1 1 1 1 2 2 2 3 4 5 6 2 3 7 8 9 10 11 4 5 6 12 1.5537 1.4703 1.1085 1.1085 1.1034 1.1034 1.1046 1.2411 1.3735 1.2402 1.0742 -DE/DX = 0.0001|-DE/DX = -0.0001|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = -0.0001|-DE/DX = 0.0002|-DE/DX = -0.0001|-DE/DX = 0.0 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 2 2 2 3 3 7 1 1 1 9 9 10 1 1 1 1 1 1 2 2 2 2 2 2 3 7 8 7 8 8 9 10 11 10 11 11 113.0709 109.5452 109.5451 109.0944 109.0981 106.2579 110.8056 110.8052 110.0613 108.1458 108.4729 108.4726 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 A13 A14 A15 A16 A17 A18 A19 1 3 4 5 1 3 4 3 4 5 6 3 4 5 4 5 6 12 4 5 6 9 9 9 9 9 9 9 -1 -1 -1 -1 -2 -2 -2 179.17 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = -0.0001|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 180.1348 180.103 180.0759 180.4713 179.9342 179.937 D1 D2 D3 D4 D5 D6 D7 D8 3 3 3 7 7 7 8 8 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 9 10 11 9 10 11 9 10 -60.0233 60.0283 -179.9978 61.8818 -178.0666 -58.0927 178.0669 -61.8815 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 1 0 0 0 0 0 0 0 0 0 0 0 0 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; 0.000000 1.519253 0.000000 1.468161 2.466311 0.000000 2.668734 3.518848 1.200575 0.000000 4.040928 4.807309 2.572770 1.372194 0.000000 5.240971 5.964887 3.772813 2.572237 1.200043 0.000000 1.095628 2.147891 2.108270 3.208997 4.529671 5.704533 0.000000 1.095567 2.147833 2.108231 3.209226 4.530162 5.705283 1.762900 0.000000 2.170384 1.095477 2.740807 3.608124 4.778965 5.874835 2.508631 3.068228 0.000000 2.170452 1.095558 2.740854 3.608386 4.779475 5.875600 3.068368 2.508635 1.770500 0.000000 2.159078 1.094541 3.413160 4.536180 5.857319 7.028825 2.477071 2.477004 1.773025 1.773054 0.000000 6.305949 7.004156 4.837791 3.637216 2.265021 1.064978 6.754577 6.755498 6.876538 6.877475 8.075494 0.000000 22.1245852 1.3427150 1.2861580 -9.89332 -0.74426 -0.71401 -0.66868 -0.59032 -0.54618 -0.46453 -0.43650 -0.42160 -0.36711 -0.33234 -0.32758 -0.30589 -0.30331 -0.22157 -0.22115 -0.03716 -0.03647 0.08089 0.09773 0.10500 0.11703 0.13336 0.15008 0.16275 0.16536 0.17586 0.18268 0.20591 0.21083 0.24210 0.25377 0.25842 0.26300 0.27646 0.28188 0.32101 0.32283 0.37523 0.37743 0.42901 0.48172 0.48627 0.50233 0.59606 0.60866 0.61946 0.72478 0.80599 0.87733 0.90428 0.95839 0.97307 1.06007 1.08071 1.09425 1.09975 1.11882 1.21086 1.32069 1.36394 22.28527 22.53268 22.58417 22.64799 22.77641 22.85480 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V -9.92700 -9.92409 -9.91860 -9.91587 -9.90803 -9.89332 -0.74426 -0.71401 -0.66868 -0.59032 -0.54618 -0.46453 -0.43650 -0.42160 -0.36711 -0.33234 -0.32758 -0.30589 -0.30331 -0.22157 -0.22115 -0.03716 -0.03647 0.08089 0.09773 0.10500 0.11703 0.13336 0.15008 0.16275 0.16536 0.17586 0.18268 0.20591 0.21083 0.24210 0.25377 0.25842 0.26300 0.27646 0.28188 0.32101 0.32283 0.37523 0.37743 0.42901 0.48172 0.48627 0.50233 0.59606 0.60866 0.61946 0.72478 0.80599 0.87733 0.90428 0.95839 0.97307 1.06007 1.08071 1.09425 1.09975 1.11882 1.21086 1.32069 1.36394 22.28527 22.53268 22.58417 22.64799 22.77641 22.85480 0.60042 0.00127 -0.00546 0.00256 0.00016 -0.00098 -0.08210 0.05465 -0.02885 0.05469 -0.04104 -0.00995 0.01128 0.00001 0.01688 -0.00412 0.00000 -0.00252 0.00000 0.00091 0.00000 -0.00107 0.00002 -0.06321 0.05050 -0.02495 -0.00009 0.00708 0.00384 0.02442 0.00005 0.00406 -0.00916 0.00004 -0.01671 0.02533 0.00399 0.00004 0.00313 0.00000 -0.00618 0.00001 -0.00304 -0.00008 -0.02409 -0.06753 -0.01280 -0.00024 -0.01649 -0.01127 -0.00011 0.00107 -0.01510 -0.00125 -0.04539 0.09065 -0.10590 0.01862 0.00002 0.00150 0.00667 0.00000 0.01527 -0.02328 0.03686 0.00214 -0.47212 -0.98044 -0.02779 -1.36807 -0.16724 -0.13931 0.43386 0.00097 -0.00380 0.00185 0.00016 -0.00062 -0.10329 0.06853 -0.03644 0.06939 -0.05216 -0.01248 0.01454 0.00001 0.02187 -0.00510 -0.00001 -0.00333 0.00000 0.00128 0.00000 -0.00144 0.00002 -0.08145 0.06492 -0.03299 -0.00011 0.00845 0.00676 0.03069 0.00006 0.01024 -0.01180 0.00006 -0.02395 0.03647 0.00719 0.00005 0.00568 0.00000 -0.00971 0.00001 -0.00585 -0.00012 -0.03433 -0.09361 -0.01664 -0.00032 -0.02302 -0.01135 -0.00010 0.00256 -0.02251 -0.00851 -0.07092 0.15284 -0.16990 0.02878 0.00004 0.00007 0.01249 0.00000 0.02521 -0.04246 0.07877 0.00272 0.51224 1.07836 0.03062 1.51349 0.18623 0.15563 0.02071 -0.00039 -0.00121 -0.00001 -0.00050 -0.00025 0.28131 -0.18405 0.10827 -0.19757 0.15107 0.02979 -0.04346 -0.00002 -0.06763 0.01047 0.00001 0.01127 0.00000 -0.00480 0.00001 0.00161 -0.00007 0.17197 -0.12601 0.09353 0.00018 0.01763 -0.08544 -0.02865 -0.00002 -0.16591 0.02472 -0.00034 0.10293 -0.18097 -0.09083 -0.00033 -0.06752 0.00004 0.06722 -0.00010 0.07993 0.00062 0.17720 0.39092 0.02966 0.00058 0.10048 -0.06006 -0.00054 -0.04515 0.11273 0.19501 0.68647 -1.54903 1.56063 -0.24421 -0.00041 0.07980 -0.20043 0.00015 -0.26386 0.54963 -1.44537 -0.00088 -0.10787 -0.32866 -0.01156 -0.46966 -0.06772 -0.05338 -0.02760 0.00092 0.00807 0.00200 0.00359 0.00226 0.22099 -0.18193 -0.00175 -0.15494 0.17565 0.14078 0.01425 -0.00003 -0.04151 0.03332 0.00003 0.00709 0.00002 -0.01199 -0.00006 0.10952 -0.00008 2.43346 -1.70263 0.55577 0.00391 -0.51754 1.06114 -1.28935 -0.00279 1.59335 0.19988 0.00002 0.02801 0.28731 0.33884 0.00084 0.70463 -0.00046 -0.15142 0.00061 -0.69891 -0.00083 -0.24740 0.79002 1.30214 0.02351 -0.00337 -0.58829 -0.00887 0.33624 2.69838 -0.08288 -2.66791 4.82475 -4.16151 1.29941 0.00192 -1.19198 1.64777 -0.00198 -0.40866 -1.93392 6.78690 0.38008 0.00365 0.62710 0.03826 1.05202 0.26752 0.07843 0.00017 -0.00029 0.00000 -0.00020 -0.00001 -0.00004 0.04308 0.01150 -0.07989 -0.12811 -0.03225 -0.09762 0.35972 -0.00012 0.24409 -0.14763 -0.00007 -0.03966 0.00011 0.02195 -0.00005 0.00320 -0.00011 0.01063 0.09488 0.02301 -0.00056 0.08274 -0.28441 0.00574 -0.00006 -0.08648 0.34286 -0.00037 0.17955 -0.25269 -0.27945 -0.00052 0.00241 0.00007 0.43913 -0.00005 0.22186 0.00038 0.14517 -0.17777 0.57587 0.00977 -0.32345 0.28732 0.00224 -0.06093 0.51433 -0.12010 0.13067 0.20162 -0.08229 0.14543 0.00020 -0.05724 -0.01813 0.00037 -0.17751 0.27195 0.19935 -0.05121 0.01504 0.00445 -0.00010 0.00250 0.01171 0.01110 0.00011 -0.00002 -0.00004 -0.00009 -0.00008 0.00010 -0.03443 0.02804 -0.03003 -0.12107 0.08049 0.05516 -0.21133 0.00020 0.36822 0.20635 0.00010 -0.14600 -0.00008 0.10324 0.00003 0.00284 0.00000 0.18738 0.09222 0.00461 0.00031 -0.05082 0.22257 -0.02606 0.00002 0.24245 -0.00544 -0.00191 0.38365 -0.30028 0.18326 -0.00016 -0.24063 0.00001 -0.31349 -0.00010 0.01943 -0.00040 -0.07657 -0.69886 -0.00241 -0.00048 -0.33589 0.26000 0.00258 -0.03384 -0.26441 -0.07107 0.24658 -0.27366 0.07495 -0.03592 -0.00022 -0.07170 0.07791 -0.00043 0.05054 -0.01362 0.04008 -0.01008 -0.00077 -0.00796 0.00004 -0.00591 -0.00242 0.00250 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00004 -0.00002 -0.00001 0.00000 -0.00004 -0.00006 0.00021 0.43532 -0.00010 0.00011 -0.22385 0.00003 -0.20684 -0.00001 0.11964 0.00000 -0.00254 -0.00016 0.00006 -0.00054 0.23567 0.00022 -0.00073 -0.00105 0.36011 -0.00024 0.00056 -0.64873 -0.00270 0.00002 0.00003 -0.01477 0.00034 0.48503 -0.00050 -0.18000 0.00002 -0.33406 0.00126 0.00044 0.00397 -0.21531 0.00013 0.00050 -0.05185 -0.00013 0.00028 -0.00006 -0.00011 0.00029 -0.00015 0.00005 -0.34511 -0.00047 -0.00108 -0.46556 -0.00017 0.00018 0.00008 -0.00002 0.00001 0.00001 0.00000 0.00000 0.00001 0.00001 -0.00273 0.00239 0.00551 0.00173 0.00301 -0.00320 -0.00838 -0.02701 -0.00930 0.00649 0.02711 0.03141 0.11112 -0.00003 0.04405 -0.02441 0.00001 0.02087 0.00003 -0.04179 -0.00002 0.19359 0.00028 0.81166 0.79644 -0.04422 -0.00072 0.30708 -1.67272 -0.60621 -0.00339 2.10440 0.39840 0.00200 -0.09647 -0.00781 0.95797 0.00114 0.32813 0.00023 -0.14388 -0.00056 -0.91914 -0.00577 -1.27827 0.48466 -0.05044 -0.00072 1.26625 -1.95877 -0.02151 1.33877 0.94137 0.19798 0.75378 0.05549 -0.72000 0.41350 0.00002 -1.49364 1.80083 -0.00374 -0.33325 -0.21893 1.29567 0.35449 -0.20961 0.17686 0.14634 0.08755 0.07702 -0.00602 0.00084 0.00008 -0.00004 0.00018 0.00001 -0.00296 0.01000 -0.00863 0.00774 -0.00799 0.01266 0.01318 -0.05151 0.00005 0.07476 0.06450 0.00003 -0.02724 -0.00001 0.03078 -0.00001 0.09392 0.00033 0.32450 1.16603 -0.19316 -0.00015 0.68321 1.29641 0.03635 0.00041 -0.40545 0.07685 -0.00581 1.00316 -0.30892 0.10426 0.00060 0.98218 0.00066 1.29943 0.00097 -0.86034 -0.00184 -0.95784 1.07321 0.14650 0.00470 1.40773 -0.43325 -0.00389 1.72928 0.04140 -0.11876 0.37526 0.36241 -0.58583 0.21509 0.00049 0.13147 0.33524 0.00043 -0.29230 0.58799 -1.23522 0.03079 0.00614 0.04956 0.08467 -0.08330 -0.00634 -0.00791 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00004 -0.00006 -0.00005 0.00005 0.00012 0.00015 0.00016 0.10873 0.00000 0.00003 -0.08654 0.00002 -0.04790 -0.00003 0.02488 -0.00037 0.16779 0.00030 -0.00023 -0.00203 0.72288 0.00009 -0.00237 -0.00238 0.50275 0.00007 0.00174 -1.88664 -0.00757 -0.00098 -0.00018 1.18238 -0.00066 -0.86253 0.00028 2.21911 0.00017 3.40133 -0.01226 -0.00147 -0.04144 2.51299 -0.00169 -0.03204 3.31017 0.00264 0.00356 0.00225 0.00020 0.00002 0.00103 0.00157 1.30864 0.00077 0.00590 2.22709 -0.00088 -0.00147 0.00222 0.00067 -0.00008 0.00005 0.00003 0.00015 0.00016 -0.00017 0.00098 -0.00007 -0.00017 0.00002 -0.00014 0.60041 -0.05184 0.04568 -0.04986 -0.08726 0.02928 0.00324 -0.00303 0.00000 -0.00078 0.00134 0.00000 -0.00754 0.00000 0.01325 0.00000 -0.02244 -0.00005 -0.04008 -0.06011 0.00429 0.00001 -0.02858 0.01048 -0.00426 0.00001 0.01873 0.02420 0.00004 -0.00853 0.00776 0.00303 0.00002 0.01930 0.00000 0.00569 0.00000 -0.01005 0.00006 0.01562 0.05331 -0.01663 -0.00026 0.01700 -0.00359 0.00001 0.00035 -0.02341 -0.03193 0.13600 -0.00749 -0.06372 0.03001 -0.00003 0.01238 -0.00614 0.00002 -0.00644 0.01116 0.00179 -0.00190 -0.23231 -0.96665 -1.21132 0.80325 -0.01319 -0.04419 0.00079 -0.00002 -0.00007 0.00001 -0.00007 0.43399 -0.06505 0.05733 -0.06279 -0.11034 0.03719 0.00423 -0.00379 0.00000 -0.00091 0.00179 0.00000 -0.00977 0.00000 0.01726 -0.00001 -0.02946 -0.00007 -0.05221 -0.07658 0.00495 0.00001 -0.03578 0.01371 -0.00552 0.00002 0.02705 0.03173 0.00006 -0.01216 0.01205 0.00386 0.00003 0.02742 -0.00001 0.00801 0.00000 -0.01552 0.00008 0.02007 0.07362 -0.02259 -0.00035 0.02442 -0.00165 0.00006 0.00072 -0.03783 -0.05365 0.22074 -0.01064 -0.10741 0.04946 -0.00004 0.00950 0.00200 0.00002 -0.01124 0.02586 -0.00422 -0.00278 0.25143 1.06100 1.33312 -0.88685 0.01471 0.04938 -0.00039 -0.00031 -0.00067 0.00001 -0.00030 0.01973 0.17746 -0.15411 0.16992 0.30629 -0.10737 -0.01393 0.00696 0.00001 0.00007 -0.00592 -0.00001 0.02954 -0.00001 -0.05243 0.00002 0.08583 0.00020 0.13006 0.13118 0.00598 0.00002 0.03136 -0.02313 0.00673 0.00000 -0.11720 -0.06526 -0.00024 0.07031 -0.09214 0.00188 -0.00012 -0.13047 0.00004 -0.04297 -0.00003 0.10696 -0.00013 -0.02430 -0.29853 0.07773 0.00115 -0.14513 -0.09934 -0.00151 -0.03078 0.34557 0.53466 -2.06529 0.11914 1.04171 -0.46767 0.00024 0.20980 -0.35283 0.00028 0.13882 -0.48038 0.31985 0.01205 -0.03478 -0.28337 -0.37194 0.24742 -0.00923 -0.02075 0.00505 0.00069 0.00119 0.00118 0.00062 -0.02129 0.11399 -0.12780 0.16637 0.28447 -0.08004 -0.00896 0.03828 0.00002 0.03823 0.00503 0.00002 0.04859 0.00000 -0.10432 0.00003 0.35662 0.00083 1.21487 2.21260 -0.23310 -0.00069 1.58557 -0.56145 0.17186 -0.00109 -0.61917 -1.09797 -0.00034 -0.10353 0.26094 -0.11249 0.00007 0.06730 0.00049 0.36515 -0.00008 -0.40411 -0.00427 -1.21425 -0.47537 0.32685 0.00596 0.79810 0.15340 0.00153 1.10819 -0.78284 -1.22929 5.93641 -1.28840 -1.90351 1.16594 -0.00092 -0.57032 1.01918 -0.00118 -0.75663 1.42703 -2.38919 0.17466 -0.01650 0.35710 0.61967 -0.55036 -0.01006 -0.03344 0.00004 -0.00007 0.00006 0.00016 -0.00001 0.00003 0.03425 -0.02158 0.00460 -0.05751 0.02429 -0.03077 0.19861 -0.00012 -0.29787 0.35455 0.00024 0.09556 -0.00008 -0.09635 0.00004 0.06521 0.00018 -0.10851 0.03712 -0.01907 -0.00022 0.01865 0.12313 -0.04502 0.00016 -0.24554 0.53354 0.00146 -0.20217 -0.28862 -0.00552 -0.00033 0.16118 -0.00015 -0.30261 0.00005 -0.36409 -0.00134 -0.39950 -0.38829 0.10984 0.00185 -0.02277 -0.10285 -0.00110 -0.03703 0.10869 0.05918 0.13557 -0.12152 0.06398 0.01974 -0.00018 0.37715 0.25028 -0.00088 -0.22636 -0.10709 -0.06359 0.05720 -0.00325 -0.00271 0.00506 -0.00058 0.00153 -0.00802 0.00019 0.00003 -0.00020 0.00010 -0.00003 0.00015 0.04703 -0.03536 0.02462 -0.07571 0.07557 0.04921 -0.15176 0.00014 -0.32294 -0.30678 -0.00012 0.11970 0.00005 -0.10171 0.00002 0.10219 0.00026 -0.12546 0.06713 -0.02030 -0.00011 -0.26551 0.07167 -0.02401 0.00019 0.19246 0.00309 -0.00089 0.16011 0.14953 0.27584 0.00060 0.22234 0.00024 0.57207 -0.00011 0.01789 -0.00088 -0.17547 -0.68353 0.04557 0.00035 -0.23920 -0.13810 -0.00159 0.01852 0.04951 0.06085 0.22680 -0.18058 0.12670 0.02231 -0.00018 -0.01124 -0.36825 0.00095 0.05621 -0.02164 -0.20664 0.00934 0.00221 -0.00427 -0.00296 -0.01021 -0.00573 -0.00738 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00001 -0.00001 0.00000 -0.00002 -0.00003 0.00011 0.30112 0.00004 -0.00016 0.41428 0.00000 0.16238 0.00001 -0.01452 0.00005 -0.02791 0.00007 0.00004 0.00009 -0.02536 0.00032 -0.00011 -0.00104 0.49816 0.00006 -0.00005 -0.10985 -0.00078 -0.00001 0.00065 -0.20084 -0.00060 -0.81639 0.00058 -0.00771 -0.00024 -0.18820 0.00059 0.00030 0.00254 -0.15412 0.00025 0.00185 -0.19324 -0.00009 -0.00015 -0.00012 -0.00014 0.00005 -0.00005 -0.00018 -0.33776 0.00011 0.00087 0.36939 -0.00019 -0.00010 0.00009 0.00002 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00114 0.00135 0.00087 -0.00007 0.00099 -0.00063 -0.00877 0.00299 0.00200 -0.00910 0.00398 -0.00907 0.05666 -0.00003 -0.07930 0.09877 0.00005 0.00762 -0.00002 -0.01158 -0.00001 0.01757 0.00015 -0.05090 0.80832 -0.16325 -0.00025 0.61607 1.53040 -0.37268 -0.00064 0.22726 0.99029 -0.00023 -0.14551 0.54115 0.03249 0.00080 -0.27768 -0.00010 0.20986 0.00028 0.98050 0.00642 1.67901 0.45570 -0.56178 -0.00964 -0.89494 -0.33103 -0.00165 -1.16565 0.02959 0.00528 0.15927 -0.07103 0.12391 -0.05824 0.00055 -1.47275 -0.24238 0.00201 0.61600 0.50715 -0.17878 -0.08082 -0.07277 0.01275 0.00387 -0.04593 -0.00776 0.01560 0.00196 0.00091 0.00118 0.00119 0.00095 -0.00141 -0.01278 -0.00461 0.00436 -0.00310 0.02298 0.02347 -0.02483 0.00003 -0.06714 -0.08168 -0.00001 0.04494 0.00001 -0.05343 0.00002 0.13843 0.00031 -0.40281 1.01772 -0.33273 -0.00194 -0.03922 -0.67754 0.55103 0.00073 1.32077 0.16756 -0.00391 1.11219 -0.94078 -0.14563 -0.00109 0.10151 -0.00005 -0.29606 -0.00033 -0.72433 -0.00267 -0.58826 1.05241 0.02846 0.00083 1.01358 -0.73612 -0.00821 0.72840 0.33105 0.00903 0.22236 -0.00568 0.08530 -0.01325 0.00028 -0.17032 1.31082 -0.00337 -0.49628 0.26066 -0.80012 0.20681 -0.08938 0.00255 0.04512 -0.07632 -0.00194 -0.04357 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 0.00003 0.00001 -0.00002 -0.00006 -0.00007 -0.00002 0.07239 -0.00001 -0.00007 0.14727 -0.00001 0.04339 0.00003 0.02286 0.00033 -0.16342 0.00021 -0.00016 0.00163 -0.55770 0.00054 0.00136 -0.00199 1.21765 0.00115 -0.00221 2.21541 0.00878 0.00070 -0.00142 0.00489 0.00088 1.39455 -0.00118 -0.84237 0.00082 -1.27641 0.00559 0.00005 0.01599 -0.98590 -0.00035 0.01227 -1.25549 -0.00212 -0.00139 -0.00080 0.00012 -0.00014 -0.00029 -0.00025 0.88879 -0.00023 -0.00357 -1.42284 0.00130 0.00064 -0.00018 -0.00043 0.00002 0.00000 -0.00003 0.00000 -0.00006 0.00010 0.00601 0.00119 0.53693 -0.26829 0.00056 0.00015 -0.08209 -0.00493 0.06863 0.03343 0.04981 0.02421 -0.02457 -0.00001 -0.01707 0.02696 0.00004 0.00162 -0.00001 -0.00137 0.00001 0.00187 -0.00001 0.01062 0.00492 0.02404 -0.00002 0.00407 -0.03811 -0.05307 -0.00011 0.01306 0.04418 -0.00002 0.01444 0.00621 -0.02143 -0.00001 0.01208 0.00000 0.02203 -0.00002 0.00318 0.00003 0.00806 0.02123 0.02581 0.00043 0.00188 0.08915 0.00085 0.00725 -0.00862 0.00688 0.02510 0.04879 0.03737 -0.00985 -0.00002 0.00598 -0.00939 0.00000 0.04403 -0.09430 -0.05837 0.03501 -0.93094 -0.41085 0.75283 0.43581 0.48177 1.03923 0.00449 0.00103 0.38831 -0.19377 0.00050 0.00016 -0.10281 -0.00656 0.08579 0.04199 0.06178 0.03055 -0.03219 -0.00001 -0.02201 0.03495 0.00005 0.00202 -0.00001 -0.00168 0.00001 0.00224 -0.00002 0.01454 0.00622 0.03151 -0.00002 0.00659 -0.04842 -0.06794 -0.00015 0.02206 0.06130 -0.00002 0.01583 0.01223 -0.03439 -0.00002 0.01969 -0.00001 0.02860 -0.00003 0.00241 0.00004 0.00925 0.02755 0.03561 0.00059 0.00289 0.13442 0.00130 0.01095 -0.01717 0.00618 0.03992 0.08533 0.06522 -0.01970 -0.00003 0.01107 -0.01572 0.00000 0.06997 -0.15354 -0.09768 0.05676 1.00978 0.45181 -0.83024 -0.48205 -0.53629 -1.16050 -0.00060 -0.00179 0.01766 -0.01085 -0.00108 -0.00062 0.28502 0.02199 -0.22989 -0.11500 -0.15129 -0.08157 0.10826 0.00004 0.06784 -0.10790 -0.00015 -0.00472 0.00002 0.00267 -0.00004 -0.00004 0.00006 -0.03718 -0.03127 -0.07901 0.00004 -0.06023 0.06589 0.12516 0.00025 -0.20544 -0.24675 -0.00022 0.06268 -0.17497 0.27556 0.00012 -0.16139 0.00021 -0.04885 0.00013 0.04391 -0.00012 0.01268 -0.05494 -0.14386 -0.00235 -0.01410 -0.89178 -0.00890 -0.06834 0.20157 0.14177 -0.43042 -0.97341 -0.87864 0.33439 0.00026 -0.16788 0.20080 -0.00006 -0.61326 1.44136 1.11274 -0.55593 -0.18389 -0.13971 0.26501 0.14283 0.19018 0.41261 0.00735 0.01275 -0.02036 0.02671 0.00710 0.00116 0.10118 0.06865 -0.08218 -0.05705 -0.13412 -0.11441 0.03804 0.00002 0.02963 -0.14039 -0.00019 -0.01735 0.00004 0.02944 -0.00002 -0.07693 -0.00014 0.41254 0.09085 -0.62541 0.00127 0.92689 2.14093 3.00071 0.00671 1.32763 0.03855 0.00415 -1.87714 0.85972 -2.42157 -0.00169 0.64957 -0.00115 -0.20765 -0.00003 0.23506 0.00172 0.31466 -1.15952 -0.34840 -0.00666 -0.89319 -1.98777 -0.01699 -0.91112 -1.21045 -4.05647 3.13157 3.62913 5.59684 -3.63781 0.00107 -1.20242 -0.35470 -0.00106 -0.17512 -5.70949 -5.79986 2.24630 -0.07460 0.30215 -0.56745 -0.47014 -0.58855 -1.24054 0.00049 -0.00030 0.00044 -0.00106 -0.00010 0.00003 0.01099 0.14025 -0.18897 0.16184 -0.17272 0.03865 -0.34678 -0.00008 -0.10835 0.19367 0.00026 0.04282 -0.00005 -0.07286 0.00014 0.08185 0.00006 0.08619 -0.03927 -0.02382 -0.00005 -0.04216 -0.14707 -0.01631 -0.00003 -0.04820 0.16804 0.00089 -0.11884 -0.25022 0.34884 0.00037 -0.11989 0.00041 0.15764 0.00019 0.12463 0.00001 0.04685 0.14779 0.21883 0.00393 0.06583 0.09250 0.00088 0.15742 0.09496 -0.86785 0.02700 0.53639 0.42158 -0.28828 0.00028 0.00071 -0.37400 0.00058 -0.47868 0.35791 0.32349 -0.20488 0.02454 -0.02240 -0.00692 -0.02297 0.01448 0.05582 -0.00011 -0.00003 -0.00007 0.00014 -0.00004 -0.00014 -0.00603 -0.01695 0.02191 -0.05097 0.04310 0.00864 -0.01290 0.00007 0.22770 0.00831 -0.00010 0.19459 0.00004 -0.41164 -0.00008 0.46166 0.00137 -0.03126 0.01478 0.00713 0.00015 -0.34999 0.10096 0.05619 0.00047 -0.03431 0.15363 0.00064 -0.13261 0.10993 -0.19846 -0.00030 -0.24207 -0.00001 -0.08761 -0.00027 0.43783 -0.00042 -0.12785 -0.02891 0.08197 0.00173 0.41317 -0.07432 -0.00098 0.65717 -0.03614 0.14676 0.02296 -0.10243 -0.12858 0.08185 -0.00006 0.02673 -0.03282 0.00010 0.06852 -0.06141 -0.04356 0.02788 0.00012 0.00552 0.00682 0.00237 -0.00107 -0.00740 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00004 0.00003 -0.00002 0.00007 -0.00005 0.00001 -0.00009 0.14938 -0.00015 0.00029 -0.21410 -0.00006 0.14972 0.00006 -0.41556 -0.00136 0.47353 0.00004 0.00003 -0.00079 0.25866 0.00018 -0.00020 -0.00022 0.06092 0.00013 -0.00006 0.23679 0.00103 0.00015 0.00044 -0.40330 0.00008 -0.05284 0.00045 -0.55773 -0.00018 0.05642 -0.00008 -0.00004 -0.00622 0.38577 -0.00049 -0.00540 0.56799 0.00023 0.00016 0.00010 -0.00013 0.00009 0.00007 0.00000 -0.02491 0.00007 0.00021 0.14091 -0.00009 0.00007 0.00018 -0.00006 0.00001 -0.00001 0.00000 0.00000 0.00001 0.00001 -0.00808 0.00655 0.00737 0.01636 0.00912 -0.00336 -0.03165 -0.07280 -0.01148 0.03696 0.13867 0.15713 0.14787 -0.00001 -0.00697 -0.01498 -0.00002 0.02215 0.00000 -0.05894 -0.00001 0.23664 0.00028 1.89966 0.37986 -0.27291 0.00135 0.55813 0.54155 -0.12696 -0.00155 4.00364 0.49275 0.00343 -1.33774 1.36102 -0.95160 0.00090 0.76288 -0.00181 -0.73778 0.00111 -0.45470 0.00084 -0.05370 0.43057 1.74073 0.03173 -0.53028 -3.44109 -0.03529 -0.52149 4.52981 -0.58447 1.88396 2.45959 -0.29223 0.76945 0.00248 -4.16443 3.70671 -0.00502 -1.96520 -3.45461 2.79927 2.19019 -0.47182 0.49935 0.11855 0.32604 0.09397 -0.57954 0.00153 -0.00057 -0.00134 -0.00272 -0.00120 0.00074 -0.00119 0.01680 0.00358 -0.01107 -0.02010 -0.02862 -0.02493 0.00001 0.04088 -0.00380 -0.00003 0.02382 0.00000 -0.14243 -0.00002 0.30219 0.00094 -0.28664 -0.06767 0.09625 0.00015 -0.79203 -0.18123 -0.01571 0.00042 -0.68294 0.05390 0.00319 -0.51469 0.25650 0.05911 0.00002 -0.44048 -0.00017 -0.40961 -0.00031 0.46039 0.00436 1.45526 -0.26291 -0.71172 -0.01391 -1.23991 1.02203 0.01197 -3.99341 -0.73493 -0.03339 -0.24309 -0.31423 0.26831 -0.27286 -0.00020 0.33038 -0.48228 0.00074 0.55420 0.67221 -0.39610 -0.40084 0.06323 -0.07860 -0.03945 -0.06029 -0.02451 0.09795 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00002 0.00001 0.00002 -0.00002 -0.00003 -0.00005 -0.00001 0.01891 -0.00004 0.00005 -0.03153 0.00000 0.02717 0.00001 -0.15601 -0.00088 0.32771 0.00037 0.00028 -0.00104 0.40016 0.00023 0.00021 0.00088 -0.57845 0.00157 -0.00004 0.99014 0.00423 0.00071 -0.00081 -0.19384 0.00051 0.19276 -0.00021 -0.37638 -0.00030 -1.64317 0.00525 0.00096 0.02372 -1.46827 0.00190 0.03733 -4.03630 -0.00168 -0.00034 -0.00232 0.00078 0.00057 -0.00137 -0.00096 -0.07395 -0.00153 -0.00092 -1.03561 0.00003 -0.00025 0.00081 0.00029 -0.00021 0.00020 0.00009 0.00013 -0.00005 0.00002 0.00011 0.01802 0.26784 0.53689 0.00200 0.00006 -0.06650 -0.06235 0.07253 -0.04283 -0.01562 -0.02610 0.01728 0.00000 0.00933 -0.01077 -0.00001 -0.00103 0.00000 0.00072 0.00000 -0.00077 0.00000 -0.01510 0.01168 -0.02696 0.00001 -0.00065 0.03435 0.01324 0.00000 0.03576 -0.03622 0.00022 -0.06002 -0.01470 0.03440 0.00004 -0.00092 0.00002 -0.01363 0.00005 -0.01158 -0.00004 -0.01104 0.00838 0.04807 0.00086 -0.00317 0.01048 0.00008 0.00408 0.00058 -0.01418 0.00320 0.01650 0.03764 -0.00899 -0.00007 0.06344 -0.01492 0.00001 0.07593 0.11675 0.03515 -0.02821 -0.81279 -0.08672 0.59417 0.48019 -0.08986 -1.35850 0.00016 0.01318 0.19377 0.38787 0.00153 0.00006 -0.08353 -0.07804 0.09054 -0.05359 -0.02027 -0.03327 0.02121 0.00000 0.01181 -0.01342 -0.00001 -0.00136 0.00000 0.00099 -0.00001 -0.00124 0.00000 -0.02152 0.01521 -0.03709 0.00001 -0.00088 0.04542 0.01976 0.00001 0.04675 -0.04721 0.00031 -0.08141 -0.01792 0.04764 0.00005 -0.00018 0.00003 -0.01861 0.00006 -0.01705 -0.00006 -0.01659 0.01051 0.06308 0.00113 -0.00264 0.02619 0.00022 0.00667 -0.00758 -0.01181 0.00418 0.02791 0.06053 -0.01309 -0.00011 0.10478 -0.02628 0.00003 0.12431 0.19250 0.05698 -0.04909 0.88222 0.09534 -0.65531 -0.53138 0.10023 1.51769 -0.00062 -0.00023 0.00852 0.02094 -0.00070 -0.00020 0.23418 0.21280 -0.24317 0.14405 0.06785 0.10068 -0.04436 0.00001 -0.03213 0.03171 0.00003 0.00480 0.00000 -0.00425 0.00001 0.00963 0.00000 0.10601 -0.03992 0.13377 0.00002 0.00172 -0.12491 -0.10576 -0.00013 -0.11947 0.10694 -0.00110 0.27466 -0.00302 -0.15308 -0.00019 -0.03979 -0.00008 0.06562 -0.00019 0.09995 0.00039 0.10774 -0.00129 -0.12056 -0.00213 -0.04904 -0.51485 -0.00486 -0.06191 0.30911 -0.29113 -0.02002 -0.27618 -0.53354 0.07501 0.00121 -1.11641 0.29032 -0.00034 -1.41409 -1.96826 -0.51844 0.60531 -0.19967 -0.02027 0.20463 0.17780 -0.05091 -0.56547 0.00168 0.00277 -0.01439 -0.04449 -0.00018 0.00126 0.10049 0.10190 -0.02881 0.02874 0.04440 -0.02860 -0.05987 0.00002 0.00042 0.02873 0.00003 -0.00290 0.00000 0.00697 0.00005 -0.06174 -0.00013 -0.31049 -0.64957 0.25111 -0.00134 -0.18416 -1.63302 0.78762 0.00255 -3.07134 1.31077 -0.00565 2.16388 -0.15449 0.69542 -0.00035 -0.35475 0.00112 0.84267 -0.00182 0.31579 -0.00106 0.06897 -0.82325 -4.94892 -0.08857 1.23110 4.25117 0.04398 0.43508 -2.74790 5.06835 -0.59248 -0.09773 0.43779 0.47065 -0.00593 5.08171 -1.20933 0.00156 7.64213 8.33272 1.52202 -4.74696 0.51614 0.00727 -0.53899 -0.45173 0.03845 1.75769 0.00027 -0.00044 0.00088 -0.00078 -0.00007 -0.00004 -0.06275 0.07917 0.18314 0.09650 0.39494 0.11857 0.19805 0.00002 0.07820 -0.05779 -0.00009 0.05266 0.00004 -0.04833 -0.00005 -0.05103 -0.00002 -0.13317 0.02746 0.07954 -0.00003 0.04298 0.08812 -0.06405 -0.00012 -0.01563 -0.08041 -0.00095 0.20551 0.35708 -0.07250 0.00011 -0.05228 -0.00031 -0.23414 -0.00018 -0.07987 -0.00044 -0.14978 -0.15961 -0.40323 -0.00702 0.11388 -0.07567 -0.00029 -0.05105 0.43405 -0.35834 0.21240 0.44711 0.44799 -0.24549 0.00032 -0.14758 -0.16632 0.00037 -0.79559 0.42896 0.32522 -0.44881 -0.01585 -0.03874 0.03946 0.00777 0.03223 0.05095 -0.00003 0.00007 -0.00015 0.00012 0.00001 0.00001 0.00880 -0.01185 -0.02870 -0.02048 -0.05649 -0.01341 -0.05598 0.00002 0.11591 0.03615 -0.00005 0.37754 0.00008 -0.33803 -0.00004 -0.29950 -0.00088 -0.11708 -0.25152 -0.01157 -0.00021 0.44498 0.05923 -0.06255 -0.00031 0.15393 -0.02977 -0.00062 0.11505 -0.01521 0.03206 -0.00003 -0.40523 0.00063 0.26672 0.00003 -0.03403 -0.00123 -0.37936 0.01500 0.09727 0.00187 0.23517 0.05411 0.00075 -0.66747 -0.03710 0.04673 -0.02698 -0.04786 -0.06043 0.03154 -0.00006 0.05881 0.06254 -0.00010 0.10474 -0.06970 -0.06289 0.07255 0.00235 0.00591 -0.00646 -0.00159 -0.00528 -0.00844 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 -0.00002 0.00000 0.00000 -0.00002 0.00001 -0.00002 0.06314 -0.00008 0.00024 -0.20859 -0.00011 0.33897 0.00005 -0.34300 0.00087 -0.30089 0.00025 -0.00003 0.00152 -0.51752 -0.00014 0.00012 0.00017 0.10913 0.00011 -0.00003 -0.25856 -0.00143 0.00027 0.00091 -0.37904 0.00020 0.20855 -0.00023 0.11062 0.00008 0.40098 -0.00123 -0.00007 -0.00384 0.19215 0.00004 0.00689 -0.69615 -0.00028 0.00003 -0.00028 0.00008 -0.00003 -0.00007 -0.00005 0.02696 -0.00004 -0.00008 -0.04130 -0.00010 -0.00005 -0.00005 0.00007 -0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 -0.00056 0.01672 -0.01060 0.00840 0.00858 -0.00134 0.00040 0.04428 0.04746 -0.00478 -0.01951 -0.05554 -0.01974 -0.00001 -0.04411 -0.02517 -0.00003 0.02952 0.00002 -0.03254 0.00005 0.05864 -0.00018 1.72816 0.00394 -0.20668 0.00174 1.29894 0.29737 2.53100 0.00453 2.17164 1.36030 0.00312 -1.12493 0.27510 -1.78694 -0.00135 0.82838 -0.00042 0.51943 -0.00051 0.01730 -0.00023 -0.00768 -0.87281 -1.87259 -0.03343 -0.12200 -3.49303 -0.03332 0.25747 -1.49749 -2.42001 2.44466 3.46888 3.03863 -3.27009 0.00044 -1.37877 1.24599 -0.00356 2.46992 -2.35335 -1.81680 0.28471 -0.20557 0.51603 -0.44119 -0.22680 -0.42832 -0.34726 -0.00013 -0.00286 0.00180 -0.00118 -0.00145 0.00036 0.00289 -0.00921 -0.01033 0.00114 0.00329 0.01304 -0.00512 0.00000 0.02316 0.01389 0.00000 0.10566 0.00003 -0.08733 -0.00003 -0.21692 -0.00056 -0.42501 -0.21216 -0.00659 -0.00078 0.74852 -0.11971 -0.39831 -0.00124 -0.31010 -0.45224 -0.00323 0.70249 -0.48328 0.42358 0.00024 0.62940 -0.00023 0.05601 0.00039 -0.64638 -0.00135 -0.48214 0.44283 0.29864 0.00514 -0.54410 0.16482 -0.00040 4.13522 0.17173 0.48643 -0.48336 -0.68194 -0.53228 0.57949 -0.00019 0.25792 -0.37715 0.00064 -0.45653 0.23326 0.38422 -0.01309 0.03582 -0.08558 0.07275 0.04850 0.07305 0.04910 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 -0.00003 -0.00003 0.00003 0.00004 0.00007 0.00002 0.00867 -0.00001 0.00004 -0.05194 -0.00003 0.09200 0.00001 -0.08633 0.00057 -0.20214 0.00033 -0.00024 0.00209 -0.80357 -0.00029 0.00026 -0.00011 0.29956 -0.00068 -0.00007 -0.70865 -0.00340 -0.00108 -0.00013 0.75254 -0.00058 -0.24206 -0.00003 0.57345 0.00021 0.56395 -0.00199 -0.00025 0.00862 -0.36550 -0.00055 -0.04066 4.23582 0.00179 0.00032 0.00207 -0.00048 0.00019 0.00128 0.00124 -0.16356 0.00039 0.00079 0.60603 -0.00015 -0.00022 -0.00033 -0.00003 0.00011 -0.00007 -0.00007 -0.00008 0.00009 -0.00010 -0.00127 0.59855 -0.00900 -0.01552 -0.04156 0.00006 -0.03984 -0.09722 -0.05116 -0.01214 -0.04707 0.03087 -0.00562 0.00000 -0.00316 0.00363 0.00001 0.00024 -0.00001 -0.00017 0.00000 0.00051 0.00000 0.00509 0.00716 0.05389 0.00011 0.00800 -0.00883 -0.00111 0.00000 0.02184 0.02640 -0.00010 0.01922 0.04416 -0.05100 -0.00002 0.02192 -0.00006 -0.00626 -0.00003 -0.00916 -0.00001 -0.00821 -0.01391 -0.04251 -0.00076 0.00913 0.03536 0.00039 0.00067 -0.02653 -0.04113 -0.04363 -0.02892 0.00933 0.07705 0.00001 0.00865 -0.03651 0.00007 -0.06886 0.04183 0.01561 0.07970 -0.85057 0.64089 -0.37287 -0.03777 -1.29867 0.37829 -0.00087 0.43270 -0.00630 -0.01114 -0.02986 0.00007 -0.05013 -0.12200 -0.06416 -0.01527 -0.05935 0.03854 -0.00740 0.00000 -0.00396 0.00478 0.00001 0.00027 -0.00001 -0.00017 0.00000 0.00050 0.00000 0.00543 0.00934 0.06969 0.00014 0.01003 -0.01203 -0.00242 -0.00001 0.03112 0.03652 -0.00013 0.02594 0.06500 -0.06785 -0.00002 0.03162 -0.00008 -0.01013 -0.00004 -0.01449 -0.00001 -0.01238 -0.01673 -0.05177 -0.00093 0.01240 0.06164 0.00067 0.00104 -0.04511 -0.05646 -0.07164 -0.04924 0.01266 0.12964 0.00001 0.01516 -0.05882 0.00012 -0.11102 0.06723 0.02565 0.12976 0.92330 -0.70525 0.41149 0.04196 1.44545 -0.42220 -0.00045 0.02104 -0.00211 -0.00076 -0.00267 -0.00025 0.14239 0.34042 0.17921 0.04204 0.16749 -0.09987 0.02655 0.00001 0.00976 -0.01729 -0.00004 0.00013 0.00004 -0.00083 0.00002 0.00241 -0.00001 0.01399 -0.02603 -0.15567 -0.00023 -0.01536 0.03390 0.02828 0.00007 -0.17899 -0.14061 0.00034 -0.05524 -0.35480 0.18464 -0.00016 -0.16564 0.00035 0.07512 0.00003 0.11154 0.00002 0.07780 -0.02096 -0.04132 -0.00058 -0.03785 -0.67259 -0.00685 -0.00822 0.46188 0.12747 0.67229 0.51276 -0.02111 -1.33231 -0.00015 -0.13761 0.58801 -0.00126 1.23388 -0.63103 -0.28777 -1.31925 -0.19143 0.21166 -0.12955 -0.01697 -0.49600 0.12926 -0.00035 -0.03305 0.01116 0.00593 0.00801 0.00043 0.05524 0.06689 -0.04052 0.04595 0.08581 0.12956 0.08182 0.00001 0.04084 -0.00207 -0.00003 -0.00658 0.00004 0.00692 -0.00001 -0.01890 0.00010 -0.23834 -0.33760 -2.27802 -0.00700 -0.52929 -0.00719 -0.62859 -0.00089 -0.35762 -0.30428 -0.00164 0.59534 1.40937 2.42644 0.00451 -0.28754 -0.00032 -1.06341 0.00171 -0.40425 0.00056 -0.08122 1.59779 5.05806 0.08990 -0.66044 1.70303 0.01365 0.02301 -0.70284 3.67743 -1.40355 -0.88657 -0.45714 6.61289 0.00129 -1.09807 -0.81841 0.00352 -6.37585 0.78720 2.28729 5.66852 0.18662 -0.40553 0.39588 0.18092 1.27093 -0.46270 0.00010 0.00035 0.00037 0.00021 -0.00127 0.00003 -0.03112 0.03557 0.21111 -0.18935 -0.30590 -0.27549 -0.14042 0.00000 -0.01679 0.02831 -0.00003 0.06763 0.00014 0.04213 0.00010 -0.05072 -0.00032 0.05204 0.02515 -0.10250 -0.00048 -0.08706 -0.07668 -0.27879 -0.00051 -0.01561 0.06165 -0.00055 0.11368 0.06706 -0.41958 -0.00065 0.04253 -0.00018 0.03610 -0.00022 -0.01585 -0.00002 -0.08343 -0.03812 -0.15614 -0.00306 -0.08488 -0.05565 -0.00061 0.00801 -0.63831 0.60310 0.15471 0.36630 0.17878 -0.27431 0.00043 -0.18315 -0.20123 0.00040 -0.70081 0.12497 0.04113 -0.71964 -0.00143 -0.03621 0.04485 0.02546 -0.06157 0.00404 -0.00002 -0.00006 -0.00005 -0.00003 0.00020 0.00000 0.00472 -0.00546 -0.03268 0.02827 0.04777 0.04372 0.01378 0.00001 0.06495 0.01448 -0.00004 0.42817 0.00009 0.27942 0.00003 -0.33696 -0.00096 0.17396 0.26172 0.01706 0.00033 -0.43929 0.02538 0.09272 0.00043 -0.07938 0.09065 0.00069 -0.13692 0.05906 -0.02933 -0.00003 -0.27159 0.00031 0.08335 0.00007 -0.05714 -0.00116 -0.38186 0.34631 -0.14721 -0.00291 -0.61753 0.00512 -0.00009 0.27001 0.08249 -0.09162 -0.02740 -0.06564 -0.02449 0.04112 -0.00006 0.01147 0.02443 -0.00007 0.11480 -0.01768 -0.00122 0.10978 0.00013 0.00540 -0.00700 -0.00368 0.00957 -0.00051 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00005 -0.00008 0.00006 0.00009 0.00009 0.00004 0.02059 -0.00003 0.00016 -0.16050 -0.00012 0.40884 -0.00004 0.28033 0.00098 -0.34451 -0.00046 0.00009 -0.00153 0.53926 0.00016 -0.00023 -0.00019 -0.02935 -0.00014 0.00006 0.17744 0.00114 0.00047 0.00034 -0.32219 0.00010 0.01513 0.00003 0.05312 0.00005 0.39512 -0.00126 0.00007 0.01276 -0.70965 0.00042 -0.00324 0.29979 0.00012 0.00014 -0.00034 -0.00009 -0.00007 0.00000 0.00004 -0.01218 0.00009 0.00007 0.00059 0.00037 0.00000 -0.00003 0.00019 0.00000 0.00002 -0.00002 -0.00001 0.00003 0.00000 -0.00349 0.00534 -0.00837 -0.00903 0.01470 -0.00177 -0.03683 -0.08052 0.03148 -0.00341 0.12566 0.10047 0.14568 0.00001 0.01877 -0.05116 -0.00006 0.02254 0.00003 -0.01008 0.00006 0.04294 -0.00020 1.79327 -0.37804 -1.22967 -0.00166 0.59850 -0.51396 2.37072 0.00476 0.88993 1.82269 -0.00008 0.26849 1.27101 0.51081 0.00191 0.28955 -0.00019 0.05967 -0.00014 0.03400 -0.00014 0.19192 -0.57072 -3.08424 -0.05445 0.94001 0.55322 0.00704 -0.04843 1.75268 3.57353 2.23625 3.57915 2.36309 2.34257 -0.00238 -0.52397 2.32110 -0.00327 3.06910 1.80332 2.31841 0.05539 -0.06414 0.52114 -0.45890 -0.21083 0.26805 0.32079 0.00065 -0.00068 0.00119 0.00134 -0.00220 0.00013 0.00429 0.01335 -0.00303 0.00013 -0.01909 -0.01718 -0.02130 0.00000 0.01311 0.00939 -0.00001 0.08541 0.00002 0.06625 0.00000 -0.36008 -0.00101 -0.01037 0.42358 0.20989 0.00073 -0.94884 0.08410 -0.31939 -0.00026 -0.21195 -0.14654 0.00168 -0.35637 -0.02319 -0.10306 -0.00020 -0.00455 -0.00039 -0.30027 -0.00021 0.44941 0.00352 1.14987 -0.76523 0.86397 0.01622 1.61138 0.09076 0.00189 -2.57229 -0.20312 -0.61122 -0.26890 -0.44377 -0.36254 -0.38551 0.00043 0.11534 -0.24397 0.00048 -0.46260 -0.21018 -0.44025 -0.01990 0.00854 -0.07532 0.07041 0.02406 -0.04493 -0.04779 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00002 0.00004 0.00002 -0.00002 -0.00004 -0.00007 -0.00004 0.00411 -0.00001 0.00005 -0.03007 -0.00003 0.08742 0.00000 0.06012 0.00099 -0.35482 -0.00115 0.00033 -0.00191 0.88993 0.00001 -0.00019 -0.00095 -0.21131 -0.00008 -0.00043 0.45998 0.00242 0.00000 -0.00097 0.05373 0.00005 -0.00763 0.00001 -0.44731 -0.00023 -1.21501 0.00395 0.00006 -0.03264 1.81684 -0.00093 0.02646 -2.68097 -0.00115 -0.00007 -0.00184 -0.00041 -0.00151 -0.00178 -0.00152 0.14083 0.00016 -0.00097 -0.26345 -0.00082 -0.00022 -0.00032 -0.00017 -0.00004 -0.00014 0.00020 0.00012 -0.00016 0.00002 -0.00025 0.04113 -0.00200 -0.00260 0.59884 0.00015 -0.02054 -0.06952 -0.07498 0.03823 0.06229 -0.03100 0.00086 0.00000 0.00132 -0.00143 0.00000 -0.00012 0.00000 0.00003 0.00000 0.00029 0.00000 0.01714 -0.00846 -0.07415 -0.00017 0.00353 0.00435 0.00625 0.00000 0.02856 0.00475 0.00012 -0.03347 -0.00980 -0.00072 0.00000 0.00963 0.00002 0.01224 0.00002 -0.00319 0.00000 -0.00082 0.00459 -0.00116 -0.00005 0.00364 0.05925 0.00059 0.00253 0.00583 0.03860 -0.00781 -0.03919 -0.06174 -0.11256 0.00005 0.00315 -0.03128 0.00006 -0.05297 -0.00369 -0.01203 -0.04386 -0.75447 0.78737 -0.75836 -0.40487 1.07456 -0.14425 -0.00014 0.02992 -0.00131 -0.00184 0.43300 0.00013 -0.02587 -0.08697 -0.09343 0.04759 0.07770 -0.04080 0.00032 0.00000 0.00166 -0.00165 0.00000 -0.00019 0.00000 0.00012 0.00000 0.00011 0.00000 0.01936 -0.01016 -0.09566 -0.00022 0.00404 0.00715 0.00652 0.00000 0.04003 0.00446 0.00018 -0.04905 -0.01477 -0.00166 0.00000 0.01430 0.00003 0.01753 0.00003 -0.00527 -0.00001 -0.00169 0.00753 0.00168 -0.00002 0.00511 0.09399 0.00093 0.00374 0.00830 0.05204 -0.01752 -0.06934 -0.10132 -0.17840 0.00008 0.00743 -0.05187 0.00009 -0.08388 -0.00753 -0.02171 -0.07445 0.81800 -0.86541 0.83559 0.44748 -1.19440 0.16082 -0.00049 0.00024 -0.00145 -0.00052 0.02008 -0.00029 0.07347 0.23559 0.24636 -0.12269 -0.19877 0.14591 0.01629 0.00000 -0.00427 0.00040 0.00000 0.00157 0.00000 -0.00215 -0.00001 0.00660 0.00002 0.03008 -0.00087 0.19380 0.00033 -0.00025 -0.06176 0.00221 0.00008 -0.18629 0.02647 -0.00101 0.27232 0.06661 0.01298 0.00001 -0.08929 -0.00012 -0.07767 -0.00017 0.05073 0.00009 0.02563 -0.06838 -0.11466 -0.00171 -0.02255 -0.77188 -0.00771 -0.02343 -0.06308 -0.08092 0.35073 0.87473 1.00607 1.50638 -0.00070 -0.17675 0.56777 -0.00095 0.75734 0.09915 0.30405 0.77018 -0.14886 0.24900 -0.24581 -0.13597 0.37600 -0.04908 0.00363 0.00339 0.00570 0.00562 -0.02660 0.00174 0.06708 0.21084 0.13669 -0.08585 -0.27368 -0.02157 -0.15450 -0.00001 -0.02723 0.05438 0.00005 -0.00738 0.00001 0.01760 -0.00004 -0.08768 -0.00011 -1.63577 0.61812 2.93412 0.00767 -0.37632 0.46305 -1.15209 -0.00246 -0.67020 -1.19228 0.00069 -0.24953 -0.73716 -0.55397 -0.00141 -0.12199 -0.00005 -0.09721 -0.00043 -0.00852 -0.00043 -0.05446 0.22148 2.27799 0.04091 -0.51059 -0.24394 -0.00422 -0.29691 -1.29508 -4.15331 -2.00863 -4.09051 -3.45710 -6.38949 0.00264 1.20502 -2.54550 0.00296 -1.43290 -1.41844 -2.84618 -1.33757 0.15602 -0.57598 0.50227 0.24265 -0.84699 -0.07580 -0.00011 0.00053 0.00021 0.00015 -0.00080 -0.00003 -0.04535 -0.13469 -0.10715 0.00725 -0.06811 0.48470 0.12336 0.00001 0.01815 -0.00992 -0.00007 0.04401 0.00017 0.06398 0.00026 0.06841 0.00045 -0.06581 0.02937 0.29229 0.00114 0.03936 0.07950 0.17288 0.00027 0.06679 -0.08734 0.00099 -0.22054 -0.20740 0.23269 -0.00008 -0.11640 0.00042 0.10051 0.00063 -0.07423 0.00009 0.10075 0.06460 0.27485 0.00502 -0.00005 0.04323 0.00011 0.00957 -0.26357 0.84510 0.19724 0.35675 0.17727 0.34307 0.00013 -0.24389 0.08201 0.00003 -0.45363 -0.15962 0.08938 -0.72383 -0.03157 0.01645 0.00320 0.01161 -0.04572 0.00627 0.00001 -0.00009 -0.00003 -0.00002 0.00012 0.00001 0.00698 0.02067 0.01641 -0.00125 0.01067 -0.07415 -0.02159 0.00000 0.02640 0.01223 -0.00002 0.29140 0.00005 0.41449 0.00002 0.44691 0.00126 -0.08952 -0.13577 -0.04453 -0.00027 0.13457 0.00064 -0.04178 -0.00010 0.01654 0.01831 -0.00006 0.00923 0.11414 -0.10289 -0.00008 -0.40222 0.00050 0.16360 0.00023 -0.61662 0.00148 0.46494 -0.23011 0.04669 0.00093 0.25187 -0.02373 -0.00022 0.10784 0.04227 -0.12590 -0.03402 -0.05830 -0.02841 -0.05077 -0.00002 0.04115 -0.01745 0.00000 0.06712 0.02036 -0.01085 0.11212 0.00493 -0.00266 -0.00047 -0.00156 0.00713 -0.00104 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 0.00006 0.00005 -0.00001 0.00003 -0.00027 -0.00007 0.00736 -0.00003 0.00010 -0.09447 -0.00008 0.28305 -0.00006 0.41814 -0.00131 0.45434 0.00026 -0.00005 0.00052 -0.21283 -0.00006 0.00001 -0.00009 0.00945 0.00009 0.00003 0.01677 0.00021 0.00052 0.00019 -0.41105 0.00031 0.13213 -0.00011 0.64089 0.00029 -0.48755 0.00150 -0.00010 -0.00595 0.32864 -0.00023 -0.00098 0.10625 0.00004 0.00010 -0.00039 -0.00012 -0.00021 -0.00006 -0.00016 -0.00428 0.00014 -0.00005 0.01442 0.00021 0.00005 -0.00010 0.00044 0.00002 -0.00001 0.00000 -0.00001 0.00002 -0.00001 -0.00053 -0.00632 0.00008 0.00377 0.00631 -0.00039 0.00974 0.00208 -0.01964 -0.01793 -0.08562 0.08669 -0.00093 0.00000 -0.01413 0.00445 -0.00001 0.01554 0.00004 0.01917 0.00009 0.10291 0.00050 0.69698 -0.29110 -1.18650 -0.00368 0.36375 -0.16118 1.04876 0.00232 0.34401 0.96872 -0.00311 0.84576 2.14767 0.79005 0.00341 0.23126 -0.00127 -0.93295 -0.00029 -0.20286 -0.00024 -0.24210 0.77510 3.28880 0.05854 -0.80500 -1.47897 -0.01750 -0.14660 -2.09180 1.17383 0.55554 1.21579 0.75278 0.04206 0.00124 -0.90084 -0.11219 0.00032 -1.71032 0.11532 0.48846 3.65622 0.03385 0.02585 -0.01181 -0.01739 0.34118 -0.25079 0.00004 0.00092 0.00002 -0.00057 -0.00099 0.00012 -0.00100 -0.00067 0.00226 0.00288 0.01311 -0.01258 -0.00101 0.00000 0.00527 0.00247 0.00000 0.07440 0.00002 0.16415 0.00001 0.45849 0.00131 -0.33877 -0.28091 0.17211 0.00019 0.61710 0.01188 -0.21325 -0.00080 0.02946 -0.28318 -0.00083 0.12449 -0.52533 0.01353 -0.00040 0.48358 -0.00031 0.05983 -0.00026 0.60364 -0.00325 -1.03921 0.47455 -0.77159 -0.01425 -0.89287 0.18305 0.00181 0.88129 0.29322 -0.16077 -0.11305 -0.22723 -0.11049 -0.00058 -0.00021 0.11675 -0.02180 -0.00005 0.26426 -0.04016 -0.04224 -0.55897 -0.00487 -0.00598 0.00159 0.00591 -0.05109 0.03811 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 0.00003 -0.00005 -0.00002 0.00042 0.00000 0.00002 -0.02188 -0.00002 0.07226 -0.00002 0.16636 -0.00138 0.47319 0.00005 0.00003 0.00268 -0.73269 -0.00037 0.00047 -0.00036 0.11889 -0.00026 -0.00077 -0.36300 -0.00270 -0.00219 -0.00044 0.53594 -0.00050 -0.12275 0.00055 -0.57740 -0.00009 1.09840 -0.00344 -0.00026 0.01901 -1.13187 0.00091 -0.00847 0.90383 0.00046 0.00070 -0.00081 -0.00052 -0.00065 -0.00011 0.00003 -0.05576 0.00048 0.00000 0.08012 0.00076 -0.00036 -0.00062 -0.00194 0.00000 -0.00005 0.00000 0.00000 -0.00018 0.00006 -0.00017 -0.00019 -0.00036 -0.00004 -0.00023 -0.00015 0.06716 -0.04794 0.03167 -0.07334 0.06890 0.03714 -0.11470 -0.16671 0.03990 0.09568 0.10694 -0.03732 0.10554 0.04063 -0.08267 -0.04272 0.07569 -0.02522 0.00018 -0.00200 0.07912 0.05476 -0.07357 -0.00105 0.08875 -0.00885 0.01230 0.02539 -0.03754 -0.00261 0.00737 0.05607 -0.05463 0.00394 -0.02630 0.06242 0.04879 0.07312 0.03479 -0.03585 -0.02523 0.05702 -0.04602 -0.15667 0.00118 0.00732 0.15760 0.08663 -0.11291 0.31824 -0.28774 0.12789 -0.74832 0.25271 -0.24477 -0.76212 -0.09916 0.31481 -0.87481 -0.00330 0.02180 0.00466 0.00345 0.00062 -0.00417 -0.00226 0.00343 0.00123 0.00094 0.00166 0.00119 0.00044 -0.01086 -0.00938 0.01743 -0.01865 0.04426 0.02862 -0.04044 -0.08970 0.03830 0.07393 0.08142 -0.03508 0.09994 0.04717 -0.10535 -0.12177 0.25397 -0.59110 0.15174 -0.15497 0.71355 0.19017 -1.16258 0.18353 0.78201 0.47909 0.12166 -1.22737 -1.00182 0.59239 -0.21658 0.75945 -0.24743 0.14114 -0.24526 1.09398 0.41922 1.39895 0.09701 -0.61566 -0.02459 0.96387 -0.37643 -0.63649 1.16969 -0.26317 0.24295 0.12673 0.81652 -1.21019 1.23668 -0.25115 1.67919 -0.81875 0.38028 1.72254 0.01141 -0.60480 0.55623 0.24322 -0.12658 -0.06232 -0.01329 -0.09884 -0.01579 -0.07108 -0.00017 -0.00019 -0.00036 -0.00004 -0.00023 -0.00015 0.06716 -0.04795 0.03167 -0.07335 0.06891 0.03715 -0.11474 0.16667 0.03990 0.09594 -0.10673 -0.03736 -0.10552 0.04068 0.08264 -0.04235 -0.07589 -0.02520 0.00013 -0.00155 -0.07921 0.05470 -0.07339 -0.00059 -0.08880 -0.00887 0.01230 -0.02498 -0.03791 -0.00251 0.00764 -0.05602 -0.05467 -0.00392 -0.02636 -0.06242 0.04875 -0.07288 0.03530 -0.03578 -0.02322 -0.05792 -0.04597 -0.15664 -0.00430 0.00745 0.15756 0.08656 -0.11275 0.31811 -0.28732 0.12807 0.74814 0.25453 -0.24128 0.76316 -0.09885 0.31462 -0.87481 -0.00330 0.02181 0.00467 0.00345 0.00063 -0.00417 -0.00226 0.00344 0.00123 0.00094 0.00166 0.00119 0.00044 -0.01084 -0.00933 0.01747 -0.01869 0.04418 0.02851 -0.04054 0.08966 0.03827 0.07414 -0.08125 -0.03512 -0.09992 0.04724 0.10531 -0.12053 -0.25442 -0.59109 0.15146 -0.15110 -0.71549 0.18947 -1.16044 0.18851 -0.78217 0.48005 0.11969 1.23594 -0.99322 0.59396 -0.21550 -0.75840 -0.24782 -0.14161 -0.24458 -1.09376 0.41917 -1.39816 0.10710 -0.61489 0.00733 -0.96478 -0.37546 -0.61440 -1.18161 -0.26526 0.24042 0.12527 0.81619 -1.21023 1.23539 -0.25261 -1.67886 -0.82248 0.37199 -1.72387 0.01154 -0.60393 0.55533 0.24290 -0.12660 -0.06233 -0.01330 -0.09891 -0.01589 -0.07097 -0.00020 -0.00017 -0.00018 -0.00006 -0.00014 -0.00045 0.04218 -0.03753 0.04455 0.10689 -0.05015 -0.02000 0.05965 -0.11340 0.05789 0.13846 -0.19267 -0.01416 -0.08328 0.00010 0.01739 0.00699 -0.00097 -0.01671 -0.01899 -0.00569 0.00362 -0.04712 0.00544 0.04763 0.12905 0.03046 -0.01352 0.06624 0.06992 -0.05662 -0.02243 0.05507 0.01104 0.05072 -0.01924 0.03725 -0.03388 0.00876 0.01826 0.04806 -0.03339 -0.02454 -0.01140 -0.14118 -0.06737 -0.08174 0.09903 0.09814 0.19051 -0.06437 -0.07162 0.12233 -0.74954 0.08322 -0.92338 0.75370 0.18114 -0.24944 0.29969 -0.02813 0.01786 0.01445 0.01467 -0.00424 0.00049 0.00167 0.00001 0.00061 0.00043 0.00087 0.00064 0.00363 -0.00186 -0.00574 0.00344 0.02838 -0.00819 0.00183 0.03259 -0.05795 0.04660 0.10858 -0.13326 -0.01638 -0.07723 0.01086 0.04292 -0.01629 -0.09342 -0.56524 -0.28351 -0.09361 -0.26215 -0.74143 -0.14938 0.29785 1.36965 1.05505 0.17790 1.17123 0.71789 -0.35091 0.05827 0.03233 0.43837 0.08548 0.31909 -0.20687 -0.46336 -0.51730 -0.22319 0.62150 0.02313 -0.42169 0.44565 -0.52582 -0.58917 0.27899 0.42746 0.20868 -1.29177 0.45061 0.57230 -0.36752 1.48204 0.22724 1.28835 -1.38039 -0.38237 -0.15672 -0.16286 0.16266 -0.05977 -0.06694 -0.11227 0.07696 -0.00159 -0.03635 -0.00020 -0.00017 -0.00018 -0.00006 -0.00014 -0.00045 0.04217 -0.03752 0.04455 0.10687 -0.05014 -0.02000 0.05960 0.11341 0.05788 0.13803 0.19299 -0.01414 0.08329 0.00009 -0.01739 0.00699 0.00101 -0.01672 -0.01902 -0.00567 -0.00363 -0.04722 0.00551 0.04815 -0.12889 0.03031 -0.01332 -0.06692 0.06925 -0.05651 -0.02219 -0.05525 0.01094 -0.05080 -0.01913 -0.03725 -0.03390 -0.00863 0.01832 0.04806 -0.03414 0.02337 -0.01144 -0.14240 0.06460 -0.08170 0.09922 0.09832 0.19074 -0.06440 -0.07163 0.12287 0.74976 0.08360 -0.92596 -0.75002 0.18167 -0.24912 0.29958 -0.02823 0.01786 0.01445 0.01466 -0.00423 0.00048 0.00168 0.00001 0.00060 0.00043 0.00087 0.00064 0.00363 -0.00187 -0.00576 0.00343 0.02839 -0.00815 0.00188 0.03262 0.05796 0.04661 0.10829 0.13353 -0.01636 0.07725 0.01083 -0.04294 -0.01674 0.09343 -0.56528 -0.28370 -0.09504 0.26129 -0.74217 -0.14933 0.30256 -1.36886 1.05241 0.18131 -1.17803 0.70772 -0.35082 0.05919 -0.03247 0.43795 -0.08557 0.31880 0.20692 -0.46330 0.51559 -0.22691 0.62104 0.00941 0.42304 0.44507 -0.53705 0.57805 0.28005 0.42835 0.20921 -1.29216 0.45076 0.57245 -0.36795 -1.48235 0.22605 1.29321 1.37454 -0.38384 -0.15760 -0.16228 0.16306 -0.05977 -0.06693 -0.11224 0.07697 -0.00153 -0.03643 -0.00019 -0.00021 -0.00019 0.00000 -0.00016 -0.00046 0.03998 -0.03875 0.04999 0.11325 -0.03850 0.01239 -0.09534 0.00001 0.12716 -0.23618 -0.00026 -0.03216 0.00001 0.03542 -0.00001 -0.03188 -0.00009 -0.01439 0.01286 0.00651 -0.00006 0.05242 0.02296 -0.07709 -0.00012 0.00989 0.12753 0.00016 -0.00200 -0.01425 0.06762 0.00009 -0.04815 0.00007 0.01605 -0.00001 0.08665 0.00039 0.11548 0.03244 -0.07745 -0.00137 -0.05832 -0.13815 -0.00133 0.02766 -0.02056 0.03545 0.16000 -0.01834 0.01757 -0.00599 -0.00091 1.32132 0.27472 -0.00130 -0.41306 -0.40460 0.27860 0.03333 0.01789 0.01331 0.01658 -0.00412 0.00096 -0.00171 -0.00026 0.00136 0.00135 -0.00024 0.00113 0.00367 -0.00420 -0.00126 0.00187 0.02882 -0.01446 0.00849 -0.04318 0.00000 0.08618 -0.18278 -0.00021 -0.04694 0.00001 0.06681 -0.00003 -0.13849 -0.00033 -0.39609 -0.04151 -0.02646 -0.00033 0.18765 1.27468 -0.67561 -0.00024 0.32987 1.86293 0.00334 -0.50578 0.15712 0.31244 0.00069 0.03024 -0.00020 -0.25976 0.00009 0.32981 0.00371 1.03802 0.44438 -0.52511 -0.00913 -0.53106 -0.65529 -0.00576 -0.91155 0.37905 0.38432 -1.23327 0.13392 0.44555 -0.22057 0.00180 -2.35373 -0.68894 0.00267 1.03107 0.34457 0.39373 -0.09911 -0.09458 -0.05418 -0.11637 0.08811 0.00606 0.02676 -0.00010 -0.00075 -0.00016 0.00013 0.00008 -0.00007 0.01262 0.04564 0.05875 -0.04828 -0.11646 0.27361 0.05768 0.00000 0.00403 -0.00379 -0.00001 -0.00002 0.00000 -0.00015 0.00001 0.00028 -0.00001 -0.00030 -0.01945 -0.16643 -0.00051 -0.03000 0.00348 -0.12993 -0.00026 -0.04261 -0.07964 0.00008 -0.03292 -0.16528 -0.04526 -0.00023 -0.03247 0.00009 0.05553 0.00000 0.03552 0.00006 0.02045 -0.02968 -0.11864 -0.00213 0.01170 -0.07589 -0.00073 0.00283 0.01425 0.38089 0.24108 0.24878 -0.04257 -0.65669 0.00027 -0.08194 -0.04840 0.00010 -0.12948 0.34788 0.22974 1.28385 0.03179 -0.01429 0.01185 0.00365 0.02510 -0.01548 -0.00006 0.00363 -0.00045 -0.00337 0.00015 0.00010 -0.00822 -0.00002 0.03694 -0.00954 0.01916 0.14710 0.06972 0.00001 0.02028 -0.01437 -0.00002 -0.00236 0.00001 0.00217 0.00002 -0.00939 -0.00003 -0.16294 -0.06234 -0.68476 -0.00239 -0.22017 -0.01792 -1.05328 -0.00218 -0.12127 -0.56125 0.00142 -0.50358 -1.43915 -0.75003 -0.00237 -0.02362 0.00069 0.68840 -0.00007 0.18749 0.00028 0.03945 -0.57890 -2.92599 -0.05260 0.58882 1.27070 0.01544 0.25952 1.86945 -0.88071 -0.47684 -0.63255 0.07599 2.05582 -0.00171 0.56830 0.51280 -0.00073 1.54103 -0.21147 -0.10993 -3.41200 -0.06917 0.06886 -0.06958 -0.02572 -0.08147 0.18197 1 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 2 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 3 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 4 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 5 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 6 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 7 H 1S 2S 8 H 1S 2S 9 H 1S 2S 10 H 1S 2S 11 H 1S 2S 12 H 1S 2S 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 1 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|2 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|3 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|4 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|5 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|6 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|7 H 1S|2S|8 H 1S|2S|9 H 1S|2S|10 H 1S|2S|11 H 1S|2S|12 H 1S|2S 1.17419 0.81430 0.72813 0.62768 0.84566 0.91341 0.95303 0.09675 0.11416 0.20864 1.17422 0.81439 0.72870 0.66669 0.91137 0.87432 0.93842 0.18813 0.13017 0.23378 1.17453 0.81389 0.75412 0.31685 0.96556 0.79288 0.78741 -0.04567 0.17239 0.17851 1.17430 0.81383 0.74334 0.24188 0.95923 0.84684 0.84525 0.07813 0.19725 0.19283 1.17442 0.81392 0.76272 0.15410 0.96521 0.82904 0.82564 -0.01015 0.15279 0.15887 1.17449 0.81407 0.74181 0.54965 0.99181 0.79389 0.78972 0.15965 0.23346 0.23515 0.51188 0.24531 0.51191 0.24528 0.51324 0.25668 0.51321 0.25674 0.51477 0.26401 0.50168 0.21556 -1.4688 0.1036 -0.0015 1.4725 -24.8992 -36.2396 -36.3216 -2.0091 -0.0026 0.0001 7.5876 -3.7528 -3.8349 -2.0091 -0.0026 0.0001 43.5765 3.8109 0.0012 1.9457 -1.4403 -0.0178 1.3733 1.4001 0.0003 0.0022 -865.0685 -102.5920 -51.0363 -38.7503 -0.0697 -6.1593 0.0056 0.0064 -0.0033 -203.6210 -197.9352 -22.8868 0.0085 -0.0002 -2.2748 0 0 0 0 0 0 0 0 0 0 0 0 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; 0.000000 1.553660 0.000000 1.470254 2.523051 0.000000 2.711272 3.606930 1.241102 0.000000 4.084737 4.895263 2.614583 1.373482 0.000000 5.324888 6.091132 3.854733 2.613635 1.240154 0.000000 1.108466 2.189719 2.111065 3.250817 4.573752 5.788369 0.000000 1.108465 2.189716 2.111110 3.250878 4.573646 5.788073 1.773518 0.000000 2.202095 1.103410 2.803309 3.699317 4.872181 6.005545 2.550553 3.110399 0.000000 2.202090 1.103410 2.803339 3.699368 4.872078 6.005255 3.110398 2.550543 1.787004 0.000000 2.193502 1.104622 3.465119 4.625068 5.947853 7.159103 2.515500 2.515496 1.791676 1.791673 0.000000 6.399129 7.139573 4.928968 3.687874 2.314394 1.074241 6.847727 6.847384 7.016985 7.016646 8.215563 0.000000 21.4644093 1.2950656 1.2405259 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 71 71 71 71 71 MxSgAt= 12 MxSgA2= 12. SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F SDD (6D, 10F) 0.10000e-02 0.10000e-05 F IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. 1 Symmetry operations used in ECPInt. ECPInt: NShTT= 1176 NPrTT= 6030 LenC2= 1130 LenP2D= 4328. LDataN: DoStor=T MaxTD1= 2 Len= 12 NBasis= 72 RedAO= T EigKep= 2.17D-03 NBF= 72 NBsUse= 72 1.00D-06 EigRej= -1.00D+00 NBFU= 72 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 71 71 71 71 71 MxSgAt= 12 MxSgA2= 12. 1 Closed 1 0 1 -231.651862390382 -231.701919096892 -0.050056706510 -231.769247580571 -0.067328483680 -231.769521061154 -0.000273480583 -231.771767744715 -0.002246683561 -231.772133459784 -0.000365715069 -231.772135569002 -0.000002109218 -231.772138554022 -0.000002985020 -231.772183106100 -0.000044552077 -231.772183112627 -0.000000006527 -231.772183107822 0.000000004805 -231.772183121023 -0.000000013201 -231.772183121787 -0.000000000763 -231.772183121800 -0.000000000014 -231.772183121806 -0.000000000006 -231.772183122 15 2.308282219284e+02 -8.872294957941e+02 2.497486843011e+02 Using DIIS extrapolation, IDIIS= 1040. Two-electron integral symmetry not used. Keep J ints in memory in canonical form, NReq=4384034. IVT= 35134 IEndB= 35134 NGot= 2818572288 MDV= 2815082649 LenX= 2815082649 LenY= 2815077024 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. FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 1 NMatS0= 2628 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. Integral accuracy reduced to 1.0D-05 until final iterations. -5.77881533e-01 4.07618081e-02 -5.77091626e-04 1 2 3 4 5 6 7 8 9 10 11 12 6 6 6 6 6 6 1 1 1 1 1 1 0.010506605 0.001444986 -0.000005893 -0.007710321 -0.010979556 0.000042817 -0.074356122 0.016687809 -0.000027061 0.071900980 -0.011410622 0.000012982 -0.071914638 0.010740578 0.000023769 0.071753400 -0.011107640 -0.000030011 -0.000723466 0.005576288 -0.005524177 -0.000743417 0.005605338 0.005547757 0.001037905 -0.003084034 -0.004222617 0.001026042 -0.003049548 0.004184759 -0.006979137 0.000449451 -0.000004648 0.006202168 -0.000873050 0.000002323 0.074356122 0.024848465 (Enter /mnt/data/applications/G09/g09/l716.exe) Closed 1 0 1 -231.778977201706 -231.779135453009 -0.000158251303 -231.779116824180 0.000018628828 -231.779136887986 -0.000020063805 -231.779137760197 -0.000000872211 -231.779194062052 -0.000056301856 -231.779193905874 0.000000156179 -231.779194081852 -0.000000175978 -231.779194089524 -0.000000007672 -231.779194090763 -0.000000001239 -231.779194091547 -0.000000000784 -231.779194091552 -0.000000000004 -231.779194092 12 2.303763765911e+02 -8.808815963324e+02 2.468268506281e+02 Using DIIS extrapolation, IDIIS= 1040. Two-electron integral symmetry not used. Keep J ints in memory in canonical form, NReq=4384034. IVT= 35134 IEndB= 35134 NGot= 2818572288 MDV= 2815082649 LenX= 2815082649 LenY= 2815077024 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. FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 1 NMatS0= 2628 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. Integral accuracy reduced to 1.0D-05 until final iterations. (Enter /mnt/data/applications/G09/g09/l716.exe) alpha 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 O O O O O O O O O O O O O O O O O O O O O V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V V -9.934242 -9.932297 -9.927454 -9.924908 -9.916428 -9.900155 -0.738922 -0.708954 -0.660477 -0.593157 -0.546660 -0.463564 -0.433480 -0.417589 -0.365349 -0.335047 -0.329107 -0.301632 -0.299962 -0.217018 -0.216200 -0.049176 -0.047645 0.076680 0.089144 0.094987 0.105164 0.123931 0.146498 0.158309 0.159807 0.173646 0.175846 0.198725 0.201589 0.239479 0.247080 0.259659 0.265856 0.273049 0.278104 0.317576 0.320262 0.371194 0.371477 0.405373 0.474000 0.478424 0.493873 0.587227 0.596627 0.609900 0.703123 0.763620 0.871569 0.891763 0.949779 0.960478 1.052386 1.070531 1.077981 1.078757 1.094975 1.177324 1.307121 1.321648 22.271819 22.527026 22.574808 22.631866 22.747196 22.822748 15.958440 15.952769 15.950111 15.956126 15.955774 15.957893 1.574034 1.686360 1.773456 1.469676 1.593434 1.274693 1.207472 0.904612 1.197699 1.113571 1.037168 1.099281 1.080058 1.235050 1.210513 1.378976 1.348524 1.035692 1.227357 1.455745 1.544516 1.387400 1.069466 0.943966 1.100560 1.264613 0.951153 1.226052 1.447305 1.270211 1.516060 1.162311 1.177735 1.454486 1.582771 1.309523 1.387576 1.269516 1.575809 2.418650 1.754562 1.456686 1.557526 2.049094 1.577116 1.612052 2.188230 2.791748 3.046511 2.974251 3.247699 3.149094 2.466478 2.684599 3.103381 2.637684 3.308293 3.510950 2.954080 3.283451 57.369719 57.389916 57.382243 57.373565 57.433962 57.438411 2.303763765911D+02 PT196.500S 2017-07-12T16:49:37.000+02:00 Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 C C C C C C H H H H H H -0.475943 -0.660185 0.089539 -0.092871 0.173432 -0.483703 0.242808 0.242810 0.230083 0.230052 0.221220 0.282758 0.00000 -9.90015 -0.73892 -0.70895 -0.66048 -0.59316 -0.54666 -0.46356 -0.43348 -0.41759 -0.36535 -0.33505 -0.32911 -0.30163 -0.29996 -0.21702 -0.21620 -0.04918 -0.04764 0.07668 0.08914 0.09499 0.10516 0.12393 0.14650 0.15831 0.15981 0.17365 0.17585 0.19872 0.20159 0.23948 0.24708 0.25966 0.26586 0.27305 0.27810 0.31758 0.32026 0.37119 0.37148 0.40537 0.47400 0.47842 0.49387 0.58723 0.59663 0.60990 0.70312 0.76362 0.87157 0.89176 0.94978 0.96048 1.05239 1.07053 1.07798 1.07876 1.09497 1.17732 1.30712 1.32165 22.27182 22.52703 22.57481 22.63187 22.74720 22.82275 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|O|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V|V -9.93424 -9.93230 -9.92745 -9.92491 -9.91643 -9.90015 -0.73892 -0.70895 -0.66048 -0.59316 -0.54666 -0.46356 -0.43348 -0.41759 -0.36535 -0.33505 -0.32911 -0.30163 -0.29996 -0.21702 -0.21620 -0.04918 -0.04764 0.07668 0.08914 0.09499 0.10516 0.12393 0.14650 0.15831 0.15981 0.17365 0.17585 0.19872 0.20159 0.23948 0.24708 0.25966 0.26586 0.27305 0.27810 0.31758 0.32026 0.37119 0.37148 0.40537 0.47400 0.47842 0.49387 0.58723 0.59663 0.60990 0.70312 0.76362 0.87157 0.89176 0.94978 0.96048 1.05239 1.07053 1.07798 1.07876 1.09497 1.17732 1.30712 1.32165 22.27182 22.52703 22.57481 22.63187 22.74720 22.82275 0.60044 0.00195 -0.00708 0.00225 0.00019 -0.00067 -0.08238 0.05584 -0.02638 0.05214 -0.04233 -0.01063 0.01164 0.00000 0.01863 -0.00294 0.00000 -0.00259 0.00000 0.00063 0.00000 0.00110 0.00000 -0.06541 0.05431 -0.01540 0.00001 0.01202 0.00604 0.02480 0.00007 -0.00431 0.00156 -0.00004 -0.01257 0.02552 0.00423 0.00000 0.00441 0.00000 -0.00340 -0.00001 -0.00507 -0.00018 -0.03448 -0.06062 -0.01413 0.00008 -0.01087 -0.00863 0.00003 0.00298 -0.01906 0.00047 -0.04645 0.08041 -0.11088 -0.02721 0.00000 0.00448 -0.01069 0.00002 0.00858 -0.01413 0.04055 0.01980 -0.47060 -0.93861 -0.02119 -1.38609 -0.23646 -0.15428 0.43387 0.00146 -0.00496 0.00164 0.00018 -0.00041 -0.10366 0.07004 -0.03333 0.06609 -0.05373 -0.01333 0.01498 0.00000 0.02405 -0.00358 0.00000 -0.00341 0.00000 0.00090 0.00000 0.00140 0.00000 -0.08431 0.07009 -0.02083 0.00001 0.01480 0.00933 0.03112 0.00009 -0.00512 0.00653 -0.00006 -0.01891 0.03768 0.00453 -0.00001 0.00783 0.00000 -0.00561 -0.00002 -0.00878 -0.00025 -0.04879 -0.08342 -0.01839 0.00011 -0.01479 -0.00788 0.00003 0.00532 -0.02695 0.00672 -0.07235 0.13590 -0.17810 -0.04279 0.00000 0.00565 -0.01973 0.00004 0.01345 -0.02628 0.08274 0.03981 0.51039 1.03240 0.02332 1.53274 0.26302 0.17214 0.02051 -0.00037 -0.00124 -0.00020 -0.00054 -0.00025 0.28341 -0.18896 0.09899 -0.18824 0.15468 0.03204 -0.04441 0.00000 -0.07388 0.00568 0.00000 0.01163 0.00000 -0.00367 0.00000 -0.00612 0.00000 0.18110 -0.15185 0.07438 -0.00005 0.00352 -0.07970 -0.02696 -0.00009 -0.00078 -0.14659 0.00043 0.10019 -0.21383 0.03367 0.00007 -0.08721 0.00000 0.04349 0.00020 0.09547 0.00121 0.24230 0.33655 0.03366 -0.00019 0.05464 -0.06604 0.00034 -0.06101 0.11039 -0.16353 0.70011 -1.38675 1.63083 0.37189 0.00004 -0.00136 0.27439 -0.00049 -0.09740 0.33584 -1.41600 -0.66329 -0.10538 -0.31410 -0.00865 -0.47543 -0.09293 -0.05658 -0.02709 0.00110 0.00741 0.00365 0.00384 0.00214 0.22792 -0.18113 0.00464 -0.15000 0.18421 0.13883 0.00658 0.00000 -0.05693 0.03104 0.00000 0.00976 0.00002 -0.01291 0.00003 0.06984 0.00006 2.44156 -1.59003 0.14461 -0.00016 -0.64363 0.82003 -1.30312 -0.00350 0.22565 1.60432 -0.00155 -0.18644 0.54348 -0.24640 -0.00019 0.73053 0.00013 -0.14082 -0.00148 -0.70587 -0.00071 -0.21432 0.69296 1.33475 -0.00755 -0.00198 -0.77265 0.00447 0.41253 2.49503 -0.47667 -2.59074 4.32008 -4.23728 -1.44227 -0.00008 -0.95432 -1.29583 0.00214 -1.30907 -1.33239 6.01082 3.45814 -0.00880 0.59645 0.02027 1.05065 0.31267 0.05172 0.00023 -0.00028 -0.00003 -0.00014 -0.00001 -0.00006 0.04945 0.00723 -0.08188 -0.12853 -0.03144 -0.09913 0.36321 0.00011 0.24292 -0.12832 -0.00006 -0.03124 -0.00003 0.01895 0.00003 -0.00187 0.00000 0.01275 0.07642 0.06449 0.00016 0.12724 -0.29327 -0.02597 -0.00015 0.33990 -0.10066 0.00063 0.16666 -0.34378 0.22472 0.00027 -0.04360 0.00025 0.40204 0.00017 0.19082 0.00043 0.08915 -0.22201 0.57249 -0.00312 -0.28978 0.25104 -0.00089 -0.07145 0.55014 0.06836 0.14044 0.21163 -0.07690 -0.11509 0.00007 -0.08355 0.11782 -0.00022 -0.20877 0.23125 0.16579 0.05632 0.01533 0.00499 0.00072 0.00195 0.01168 0.00676 0.00016 -0.00002 -0.00002 -0.00010 -0.00007 0.00005 -0.02628 0.02265 -0.02958 -0.11762 0.08215 0.05589 -0.20823 0.00010 0.36317 0.21816 -0.00006 -0.14282 -0.00004 0.09927 0.00000 0.00496 0.00000 0.18534 0.11527 -0.00236 0.00002 -0.04199 0.23680 -0.05122 -0.00018 0.06095 0.28861 0.00130 0.34822 -0.24004 -0.29695 -0.00023 -0.21328 -0.00012 -0.32143 0.00006 0.04420 -0.00098 -0.16420 -0.66167 -0.02822 0.00020 -0.28790 0.28037 -0.00131 -0.05276 -0.23820 0.12205 0.24701 -0.25401 0.07332 0.04216 0.00014 -0.05517 -0.08901 0.00028 0.00826 0.00265 0.06133 0.01147 -0.00013 -0.00619 0.00134 -0.00681 -0.00225 0.00310 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00002 0.00006 -0.00002 0.00001 -0.00004 0.43462 -0.00014 -0.00002 -0.24470 0.00003 -0.18016 0.00000 0.11565 0.00000 -0.00809 -0.00007 -0.00006 0.00029 0.22029 -0.00001 0.00023 0.00147 -0.37939 -0.00009 -0.00005 -0.66217 0.00299 0.00020 0.00033 0.02199 0.00006 0.38665 -0.00023 -0.24683 0.00041 -0.37638 0.00197 0.00019 -0.00147 -0.24575 0.00008 -0.00046 -0.07632 -0.00001 -0.00001 -0.00008 -0.00009 0.00005 0.00000 -0.00001 0.43062 0.00012 0.00065 0.35217 -0.00003 -0.00002 -0.00003 -0.00002 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00289 0.00238 0.00514 0.00262 0.00308 -0.00328 -0.00704 -0.02364 -0.00827 0.00668 0.02539 0.02806 0.10846 0.00003 0.04388 -0.01659 -0.00001 0.02046 0.00000 -0.04407 0.00004 0.17668 0.00002 0.80703 0.68630 0.06051 0.00060 0.66301 -1.61706 -0.33648 -0.00141 0.53622 2.04456 -0.00289 -0.38559 0.27917 -1.00437 -0.00084 0.40274 -0.00032 -0.24971 -0.00154 -0.84938 -0.00478 -1.06100 0.79868 -0.06096 0.00025 1.23080 -1.86511 0.00867 1.45400 0.70297 -0.52776 0.66778 -0.07399 -0.74636 -0.35671 -0.00019 -1.33223 -1.63016 0.00279 -1.19959 -0.11719 1.02517 0.99132 -0.21066 0.16762 0.15666 0.10392 0.08546 -0.01423 0.00060 0.00006 -0.00002 0.00017 0.00002 -0.00298 0.01044 -0.00899 0.00639 -0.00725 0.01309 0.01459 -0.05326 0.00003 0.07792 0.06923 -0.00002 -0.03031 -0.00001 0.02975 -0.00001 0.09811 0.00003 0.33106 1.06060 -0.05280 0.00012 0.71587 1.33642 -0.18730 -0.00031 0.13888 -0.27164 0.00447 1.05956 -0.33980 0.08128 0.00054 0.93641 0.00039 1.21358 -0.00140 -0.83824 -0.00235 -0.65623 1.42501 0.17253 -0.00056 1.39437 -0.32274 0.00188 1.79707 0.03839 0.04912 0.29020 0.34060 -0.63735 -0.23397 -0.00049 0.08257 -0.15922 -0.00036 -0.48912 0.43395 -1.14496 -0.48103 0.00738 0.04836 0.09595 -0.06920 -0.00520 -0.00677 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00003 0.00003 -0.00001 -0.00002 -0.00007 -0.00004 0.10461 -0.00003 0.00000 -0.08273 0.00000 -0.03850 0.00000 0.02353 0.00000 0.14529 -0.00028 -0.00046 0.00114 0.66312 -0.00030 0.00060 0.00309 -0.56134 -0.00018 -0.00026 -1.88620 0.00835 0.00005 0.00014 0.97308 -0.00027 -0.90219 0.00059 2.08773 -0.00359 3.16258 -0.01608 -0.00057 0.01236 2.44971 0.00012 0.01344 3.05059 0.00029 -0.00042 0.00230 -0.00034 -0.00038 0.00010 0.00118 -1.62638 0.00000 -0.00268 -1.62142 0.00109 -0.00045 -0.00025 -0.00049 0.00003 -0.00004 -0.00006 -0.00001 -0.00011 0.00001 0.00067 -0.00007 -0.00016 -0.00001 -0.00013 0.60044 -0.04930 0.04497 -0.05166 -0.08765 0.02975 0.00360 -0.00364 0.00000 -0.00110 0.00128 0.00000 -0.00714 0.00000 0.01304 0.00000 -0.02202 0.00001 -0.03946 -0.05711 -0.00198 0.00000 -0.04040 0.00552 -0.01074 -0.00003 0.02489 0.01389 -0.00006 -0.01174 0.00965 0.00162 0.00000 0.01838 0.00001 0.00567 -0.00002 -0.00941 0.00011 0.02220 0.04980 -0.01406 0.00007 0.01353 -0.00258 0.00000 0.00169 -0.01771 0.02685 0.13398 -0.01606 -0.06814 -0.03230 0.00000 0.00593 0.01159 -0.00003 -0.00949 0.01408 -0.00094 -0.00191 -0.22955 -0.86646 -1.34779 0.69324 -0.02128 -0.04317 0.00057 -0.00002 -0.00006 0.00000 -0.00007 0.43401 -0.06191 0.05645 -0.06504 -0.11074 0.03777 0.00468 -0.00454 0.00000 -0.00133 0.00169 0.00000 -0.00924 0.00000 0.01697 -0.00001 -0.02878 0.00001 -0.05148 -0.07275 -0.00294 0.00000 -0.05099 0.00729 -0.01394 -0.00004 0.03307 0.02044 -0.00008 -0.01648 0.01468 0.00293 0.00000 0.02627 0.00001 0.00810 -0.00002 -0.01464 0.00015 0.02897 0.06909 -0.01897 0.00009 0.01993 0.00005 -0.00002 0.00308 -0.02848 0.04525 0.21682 -0.02490 -0.11390 -0.05264 0.00000 0.00040 0.00790 -0.00002 -0.02252 0.02925 -0.00865 -0.00550 0.24833 0.95106 1.48310 -0.76506 0.02367 0.04816 -0.00040 -0.00032 -0.00064 -0.00013 -0.00031 0.01952 0.16961 -0.15226 0.17643 0.30792 -0.10937 -0.01492 0.00893 0.00000 0.00055 -0.00558 0.00000 0.02810 0.00000 -0.05132 0.00001 0.08227 -0.00003 0.13121 0.13180 0.01566 -0.00002 0.06503 -0.01157 0.02329 0.00006 -0.07984 -0.09345 0.00036 0.08118 -0.09855 -0.04020 -0.00002 -0.12786 -0.00006 -0.04647 0.00018 0.10194 -0.00032 -0.06058 -0.29778 0.06356 -0.00029 -0.13661 -0.11588 0.00064 -0.05514 0.25872 -0.45364 -2.01631 0.25759 1.08122 0.47895 -0.00002 0.25479 0.22495 -0.00036 0.41540 -0.46524 0.36222 0.15149 -0.03319 -0.25260 -0.41136 0.21340 -0.01142 -0.01767 0.00482 0.00075 0.00102 0.00129 0.00065 -0.02084 0.11182 -0.12750 0.17285 0.28680 -0.08503 -0.01239 0.03970 0.00000 0.03717 0.00630 0.00000 0.04676 -0.00001 -0.10683 0.00004 0.34437 -0.00009 1.17337 1.91187 0.03007 -0.00001 1.89788 -0.31046 0.43339 0.00104 -1.05590 -0.45045 0.00047 0.03610 0.17408 0.16181 0.00011 0.08138 0.00018 0.34087 -0.00089 -0.37054 -0.00573 -1.12063 -0.10403 0.24746 -0.00153 0.87546 0.25656 -0.00154 1.16999 -0.62239 0.98139 5.65251 -1.49613 -1.96538 -1.08668 0.00007 -0.70354 -0.54252 0.00084 -1.33441 1.14752 -2.33058 -0.84192 -0.01695 0.31247 0.67478 -0.48572 -0.01612 -0.03281 0.00008 -0.00006 0.00000 0.00017 -0.00002 0.00001 0.03249 -0.02062 0.00248 -0.05371 0.02554 -0.02643 0.18291 0.00008 -0.32419 0.33871 0.00010 0.08478 0.00002 -0.09414 0.00002 0.07377 -0.00003 -0.11117 0.05819 -0.00486 0.00002 -0.01136 0.11694 -0.15668 -0.00047 0.44439 -0.30833 -0.00115 -0.22121 -0.29893 -0.05361 -0.00011 0.15510 -0.00029 -0.30367 -0.00078 -0.37494 -0.00245 -0.47755 -0.31305 0.10140 -0.00055 0.02617 -0.09247 0.00048 0.00147 0.08040 -0.07883 0.13427 -0.12092 0.07507 -0.00911 0.00005 0.38067 -0.05542 -0.00011 -0.27770 -0.14621 -0.10437 0.01799 -0.00207 -0.00363 0.00398 -0.00269 -0.00011 -0.00904 0.00024 0.00002 -0.00020 0.00005 -0.00003 0.00012 0.04324 -0.03288 0.01963 -0.06947 0.07348 0.04999 -0.15713 0.00007 -0.29736 -0.32560 0.00010 0.12025 0.00002 -0.10518 0.00003 0.10978 -0.00005 -0.12426 0.11458 -0.01159 0.00003 -0.24304 0.03051 -0.02790 -0.00020 0.03637 0.22630 0.00080 0.18801 0.16186 -0.19096 -0.00029 0.23443 0.00005 0.61029 -0.00020 -0.02014 -0.00156 -0.29605 -0.62124 0.02808 -0.00010 -0.17265 -0.12605 0.00052 0.03770 0.03485 -0.06845 0.21945 -0.16469 0.14120 -0.00952 0.00006 -0.06664 0.27170 -0.00054 0.24078 -0.03343 -0.17103 -0.08292 0.00195 -0.00464 -0.00248 -0.01222 -0.00686 -0.00634 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 0.00001 -0.00001 0.00003 -0.00002 -0.00001 -0.00001 0.29976 0.00015 0.00000 0.42766 -0.00004 0.12008 0.00005 -0.01279 -0.00005 -0.02420 0.00006 -0.00004 -0.00003 -0.02310 0.00007 0.00005 0.00131 -0.48545 -0.00004 -0.00001 -0.01374 0.00016 0.00006 0.00061 -0.38007 0.00001 -0.77953 0.00021 0.05635 -0.00005 -0.14231 0.00089 0.00024 -0.00072 -0.13726 -0.00001 -0.00069 -0.17072 -0.00005 -0.00001 -0.00009 -0.00008 0.00008 -0.00003 -0.00008 0.24257 -0.00014 -0.00089 -0.43146 0.00010 0.00001 0.00006 0.00002 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00111 0.00122 0.00079 0.00014 0.00093 -0.00061 -0.00811 0.00165 0.00200 -0.00851 0.00569 -0.00754 0.05359 0.00002 -0.08555 0.09127 0.00003 0.00749 0.00000 -0.01357 0.00000 0.02967 0.00000 -0.09999 0.74283 -0.05768 -0.00007 0.58208 1.40891 -0.72311 -0.00182 0.94473 0.03252 -0.00062 -0.17259 0.57201 0.12507 0.00009 -0.17853 0.00047 0.34484 0.00173 0.85456 0.00798 1.58152 0.18998 -0.47870 0.00273 -0.88599 -0.39453 0.00171 -1.07225 0.05088 -0.01850 0.14206 -0.03482 0.10277 0.05480 -0.00011 -1.39402 -0.25479 0.00116 0.55718 0.52326 -0.13170 -0.12784 -0.06962 0.01308 0.00930 -0.04326 -0.00866 0.01082 0.00179 0.00086 0.00097 0.00129 0.00091 -0.00145 -0.01136 -0.00350 0.00365 -0.00201 0.02032 0.02175 -0.02791 0.00002 -0.06320 -0.08459 0.00004 0.04584 0.00000 -0.05788 0.00003 0.14519 -0.00008 -0.38369 0.96427 -0.12787 0.00018 0.17167 -0.63089 0.59199 0.00128 0.49073 1.35159 0.00500 0.90944 -0.86328 -0.07001 0.00013 0.03730 0.00014 -0.51842 -0.00149 -0.62239 -0.00187 -0.30235 1.25088 0.03521 -0.00084 0.95410 -0.65901 0.00245 0.79413 0.24432 -0.11669 0.17398 -0.01620 0.03077 0.02944 -0.00012 -0.05396 -0.95888 0.00200 -1.02466 0.10513 -0.82776 -0.11592 -0.08486 0.00464 0.05181 -0.06939 -0.00543 -0.04202 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00002 0.00001 0.00000 0.00002 0.00000 0.07404 0.00004 -0.00001 0.14564 -0.00001 0.02789 0.00003 0.02412 -0.00010 -0.14728 0.00015 -0.00037 -0.00072 -0.47938 -0.00015 -0.00031 0.00188 -1.14630 -0.00006 -0.00042 2.14635 -0.01016 -0.00002 -0.00137 0.30841 -0.00017 1.40295 -0.00068 -0.88155 0.00174 -1.22273 0.00621 -0.00041 -0.00487 -0.97212 -0.00040 -0.00472 -1.16587 -0.00049 0.00003 -0.00078 -0.00002 0.00009 0.00000 -0.00026 -0.57379 0.00050 0.00312 1.48261 -0.00041 0.00013 0.00048 0.00028 0.00004 0.00000 -0.00001 0.00003 0.00005 0.00001 0.00741 0.00046 0.57030 -0.18737 0.00062 0.00014 -0.08165 -0.00240 0.06706 0.03256 0.05107 0.02503 -0.02521 0.00000 -0.01794 0.02502 0.00000 0.00032 0.00000 -0.00004 0.00001 -0.00010 0.00000 0.01368 -0.00312 0.02828 0.00003 0.01131 -0.04807 -0.05458 -0.00015 0.03557 0.01017 0.00003 0.01057 0.00077 0.01927 0.00002 0.00796 0.00002 0.02016 0.00002 0.00249 0.00005 0.01110 0.02002 0.02769 -0.00015 0.00138 0.08968 -0.00038 0.00115 -0.00621 -0.00437 0.02362 0.04482 0.02660 -0.00426 -0.00001 0.01227 -0.02623 0.00007 0.06254 -0.09153 -0.05605 0.00651 -0.93270 -0.51088 0.67483 0.44326 0.57790 0.99345 0.00550 0.00050 0.41238 -0.13525 0.00054 0.00016 -0.10243 -0.00336 0.08400 0.04094 0.06361 0.03163 -0.03293 -0.00001 -0.02312 0.03245 0.00000 0.00034 0.00000 0.00006 0.00001 -0.00033 0.00000 0.01844 -0.00435 0.03709 0.00004 0.01569 -0.06140 -0.07064 -0.00020 0.05058 0.01731 0.00003 0.01051 0.00489 0.03238 0.00004 0.01327 0.00002 0.02572 0.00002 0.00146 0.00005 0.01328 0.02632 0.03793 -0.00020 0.00240 0.13541 -0.00058 0.00187 -0.01213 -0.00149 0.03880 0.08000 0.04716 -0.00333 -0.00002 0.02142 -0.04212 0.00012 0.10105 -0.14877 -0.09322 0.00898 1.01140 0.56187 -0.74420 -0.49013 -0.64260 -1.10804 -0.00059 -0.00175 0.01868 -0.00784 -0.00107 -0.00060 0.28796 0.01347 -0.22949 -0.11297 -0.16171 -0.08515 0.10883 0.00002 0.07110 -0.10055 -0.00001 0.00034 0.00000 -0.00246 -0.00002 0.00641 -0.00002 -0.04748 0.00113 -0.09946 -0.00010 -0.07489 0.10277 0.15687 0.00042 -0.23955 -0.16357 0.00030 0.08135 -0.14343 -0.29962 -0.00025 -0.11416 -0.00012 -0.03661 -0.00005 0.04365 0.00006 -0.00399 -0.06595 -0.15203 0.00075 -0.01540 -0.90077 0.00397 -0.00941 0.12353 -0.18489 -0.45602 -0.94821 -0.66544 -0.10926 0.00017 -0.25518 0.37245 -0.00101 -0.96917 1.44113 1.06838 -0.01805 -0.18472 -0.17204 0.23760 0.14731 0.22176 0.38042 0.00703 0.01208 -0.02347 0.02172 0.00661 0.00091 0.10331 0.05769 -0.08771 -0.06080 -0.14479 -0.12917 0.04569 0.00001 0.03821 -0.13415 0.00000 -0.01005 -0.00006 0.01926 -0.00004 -0.04761 0.00018 0.29312 0.13876 -0.66107 -0.00131 0.49486 2.42096 2.57783 0.00764 0.72207 0.90492 -0.00548 -1.75614 0.62764 2.69504 0.00166 0.29348 0.00041 -0.24712 0.00075 0.22354 0.00108 0.15329 -1.18529 -0.50794 0.00344 -0.80455 -1.74510 0.00640 -0.77507 -0.49286 3.62204 3.47817 3.75425 4.24375 2.89980 -0.00023 -0.81710 -1.50850 0.00362 1.97042 -6.38342 -5.54508 -0.36079 -0.05381 0.38534 -0.48911 -0.46647 -0.67814 -1.11803 0.00046 -0.00029 0.00030 -0.00079 -0.00014 0.00006 0.00251 0.14096 -0.17440 0.16097 -0.17910 0.03757 -0.34881 0.00000 -0.11056 0.18234 -0.00002 0.03306 0.00003 -0.06562 -0.00010 0.07328 0.00007 0.07632 -0.03350 -0.04314 -0.00002 -0.03052 -0.13163 -0.01587 -0.00013 0.11261 -0.06129 -0.00100 -0.16065 -0.20125 -0.40837 -0.00043 -0.08460 -0.00003 0.17774 -0.00003 0.12634 0.00042 0.07267 0.14257 0.19051 -0.00110 0.07628 0.05704 -0.00050 0.16692 0.28792 0.84527 0.10877 0.61272 0.35789 0.33889 0.00004 -0.06749 0.47563 -0.00107 -0.23599 0.19466 0.27623 -0.02446 0.02423 -0.02068 -0.00818 -0.02178 0.01243 0.04371 -0.00011 -0.00003 -0.00005 0.00009 -0.00003 -0.00011 -0.00508 -0.01725 0.02005 -0.04757 0.04343 0.00899 -0.01246 0.00004 0.22161 0.03312 -0.00005 0.19461 0.00003 -0.41310 0.00002 0.46572 -0.00003 -0.01024 0.05803 0.01335 0.00008 -0.35832 0.04202 -0.01316 -0.00002 0.13517 -0.06893 -0.00046 -0.13216 0.09720 0.19276 0.00003 -0.27992 -0.00001 -0.06803 0.00074 0.44573 -0.00050 -0.09451 -0.00178 0.08820 -0.00045 0.41751 -0.02943 0.00016 0.63508 -0.06666 -0.15600 -0.00787 -0.11884 -0.10364 -0.08452 -0.00001 0.02852 0.01647 -0.00004 0.06979 -0.03778 -0.03216 0.00374 -0.00024 0.00388 0.00589 0.00312 -0.00060 -0.00582 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 0.00003 -0.00001 0.00003 -0.00001 0.00006 0.15011 -0.00004 -0.00004 -0.19536 -0.00004 0.16758 0.00000 -0.41568 0.00002 0.47795 -0.00003 -0.00004 0.00048 0.27176 0.00010 0.00011 0.00015 -0.03192 -0.00009 0.00001 0.25256 -0.00114 -0.00004 0.00016 -0.41680 0.00007 0.03051 -0.00011 -0.52597 0.00091 0.06235 -0.00020 0.00002 0.00202 0.41337 -0.00003 0.00243 0.54791 -0.00004 -0.00005 0.00015 -0.00005 -0.00013 -0.00006 -0.00001 -0.00270 -0.00002 -0.00035 -0.13018 0.00009 -0.00008 -0.00007 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 -0.00826 0.00672 0.00455 0.01714 0.00918 -0.00349 -0.02128 -0.05895 -0.00617 0.03219 0.12642 0.13565 0.13557 0.00001 -0.01006 -0.01408 0.00000 0.02389 0.00001 -0.06194 0.00004 0.21142 0.00018 1.85668 0.29741 -0.31462 0.00018 0.67183 0.46688 -0.09162 -0.00011 1.02296 3.64665 -0.00690 -1.63462 1.54245 1.22600 0.00056 0.63879 0.00025 -0.81412 -0.00080 -0.48971 0.00011 -0.06794 0.28362 1.69152 -0.00962 -0.50988 -3.53759 0.01671 -0.22027 4.10614 -0.62314 1.86936 2.20663 -0.72552 -0.71028 0.00002 -3.69150 -3.43158 0.00680 -2.79035 -3.57299 1.77860 3.53740 -0.46335 0.50599 0.13138 0.35017 0.06900 -0.57524 0.00141 -0.00067 -0.00076 -0.00283 -0.00121 0.00084 -0.00121 0.01287 0.00144 -0.01042 -0.01762 -0.02437 -0.01994 0.00000 0.04223 -0.00061 -0.00001 0.03035 0.00000 -0.14833 0.00000 0.29371 -0.00005 -0.27348 -0.01102 0.09017 0.00008 -0.74496 -0.33049 -0.05957 -0.00009 -0.12737 -0.69415 -0.00178 -0.42018 0.18044 -0.11410 -0.00019 -0.34916 -0.00016 -0.27585 0.00080 0.30408 0.00546 1.17298 -0.54533 -0.65651 0.00348 -1.23593 0.76758 -0.00375 -3.85238 -0.54700 0.24481 -0.23232 -0.23831 0.25793 0.20520 0.00006 0.29648 0.31846 -0.00029 0.59854 0.69682 -0.12246 -0.54176 0.06190 -0.07629 -0.04033 -0.05594 -0.01685 0.09843 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 -0.00004 0.00002 0.00000 0.00005 0.00001 0.02292 0.00000 0.00000 -0.03428 -0.00001 0.03246 0.00001 -0.15965 -0.00002 0.31905 -0.00032 -0.00009 0.00043 0.35224 0.00005 -0.00002 -0.00172 0.58150 -0.00026 -0.00048 0.93961 -0.00420 -0.00036 -0.00096 -0.10559 -0.00006 0.18524 0.00003 -0.25285 0.00041 -1.48687 0.00730 0.00022 -0.00664 -1.49576 -0.00011 -0.01571 -3.74755 -0.00011 -0.00047 -0.00254 -0.00012 -0.00005 0.00039 -0.00116 0.22615 0.00055 0.00228 0.81754 -0.00049 0.00077 -0.00006 0.00010 0.00007 -0.00009 0.00000 -0.00004 0.00013 0.00004 0.00002 0.01898 0.18705 0.57014 0.00156 0.00007 -0.06604 -0.06424 0.06909 -0.04399 -0.01194 -0.02691 0.01753 0.00000 0.00937 -0.01005 0.00000 -0.00019 0.00001 -0.00005 -0.00001 0.00037 0.00000 -0.01826 0.01642 -0.03241 -0.00002 -0.00225 0.03855 0.01525 0.00004 -0.03346 0.03691 -0.00029 -0.06012 -0.00298 -0.03003 -0.00003 0.00396 -0.00002 -0.01032 -0.00004 -0.01019 -0.00003 -0.00851 0.00905 0.04827 -0.00028 -0.00273 0.01004 -0.00003 0.00414 0.01018 0.02566 0.00354 0.01519 0.03633 0.00126 0.00000 0.06551 -0.00749 0.00000 0.05801 0.12603 0.03306 -0.01810 -0.81201 -0.12791 0.53767 0.52769 -0.12975 -1.35822 0.00008 0.01388 0.13538 0.41191 0.00121 0.00007 -0.08303 -0.08057 0.08635 -0.05511 -0.01555 -0.03428 0.02168 0.00000 0.01191 -0.01260 -0.00001 -0.00029 0.00001 -0.00001 -0.00001 0.00029 0.00000 -0.02573 0.02171 -0.04426 -0.00002 -0.00313 0.05116 0.02222 0.00005 -0.04321 0.04799 -0.00039 -0.08135 -0.00189 -0.04054 -0.00003 0.00663 -0.00002 -0.01393 -0.00006 -0.01519 -0.00005 -0.01315 0.01204 0.06380 -0.00037 -0.00213 0.02597 -0.00010 0.00592 0.00553 0.03155 0.00447 0.02598 0.05949 -0.00003 -0.00001 0.10822 -0.01026 0.00000 0.09590 0.20748 0.05402 -0.03221 0.88109 0.14069 -0.59298 -0.58370 0.14442 1.51556 -0.00061 -0.00021 0.00539 0.02141 -0.00070 -0.00024 0.23557 0.22349 -0.23478 0.14979 0.05223 0.10229 -0.04885 -0.00001 -0.03325 0.03116 0.00002 0.00188 -0.00003 -0.00147 0.00003 0.00406 0.00000 0.11766 -0.06292 0.15618 0.00006 0.01205 -0.14326 -0.10824 -0.00028 0.08943 -0.11421 0.00128 0.27214 -0.05024 0.10851 0.00005 -0.06170 0.00009 0.04582 0.00029 0.09382 0.00049 0.09591 -0.03008 -0.14454 0.00085 -0.04745 -0.51440 0.00210 -0.03056 0.26408 0.05074 -0.00379 -0.25812 -0.55658 0.07703 0.00009 -1.16071 0.11308 -0.00010 -1.09759 -2.16405 -0.54689 0.45367 -0.19971 -0.03536 0.18819 0.19481 -0.06285 -0.54894 0.00195 0.00258 -0.00751 -0.04373 0.00037 0.00151 0.10399 0.09966 -0.05472 0.04338 0.03908 0.00438 -0.06532 0.00000 -0.00453 0.03066 0.00000 -0.00479 0.00000 0.01105 -0.00002 -0.06561 -0.00009 -0.19762 -0.61732 0.27501 0.00037 -0.18638 -1.49266 0.80389 0.00233 1.18954 -2.97147 0.00979 2.10695 -0.39497 -0.78823 -0.00003 -0.24739 -0.00010 0.86735 0.00045 0.27767 -0.00121 -0.01028 -0.50856 -4.56794 0.02607 1.09329 4.08647 -0.01941 0.08944 -3.22607 -3.57087 -0.73545 0.01888 1.17268 -1.07594 -0.00061 5.17329 -0.67099 0.00144 5.50856 9.54161 2.74186 -4.09830 0.49240 0.04104 -0.50348 -0.50451 0.09658 1.67332 0.00025 -0.00046 0.00097 -0.00031 -0.00007 -0.00004 -0.05320 0.08919 0.17432 0.09301 0.38790 0.12106 0.20110 0.00001 0.07768 -0.05271 -0.00001 0.05845 0.00002 -0.05111 0.00001 -0.04682 -0.00003 -0.13363 0.01297 0.09936 -0.00005 0.03720 0.08914 -0.04042 -0.00007 -0.07901 -0.01432 0.00109 0.20720 0.36064 0.07607 -0.00004 -0.05834 -0.00001 -0.24648 0.00007 -0.07379 -0.00086 -0.16617 -0.10716 -0.40388 0.00232 0.11629 -0.09496 0.00017 -0.03002 0.48839 0.21500 0.30958 0.58718 0.44824 0.32689 0.00006 -0.21072 0.42380 -0.00097 -0.60882 0.25943 0.35605 -0.21145 -0.01462 -0.03892 0.03184 0.00724 0.03350 0.03727 -0.00003 0.00008 -0.00016 0.00006 0.00001 0.00001 0.00806 -0.01310 -0.02826 -0.01863 -0.05681 -0.01420 -0.05581 0.00001 0.10525 0.05160 -0.00005 0.38391 0.00007 -0.32810 0.00000 -0.30078 0.00002 -0.13068 -0.30696 -0.03808 -0.00017 0.41280 0.10175 -0.03608 -0.00012 0.00289 0.15731 0.00037 0.10689 -0.00839 -0.06473 -0.00014 -0.40225 0.00010 0.23205 -0.00014 -0.01734 -0.00184 -0.38240 0.09426 0.08789 -0.00051 0.24637 0.01443 -0.00002 -0.65722 -0.03980 -0.02622 -0.03788 -0.06895 -0.06976 -0.04972 -0.00002 0.06788 -0.08827 0.00018 0.06595 -0.04487 -0.06748 0.03053 0.00229 0.00637 -0.00516 -0.00143 -0.00551 -0.00627 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00003 0.00003 -0.00002 0.00001 0.00001 -0.00001 0.00000 0.06031 -0.00004 -0.00001 -0.16942 -0.00008 0.36582 0.00000 -0.33626 -0.00001 -0.29770 0.00007 0.00013 -0.00084 -0.52684 -0.00013 -0.00031 -0.00006 -0.11933 0.00003 -0.00005 -0.25317 0.00139 -0.00002 0.00070 -0.33495 0.00011 0.27511 -0.00021 0.07267 -0.00016 0.40040 -0.00198 -0.00003 0.00115 0.17733 -0.00004 -0.00302 -0.69175 -0.00003 -0.00020 -0.00039 0.00002 0.00006 0.00004 -0.00009 -0.02228 0.00003 0.00006 0.03932 0.00005 0.00009 0.00001 -0.00004 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00092 0.01615 -0.01153 0.00690 0.00867 -0.00156 -0.00348 0.03137 0.04065 -0.00473 -0.01354 -0.05164 -0.01039 0.00000 -0.03883 -0.02751 0.00000 0.03041 -0.00004 -0.03628 -0.00002 0.05260 0.00015 1.70148 -0.07646 -0.27062 -0.00119 1.11070 0.66099 2.28989 0.00654 2.11538 1.81586 -0.00477 -1.40807 0.16425 1.96256 0.00133 0.56391 0.00042 0.33526 -0.00008 -0.03652 -0.00046 -0.13977 -0.73530 -1.84850 0.01080 -0.08723 -3.36824 0.01380 0.48305 -1.00756 2.25977 2.74652 3.53610 2.11956 2.47524 -0.00019 -0.85675 -3.54681 0.00723 2.42764 -2.44985 -1.38116 -0.37679 -0.21039 0.58631 -0.36173 -0.21290 -0.46033 -0.31097 0.00006 -0.00277 0.00186 -0.00103 -0.00151 0.00033 0.00242 -0.00606 -0.00809 0.00123 0.00186 0.01165 -0.00933 0.00000 0.02121 0.01869 -0.00001 0.10672 0.00003 -0.09117 0.00000 -0.20564 -0.00001 -0.43652 -0.29418 0.00131 -0.00004 0.66727 -0.02211 -0.26775 -0.00084 -0.48216 -0.20482 0.00281 0.70806 -0.42635 -0.41484 0.00001 0.64403 -0.00008 -0.00187 -0.00091 -0.48848 -0.00133 -0.28855 0.46482 0.30139 -0.00171 -0.53947 0.43197 -0.00163 3.90749 -0.01839 -0.46861 -0.53787 -0.72331 -0.33474 -0.40809 0.00007 0.17887 0.74126 -0.00161 -0.35355 0.28002 0.22908 0.08965 0.03793 -0.09993 0.06009 0.03942 0.07607 0.04537 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 0.00005 -0.00002 -0.00001 -0.00008 -0.00002 0.00701 0.00000 0.00000 -0.03969 -0.00002 0.10070 0.00000 -0.09350 -0.00001 -0.19020 0.00001 0.00012 -0.00095 -0.74940 -0.00030 -0.00042 0.00044 -0.32138 0.00011 -0.00028 -0.65272 0.00343 0.00019 0.00019 0.65830 -0.00017 -0.36837 0.00032 0.43954 -0.00064 0.46256 -0.00230 -0.00035 -0.00380 -0.29556 0.00043 0.01788 3.99744 0.00017 0.00052 0.00216 -0.00041 -0.00070 -0.00071 0.00111 0.07410 0.00043 -0.00116 -0.50004 0.00083 0.00037 0.00029 -0.00082 0.00001 -0.00001 0.00000 0.00001 -0.00012 0.00017 -0.00194 0.59933 -0.00628 -0.01789 -0.02923 0.00006 -0.04081 -0.09605 -0.05051 -0.01040 -0.04647 0.03138 -0.00601 0.00000 -0.00334 0.00363 0.00000 0.00007 0.00001 0.00001 0.00001 0.00008 0.00001 0.00844 -0.00194 0.05950 -0.00006 0.00768 -0.01056 -0.00353 0.00000 0.03011 0.01632 0.00011 0.01729 0.03644 0.05539 0.00004 0.01449 0.00002 -0.01057 0.00001 -0.01029 -0.00007 -0.01094 -0.01107 -0.04544 0.00026 0.00985 0.03367 -0.00018 -0.00060 -0.01240 0.05238 -0.04035 -0.02526 0.01873 -0.06234 0.00000 -0.00403 0.07554 -0.00016 -0.05206 0.02881 -0.02698 0.07629 -0.85486 0.66808 -0.27415 0.00846 -1.27845 0.46594 -0.00136 0.43322 -0.00435 -0.01282 -0.02095 0.00007 -0.05142 -0.12065 -0.06340 -0.01309 -0.05864 0.03941 -0.00786 0.00000 -0.00419 0.00479 0.00000 0.00005 0.00001 0.00007 0.00001 -0.00005 0.00001 0.00973 -0.00245 0.07754 -0.00007 0.00970 -0.01474 -0.00574 0.00000 0.04140 0.02321 0.00015 0.02313 0.05465 0.07461 0.00005 0.02162 0.00003 -0.01558 0.00001 -0.01594 -0.00010 -0.01570 -0.01286 -0.05557 0.00032 0.01342 0.05958 -0.00031 -0.00159 -0.02464 0.07485 -0.06726 -0.04398 0.02848 -0.10564 0.00000 -0.00551 0.12323 -0.00025 -0.08490 0.04687 -0.04305 0.12356 0.92765 -0.73527 0.30256 -0.00915 1.42147 -0.51954 -0.00048 0.02064 -0.00195 -0.00110 -0.00210 -0.00025 0.14773 0.34037 0.17890 0.03602 0.16603 -0.10647 0.02675 0.00000 0.01049 -0.01715 0.00001 0.00086 -0.00004 -0.00168 -0.00003 0.00375 -0.00006 0.00465 0.00213 -0.18896 0.00012 -0.01734 0.05525 0.04413 0.00007 -0.15923 -0.13541 -0.00039 -0.04751 -0.33117 -0.23949 -0.00015 -0.13489 -0.00011 0.08408 0.00009 0.11399 0.00052 0.07698 -0.02866 -0.02338 0.00009 -0.04350 -0.66192 0.00309 0.03170 0.35421 -0.32531 0.66267 0.47494 -0.20500 1.10309 -0.00002 0.06762 -1.29312 0.00263 0.94441 -0.43918 0.41296 -1.28325 -0.19202 0.22370 -0.09761 -0.00263 -0.47816 0.16047 -0.00020 -0.03213 0.01001 0.00669 0.00701 0.00050 0.06169 0.08919 -0.01121 0.03583 0.08141 0.09609 0.07511 0.00000 0.04028 -0.00158 0.00001 -0.00663 -0.00001 0.00773 0.00001 -0.01803 -0.00012 -0.42116 0.02019 -2.08757 0.00374 -0.44291 -0.20888 -0.58900 -0.00163 -0.46553 -0.50759 0.00237 0.70213 1.69215 -2.22550 -0.00217 0.01413 -0.00031 -0.77411 -0.00111 -0.30520 0.00108 0.16984 1.31463 5.01039 -0.02901 -0.65360 1.75219 -0.00538 -0.14300 -1.24283 -2.77296 -1.79722 -1.17861 0.23381 -5.63566 -0.00012 -1.54037 4.20063 -0.00824 -5.26458 0.32324 -0.80452 6.28391 0.19904 -0.45571 0.31512 0.14961 1.23157 -0.50996 0.00011 0.00007 0.00033 0.00033 -0.00113 0.00003 -0.03642 0.01622 0.20641 -0.19442 -0.29070 -0.27941 -0.14271 -0.00001 -0.01901 0.02980 0.00004 0.06647 -0.00015 0.04249 -0.00010 -0.05053 0.00014 0.06145 0.03729 -0.09591 0.00048 -0.05559 -0.14760 -0.28226 -0.00076 0.02704 -0.00474 0.00070 0.13394 -0.00462 0.40211 0.00046 -0.01781 0.00005 0.00102 0.00006 -0.02291 -0.00056 -0.08918 -0.02216 -0.11656 0.00076 -0.08943 -0.05255 0.00052 0.00293 -0.74418 -0.44537 0.19877 0.50029 0.26733 0.32560 0.00005 -0.21756 0.44128 -0.00092 -0.48062 0.05343 0.25288 -0.51545 -0.00141 -0.03799 0.03703 0.02601 -0.04955 0.00149 -0.00002 -0.00001 -0.00005 -0.00005 0.00017 0.00000 0.00564 -0.00224 -0.03184 0.02921 0.04520 0.04426 0.01431 0.00001 0.05911 0.02339 -0.00004 0.42984 0.00011 0.27509 0.00001 -0.32918 0.00000 0.17738 0.32935 0.03593 0.00011 -0.40618 -0.01281 0.04793 0.00014 0.06053 -0.09114 -0.00055 -0.13070 0.05361 0.01431 -0.00010 -0.29530 0.00005 0.08813 -0.00018 -0.06766 -0.00149 -0.31924 0.36679 -0.12464 0.00058 -0.62430 0.02312 -0.00015 0.28168 0.09486 0.06741 -0.03527 -0.08624 -0.03669 -0.04774 0.00000 0.01783 -0.06583 0.00015 0.08182 -0.00662 -0.03367 0.08124 0.00016 0.00559 -0.00578 -0.00375 0.00770 -0.00014 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 0.00004 0.00008 -0.00006 -0.00009 -0.00011 -0.00006 0.01977 -0.00003 0.00001 -0.11992 -0.00009 0.42422 0.00000 0.27511 -0.00002 -0.33988 -0.00002 -0.00015 0.00091 0.54671 0.00015 0.00028 0.00021 0.04653 -0.00002 0.00013 0.16918 -0.00103 -0.00023 0.00004 -0.30967 0.00008 0.11134 0.00007 0.08137 -0.00012 0.38770 -0.00188 -0.00017 -0.00404 -0.69005 0.00010 0.00166 0.32128 0.00003 -0.00005 -0.00020 0.00004 0.00009 0.00004 0.00004 0.01350 -0.00008 0.00016 -0.00301 -0.00023 -0.00002 0.00014 -0.00018 0.00000 -0.00002 0.00002 0.00001 -0.00002 0.00001 -0.00347 0.00490 -0.00665 -0.00947 0.01467 -0.00170 -0.02481 -0.06924 0.02032 -0.00102 0.11505 0.09517 0.13277 0.00001 0.01660 -0.04573 -0.00001 0.02542 0.00000 -0.01076 -0.00003 0.02916 0.00006 1.68693 -0.24416 -1.23445 0.00079 0.52560 -0.27793 2.21789 0.00636 2.46528 0.34428 0.00106 0.03400 1.33907 -0.29089 -0.00038 0.33276 0.00001 0.11723 -0.00043 -0.00413 0.00041 0.13391 -0.37199 -2.78331 0.01599 0.83414 0.48409 -0.00285 -0.10086 0.90200 -3.54240 2.01868 3.28075 2.19714 -2.86384 -0.00083 0.08332 -3.40894 0.00718 1.35943 2.50200 1.84874 1.11975 -0.05790 0.55939 -0.39887 -0.23739 0.26244 0.29879 0.00058 -0.00062 0.00097 0.00144 -0.00217 0.00016 0.00295 0.01107 -0.00206 -0.00016 -0.01733 -0.01603 -0.01777 0.00000 0.01238 0.01006 -0.00001 0.09100 0.00002 0.07254 0.00000 -0.32383 0.00000 -0.00122 0.48395 0.22768 0.00014 -0.81971 -0.05610 -0.36625 -0.00101 -0.30401 -0.14640 -0.00139 -0.29813 -0.04728 0.07918 0.00003 0.01469 -0.00012 -0.22647 0.00078 0.33547 0.00467 0.98143 -0.87761 0.74433 -0.00402 1.58745 -0.07009 0.00037 -2.48056 -0.00745 0.60505 -0.23515 -0.38659 -0.36232 0.43615 0.00007 0.01283 0.42977 -0.00091 -0.24977 -0.33419 -0.32007 -0.19989 0.00691 -0.07999 0.06118 0.03171 -0.04275 -0.04489 0.00000 0.00000 0.00000 0.00000 0.00001 0.00000 -0.00001 -0.00003 -0.00003 0.00001 0.00001 0.00007 0.00002 0.00477 -0.00001 -0.00001 -0.02407 -0.00002 0.09446 -0.00001 0.06675 0.00001 -0.32380 0.00052 -0.00027 0.00079 0.82917 0.00052 0.00045 0.00087 0.22507 0.00086 0.00034 0.42096 -0.00236 0.00057 -0.00068 0.06144 0.00010 -0.04531 -0.00008 -0.34009 0.00049 -1.16753 0.00574 0.00053 0.01067 1.70213 -0.00040 -0.01231 -2.59130 -0.00018 -0.00117 -0.00179 0.00102 0.00184 0.00147 -0.00119 -0.10113 -0.00041 -0.00035 0.22956 0.00001 0.00029 -0.00016 0.00115 -0.00002 0.00019 -0.00015 -0.00011 0.00016 -0.00008 -0.00028 0.02891 -0.00136 -0.00214 0.59964 0.00014 -0.02001 -0.06524 -0.07578 0.04213 0.06223 -0.02972 0.00121 0.00000 0.00137 -0.00141 0.00000 0.00000 -0.00001 -0.00001 -0.00001 0.00044 -0.00001 0.01344 0.00070 -0.07923 0.00012 0.00460 0.00173 0.00384 0.00001 0.01042 0.02451 -0.00014 -0.03165 -0.00568 0.00615 0.00001 0.00917 0.00000 0.01191 -0.00002 -0.00355 0.00000 -0.00005 0.00523 0.00069 0.00001 0.00317 0.06024 -0.00027 -0.00180 -0.00312 -0.04354 -0.00711 -0.02837 -0.05384 0.12013 0.00002 -0.00058 0.05086 -0.00011 -0.02573 -0.00843 0.00425 -0.03968 -0.75054 0.86449 -0.68257 -0.47530 1.03258 -0.18574 -0.00016 0.02108 -0.00086 -0.00149 0.43356 0.00013 -0.02525 -0.08176 -0.09466 0.05262 0.07785 -0.03902 0.00085 0.00000 0.00174 -0.00164 0.00000 -0.00005 -0.00001 0.00007 -0.00002 0.00035 -0.00002 0.01462 0.00167 -0.10232 0.00016 0.00547 0.00359 0.00345 0.00001 0.01157 0.03506 -0.00021 -0.04645 -0.00888 0.00931 0.00002 0.01361 0.00000 0.01702 -0.00003 -0.00579 -0.00001 -0.00050 0.00836 0.00409 0.00000 0.00453 0.09554 -0.00042 -0.00299 -0.00319 -0.05904 -0.01652 -0.05278 -0.08864 0.19028 0.00003 0.00082 0.08339 -0.00018 -0.04013 -0.01532 0.00653 -0.06804 0.81349 -0.95024 0.75197 0.52504 -1.14650 0.20686 -0.00052 -0.00005 -0.00131 -0.00066 0.01965 -0.00030 0.07325 0.22562 0.25484 -0.13950 -0.20427 0.13772 0.01323 0.00000 -0.00441 0.00062 0.00000 0.00124 0.00002 -0.00209 0.00005 0.00465 0.00005 0.03812 -0.02485 0.21860 -0.00028 -0.00273 -0.05187 0.01360 0.00006 0.01320 -0.17873 0.00122 0.26270 0.04120 -0.05636 -0.00009 -0.08511 0.00000 -0.07784 0.00018 0.05225 0.00011 0.01613 -0.06796 -0.11470 0.00046 -0.02238 -0.77305 0.00352 0.02754 -0.04629 0.14403 0.32797 0.73105 0.88707 -1.64413 -0.00026 -0.07922 -0.86972 0.00184 0.33829 0.19299 -0.01361 0.77122 -0.14854 0.27391 -0.21878 -0.15599 0.35003 -0.06156 0.00354 0.00347 0.00447 0.00599 -0.02555 0.00165 0.05511 0.19149 0.14786 -0.09710 -0.26648 -0.01267 -0.14113 -0.00001 -0.02583 0.04896 0.00001 -0.00948 -0.00002 0.01851 0.00005 -0.06992 0.00028 -1.41588 0.25656 2.83036 -0.00469 -0.38773 0.44624 -1.05717 -0.00321 -1.60773 -0.23513 -0.00153 -0.18926 -0.82287 0.37525 0.00023 -0.16792 0.00008 -0.13250 0.00067 -0.00463 0.00037 -0.04862 0.09852 2.04802 -0.01212 -0.42676 -0.19166 0.00169 -0.23946 -0.44859 3.68981 -1.65963 -3.49876 -3.29069 6.52063 0.00118 0.69016 2.75018 -0.00609 0.19935 -1.95617 -1.73878 -2.44228 0.14471 -0.60872 0.44093 0.28533 -0.79032 -0.04302 -0.00011 0.00045 0.00021 0.00014 -0.00048 -0.00003 -0.04377 -0.12440 -0.09997 0.00821 -0.07269 0.48052 0.12334 0.00000 0.01829 -0.00970 0.00001 0.04269 -0.00008 0.06323 -0.00017 0.06828 -0.00015 -0.06055 -0.00687 0.25533 -0.00081 0.01810 0.13787 0.16820 0.00042 -0.08872 0.08630 -0.00138 -0.26052 -0.19987 -0.24555 0.00002 -0.08599 -0.00017 0.13582 -0.00060 -0.06704 0.00076 0.11379 0.04603 0.28440 -0.00175 -0.00321 0.08774 0.00001 -0.00685 -0.42251 -0.77098 0.16998 0.37426 0.22931 -0.33250 -0.00006 -0.24597 0.11949 -0.00019 -0.43546 -0.14029 0.36045 -0.49654 -0.02938 0.01511 0.00363 0.01206 -0.03294 0.00790 0.00002 -0.00007 -0.00003 -0.00002 0.00007 0.00001 0.00669 0.01899 0.01523 -0.00136 0.01115 -0.07247 -0.02107 0.00000 0.02203 0.01612 -0.00002 0.28337 0.00007 0.41851 0.00002 0.44951 0.00000 -0.09065 -0.16474 -0.04803 0.00004 0.13894 0.00052 -0.03489 -0.00009 0.01569 0.01250 0.00017 0.02945 0.09672 0.06750 -0.00009 -0.42447 0.00011 0.13312 -0.00095 -0.62086 0.00199 0.42123 -0.27260 0.02798 -0.00007 0.24496 -0.02259 0.00004 0.10442 0.06277 0.11321 -0.02917 -0.06113 -0.03496 0.04949 0.00001 0.04100 -0.01324 0.00001 0.06631 0.01819 -0.05407 0.07583 0.00455 -0.00243 -0.00053 -0.00174 0.00508 -0.00124 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00002 -0.00006 -0.00006 0.00002 0.00000 0.00016 0.00004 0.00669 0.00000 0.00000 -0.06547 -0.00006 0.28283 0.00000 0.42276 0.00002 0.45703 0.00001 0.00007 -0.00045 -0.23313 -0.00006 -0.00004 -0.00002 -0.01267 -0.00006 -0.00001 0.00010 -0.00013 -0.00033 0.00007 -0.35927 0.00006 0.24887 0.00011 0.63536 -0.00105 -0.48497 0.00232 0.00016 0.00188 0.31036 -0.00003 0.00039 0.09587 -0.00001 -0.00022 -0.00037 0.00010 0.00021 0.00008 -0.00008 0.00139 -0.00011 0.00002 -0.01182 -0.00020 0.00000 0.00018 -0.00015 -0.00001 0.00001 0.00000 0.00001 -0.00001 0.00001 -0.00069 -0.00636 -0.00069 0.00326 0.00647 -0.00049 0.00690 -0.00163 -0.01103 -0.02073 -0.07752 0.08055 0.00577 0.00000 -0.01117 0.00092 0.00001 0.01503 -0.00002 0.01946 -0.00004 0.09346 -0.00015 0.64389 -0.16106 -1.07437 0.00164 0.31985 -0.09941 1.01896 0.00301 1.31603 -0.00308 0.00386 0.70823 2.22771 -0.59114 -0.00135 0.31554 0.00018 -0.79457 0.00014 -0.15701 -0.00040 -0.12433 0.63959 3.25015 -0.01887 -0.75757 -1.32234 0.00774 -0.08047 -2.19010 -0.66267 0.55388 1.28256 0.80907 -0.19796 0.00004 -0.79794 0.46626 -0.00093 -0.99898 -0.04150 -1.23037 3.73311 0.03611 0.04731 -0.02646 -0.03399 0.33541 -0.25319 0.00008 0.00092 0.00013 -0.00049 -0.00101 0.00012 -0.00076 0.00006 0.00122 0.00324 0.01172 -0.01152 -0.00254 0.00000 0.00430 0.00401 0.00000 0.07480 0.00002 0.17014 0.00000 0.42863 0.00000 -0.31312 -0.35202 0.13572 -0.00046 0.50513 0.07732 -0.14283 -0.00045 -0.27317 0.09022 0.00030 0.10823 -0.49628 -0.00119 0.00031 0.49259 -0.00009 0.02265 0.00097 0.66591 -0.00454 -0.94373 0.58758 -0.70786 0.00390 -0.86376 0.21293 -0.00122 0.83154 0.28322 0.08059 -0.11035 -0.23643 -0.10970 0.03443 0.00002 0.10432 -0.04208 0.00009 0.16916 -0.00908 0.20313 -0.55475 -0.00486 -0.00944 0.00374 0.00705 -0.05000 0.03824 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00001 0.00000 0.00002 0.00003 0.00012 0.00000 -0.00001 -0.01493 -0.00001 0.07482 0.00000 0.17261 0.00004 0.44384 0.00036 0.00009 -0.00167 -0.65936 -0.00013 -0.00054 0.00012 -0.12999 0.00056 -0.00017 -0.30918 0.00216 0.00113 0.00001 0.46881 0.00000 -0.27437 -0.00033 -0.64067 0.00100 1.07731 -0.00520 -0.00024 -0.00598 -1.05608 0.00012 0.00404 0.86601 0.00007 0.00009 -0.00037 0.00012 0.00028 0.00017 -0.00052 0.04345 -0.00010 -0.00029 -0.07057 -0.00019 0.00037 0.00007 0.00105 0.00001 0.00005 -0.00003 -0.00001 0.00014 0.00000 -0.00014 -0.00019 -0.00033 -0.00011 -0.00024 -0.00017 0.06756 -0.04926 0.02921 -0.06888 0.07009 0.03843 -0.11551 -0.16669 0.03730 0.09435 0.11621 -0.03857 0.09261 0.04165 -0.08172 -0.04267 0.07718 -0.02968 -0.00303 0.00095 0.08035 0.05847 -0.06411 0.01052 -0.09032 0.00776 -0.01474 0.01652 -0.04215 -0.00020 -0.01904 0.05921 -0.04820 0.00627 -0.02047 0.06247 0.04985 0.07066 0.02484 -0.05241 -0.02215 0.05484 -0.04967 -0.16254 -0.00527 0.01465 0.13326 -0.11719 -0.12769 0.30657 -0.30079 -0.14966 0.89801 0.18325 0.29670 0.56170 0.01624 0.22147 -0.80635 -0.39166 0.02167 0.00355 0.00456 -0.00093 -0.00434 -0.00098 0.00334 0.00121 0.00069 0.00174 0.00118 0.00039 -0.00921 -0.00869 0.01632 -0.01759 0.04291 0.02741 -0.04375 -0.09668 0.03593 0.07283 0.09390 -0.03643 0.09136 0.04945 -0.10762 -0.11549 0.24226 -0.60545 0.12737 -0.07189 0.66883 0.27985 -1.10698 0.35126 -0.80462 0.13573 0.32914 -1.26857 -0.99717 0.55194 0.26518 0.71444 -0.26061 0.00970 -0.23309 0.96885 0.37829 1.24953 -0.02791 -0.67756 -0.02124 0.90319 -0.35366 -0.60265 1.05658 -0.25580 0.16970 -0.19722 0.83494 -1.13452 1.23753 0.33536 -1.93783 -0.72663 -0.54361 -1.17969 -0.04384 -0.56660 0.43377 0.48956 -0.12454 -0.05424 -0.01153 -0.09808 -0.02478 -0.06971 -0.00014 -0.00019 -0.00033 -0.00011 -0.00024 -0.00017 0.06756 -0.04926 0.02921 -0.06888 0.07009 0.03843 -0.11554 0.16666 0.03730 0.09438 -0.11619 -0.03859 -0.09260 0.04170 0.08168 -0.04272 -0.07715 -0.02968 -0.00302 0.00070 -0.08034 0.05847 -0.06422 0.00990 0.09034 0.00775 -0.01474 -0.01694 -0.04194 -0.00018 -0.01884 -0.05926 -0.04819 -0.00631 -0.02051 -0.06228 0.05008 -0.07040 0.02557 -0.05242 -0.02279 -0.05458 -0.04970 -0.16249 0.00680 0.01467 0.13326 -0.11720 -0.12769 0.30650 -0.30085 -0.14953 -0.89804 0.18298 0.29463 -0.56283 0.01643 0.22143 -0.80640 -0.39166 0.02167 0.00355 0.00456 -0.00093 -0.00434 -0.00098 0.00334 0.00121 0.00069 0.00174 0.00118 0.00039 -0.00922 -0.00872 0.01630 -0.01758 0.04292 0.02746 -0.04375 0.09667 0.03593 0.07285 -0.09388 -0.03645 -0.09135 0.04952 0.10759 -0.11568 -0.24215 -0.60540 0.12746 -0.07399 -0.66833 0.27984 -1.10836 0.34466 0.80597 0.13577 0.32909 1.25958 -1.00868 0.55188 0.26550 -0.71439 -0.26062 -0.00981 -0.23350 -0.96724 0.38203 -1.24969 -0.01483 -0.67751 -0.03046 -0.90272 -0.35421 -0.61155 -1.05097 -0.25657 0.16992 -0.19881 0.83505 -1.13422 1.23777 0.33441 1.93790 -0.72618 -0.53929 1.18213 -0.04447 -0.56632 0.43414 0.48985 -0.12454 -0.05424 -0.01153 -0.09807 -0.02471 -0.06971 -0.00021 -0.00016 -0.00016 -0.00010 -0.00014 -0.00043 0.04036 -0.03738 0.04747 0.10557 -0.04987 -0.02010 0.06040 -0.11428 0.04872 0.14024 -0.19945 -0.01677 -0.06286 0.00241 0.01596 0.00482 -0.00179 -0.01750 -0.01354 -0.00759 0.00482 -0.05026 0.00639 0.04623 -0.12878 0.00656 0.04077 0.06588 0.06590 -0.05706 0.01222 0.06377 0.00912 0.04349 -0.02595 0.03254 -0.03426 0.00885 0.02471 0.05032 -0.02826 -0.02256 -0.01273 -0.14731 -0.06096 -0.06944 0.07892 -0.11658 0.20306 -0.06653 -0.06054 -0.12507 0.55559 -0.02773 0.72230 -0.90232 0.60918 -0.17878 0.31128 0.08708 0.01726 0.01250 0.01545 -0.00211 0.00115 0.00270 -0.00007 0.00053 0.00028 0.00087 0.00060 0.00353 -0.00095 -0.00491 0.00398 0.02777 -0.00975 0.00030 0.03267 -0.06047 0.04066 0.11159 -0.14216 -0.01869 -0.06225 0.01297 0.04160 -0.01665 -0.08700 -0.54394 -0.20041 -0.09412 -0.22165 -0.73827 -0.21919 0.27062 -1.31393 0.40330 1.06309 1.21279 0.59964 -0.30004 -0.07818 0.04849 0.36838 0.13162 0.20277 -0.20431 -0.42565 -0.47904 -0.09976 0.68047 0.02887 -0.41278 0.40708 -0.49588 -0.53071 0.31871 0.33961 -0.23615 -1.27735 0.48273 0.52633 0.34934 -1.12372 0.39563 -0.95898 1.63425 -0.84770 -0.24846 -0.20759 0.11043 -0.05533 -0.05598 -0.12008 0.06792 -0.00297 -0.03400 -0.00021 -0.00016 -0.00016 -0.00010 -0.00014 -0.00043 0.04036 -0.03738 0.04747 0.10557 -0.04987 -0.02009 0.06038 0.11429 0.04873 0.14019 0.19948 -0.01676 0.06287 0.00240 -0.01597 0.00482 0.00179 -0.01750 -0.01354 -0.00760 -0.00483 -0.05026 0.00634 0.04555 0.12906 0.00652 0.04077 -0.06521 0.06651 -0.05704 0.01240 -0.06373 0.00914 -0.04352 -0.02593 -0.03267 -0.03413 -0.00859 0.02481 0.05032 -0.02804 0.02288 -0.01271 -0.14679 0.06239 -0.06940 0.07891 -0.11641 0.20304 -0.06656 -0.06059 -0.12483 -0.55567 -0.02731 0.72572 0.89997 0.60860 -0.17863 0.31135 0.08714 0.01726 0.01250 0.01545 -0.00211 0.00115 0.00270 -0.00007 0.00053 0.00028 0.00087 0.00060 0.00353 -0.00095 -0.00490 0.00400 0.02776 -0.00975 0.00028 0.03265 0.06048 0.04067 0.11156 0.14218 -0.01868 0.06226 0.01295 -0.04160 -0.01659 0.08702 -0.54396 -0.20045 -0.09341 0.22195 -0.73825 -0.21919 0.26469 1.31552 0.40292 1.06308 -1.20706 0.61067 -0.29988 -0.07714 -0.04853 0.36842 -0.13138 0.20293 0.20244 -0.42642 0.47807 -0.10472 0.68045 0.03296 0.41211 0.40733 -0.49128 0.53505 0.31909 0.33952 -0.23555 -1.27738 0.48270 0.52638 0.34927 1.12380 0.39495 -0.96517 -1.63128 -0.84646 -0.24886 -0.20785 0.11015 -0.05533 -0.05598 -0.12009 0.06791 -0.00301 -0.03400 -0.00019 -0.00020 -0.00019 -0.00003 -0.00016 -0.00044 0.03834 -0.03828 0.05258 0.11097 -0.03898 0.01044 -0.09019 -0.00002 0.14054 -0.23097 -0.00002 -0.02470 0.00000 0.03189 -0.00001 -0.03072 0.00001 -0.01805 0.00327 0.01123 0.00002 0.04908 0.01797 -0.09938 -0.00027 0.11416 -0.00644 -0.00019 -0.02257 -0.00006 -0.07406 -0.00007 -0.03389 0.00000 0.02068 0.00016 0.08246 0.00060 0.11755 0.01408 -0.07697 0.00044 -0.06450 -0.14756 0.00061 0.02093 -0.01963 -0.04134 0.18334 -0.03830 0.00492 -0.01947 0.00002 1.31846 0.12437 -0.00064 -0.44212 -0.42380 0.22347 0.13509 0.01787 0.01128 0.01670 -0.00212 0.00107 -0.00158 -0.00031 0.00121 0.00126 0.00003 0.00106 0.00362 -0.00382 -0.00228 0.00357 0.02820 -0.01307 0.00850 -0.04281 -0.00001 0.09871 -0.18130 -0.00002 -0.03968 0.00000 0.06319 -0.00002 -0.12629 0.00007 -0.42322 -0.05314 -0.01407 0.00010 0.03832 1.10857 -1.12508 -0.00282 1.65637 -0.00275 -0.00362 -0.65564 0.27510 -0.22329 -0.00027 0.11032 -0.00004 -0.15206 0.00062 0.25081 0.00502 0.96282 0.23662 -0.43410 0.00252 -0.55695 -0.66541 0.00317 -0.83746 0.29319 -0.37769 -1.22988 0.22464 0.46809 0.23991 -0.00005 -2.26315 -0.17792 0.00115 1.16229 0.46605 0.45269 0.11574 -0.08986 -0.04504 -0.12435 0.07994 0.00811 0.02228 -0.00011 -0.00072 -0.00019 0.00008 0.00003 -0.00007 0.01258 0.04389 0.06261 -0.05299 -0.11773 0.26984 0.05763 0.00000 0.00454 -0.00418 0.00000 0.00009 0.00001 -0.00024 -0.00001 0.00088 -0.00005 -0.00438 0.00248 -0.18175 0.00043 -0.01772 -0.01908 -0.12019 -0.00033 -0.10040 -0.01669 -0.00010 -0.01387 -0.16578 0.02464 0.00007 -0.03563 -0.00002 0.04701 0.00001 0.03392 0.00009 0.01604 -0.02820 -0.11817 0.00066 0.01071 -0.06880 0.00038 0.00493 -0.04313 -0.34809 0.22580 0.26423 -0.05222 0.60569 0.00007 -0.00394 0.01134 -0.00006 0.04673 0.33760 -0.40872 1.27218 0.03122 -0.01337 0.00872 0.00289 0.02282 -0.01570 0.00005 0.00368 0.00021 -0.00307 -0.00012 0.00018 -0.00470 0.00360 0.03176 -0.00909 0.01218 0.15161 0.06486 0.00001 0.01845 -0.01163 -0.00001 -0.00158 0.00002 0.00186 -0.00002 -0.00790 -0.00014 -0.18263 0.02647 -0.73396 0.00208 -0.13618 -0.18441 -0.98967 -0.00275 -0.73324 0.06038 -0.00165 -0.32446 -1.44311 0.64234 0.00106 -0.10808 -0.00001 0.54340 0.00017 0.15196 -0.00080 -0.04661 -0.44827 -2.89027 0.01707 0.55244 1.12115 -0.00695 0.19829 1.94373 0.51425 -0.49905 -0.79488 0.03108 -1.88821 -0.00032 0.47317 -0.74076 0.00163 0.59813 -0.00120 1.48685 -3.32256 -0.06867 0.06079 -0.05216 -0.02269 -0.08725 0.18007 1 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 2 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 3 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 4 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 5 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 6 C 1S 2S 3S 4S 5PX 5PY 5PZ 6PX 6PY 6PZ 7 H 1S 2S 8 H 1S 2S 9 H 1S 2S 10 H 1S 2S 11 H 1S 2S 12 H 1S 2S 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 1 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|2 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|3 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|4 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|5 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|6 C 1S|2S|3S|4S|5PX|5PY|5PZ|6PX|6PY|6PZ|7 H 1S|2S|8 H 1S|2S|9 H 1S|2S|10 H 1S|2S|11 H 1S|2S|12 H 1S|2S 1.17424 0.81432 0.72605 0.64623 0.83790 0.90392 0.94571 0.09360 0.12477 0.20042 1.17427 0.81441 0.72782 0.68117 0.90118 0.86327 0.93420 0.18690 0.13558 0.23297 1.17457 0.81397 0.75782 0.33556 0.95005 0.78419 0.77671 -0.05438 0.18241 0.19089 1.17433 0.81393 0.74365 0.27528 0.94404 0.83581 0.83863 0.06643 0.20252 0.20085 1.17444 0.81401 0.76270 0.19571 0.94976 0.82075 0.81732 -0.02133 0.16439 0.17038 1.17453 0.81414 0.74602 0.55558 0.97362 0.78289 0.78077 0.15211 0.24166 0.24438 0.50638 0.25349 0.50638 0.25349 0.50985 0.26097 0.50985 0.26097 0.51043 0.27004 0.49639 0.22176 Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 C C C C C C H H H H H H -0.467164 -0.651760 0.088223 -0.095470 0.151862 -0.465694 0.240130 0.240134 0.229183 0.229183 0.219527 0.281846 0.00000 -6.27260250e-01 3.57115734e-02 2.08823616e-04 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] -1.5943 0.0908 0.0005 1.5969 -24.4512 -36.4985 -36.7057 -1.9989 0.0021 -0.0001 8.1006 -3.9467 -4.1539 -1.9989 0.0021 -0.0001 43.4995 3.5380 0.0360 0.7748 -2.0737 0.0164 0.4605 1.2879 0.0121 -0.0004 -884.0356 -105.6571 -52.2417 -41.4135 0.0408 -7.7976 0.0160 0.0105 0.0107 -211.7027 -206.5298 -23.4163 0.0010 0.0041 -2.6951 0 -231.7791941 9.516E-9 7.964E-5 6.0225899,-2.9342602,-3.0883297,-1.4861052,0.0015335,-0.0000566 C01 [X(C6H6)] -0.6272603 0.0357116 0.0002088 @ 0.000196300 0.000158026 -0.000008631 -0.000114162 -0.000156872 0.000000766 0.000023387 -0.000033452 -0.000001110 -0.000246298 0.000011394 0.000010217 0.000232440 0.000030204 0.000009465 -0.000047376 -0.000034699 -0.000013472 -0.000029404 -0.000019130 0.000017617 -0.000023698 -0.000020121 -0.000016401 0.000003449 0.000021658 0.000016259 0.000003164 0.000020903 -0.000016574 0.000025156 0.000021584 -0.000000191 -0.000022959 0.000000506 0.000002055 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; Gaussian 09 GINC-KIMIK2019 CBGUSER 000138254 EM64L-G09RevD.01 12-Jul-2017 Gaussian 09 24-Apr-2013 EM64L-G09RevD.01 30 C1[X(C6H6)] RPBEPBE SDD Freq #p freq=noraman PBEPBE/SDD 72.0642 0 1 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; g09 /mnt/data/applications/G09/g09/l1.exe "/scratch/Gau-6757.inp" -scrdir="/scratch/" chk=000138254-Freq.chk nprocshared=4 mem=7GB #p freq=noraman PBEPBE/SDD 1/10=4,30=1,38=1/1,3 2/12=2,17=6,18=5,40=1/2 3/5=17,6=7,11=2,16=1,25=1,30=1,71=2,74=1009,140=1/1,2,3 4//1 5/5=2,38=5,98=1/2 8/6=4,10=90,11=11/1 11/6=1,8=1,9=11,15=111,16=1/1,2,10 10/6=1/2 6/7=2,8=2,9=2,10=2,18=1,28=1/1 7/8=1,10=1,25=1/1,2,3,16 1/10=4,30=1/3 99//99 000138254 1 2 3 4 5 6 7 8 9 10 11 12 12 12 12 12 12 12 1 1 1 1 1 1 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 1 1 1 1 1 1 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 (Enter /mnt/data/applications/G09/g09/l101.exe) Initialization pass. 3.00e-01 1.00e-07 1.00e-07 2 2 Search for a local minimum. |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000245 0.000083 0.001629 0.000609 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -2.086129e-07 Optimization completed. -- Stationary point found. 1 SDD (6D, 10F) 0.10000e-02 0.10000e-05 F 171.8991596591 72 168 72 21 21 IExCor= 1009 DFT=T Ex=PBE Corr=PBE ExCW=0 ScaHFX= 0.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 12 12 12 1.00e+00 60 F 0 0 0 0 0 0 0 0 0 0 0 0 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; 0.000000 1.553660 0.000000 1.470254 2.523051 0.000000 2.711272 3.606930 1.241103 0.000000 4.084737 4.895264 2.614584 1.373483 0.000000 5.324889 6.091133 3.854734 2.613636 1.240154 0.000000 1.108466 2.189719 2.111064 3.250817 4.573752 5.788369 0.000000 1.108465 2.189717 2.111110 3.250879 4.573647 5.788074 1.773518 0.000000 2.202095 1.103410 2.803308 3.699317 4.872181 6.005545 2.550554 3.110399 0.000000 2.202090 1.103410 2.803339 3.699367 4.872078 6.005255 3.110398 2.550543 1.787004 0.000000 2.193503 1.104622 3.465119 4.625069 5.947853 7.159103 2.515500 2.515496 1.791676 1.791674 0.000000 6.399129 7.139573 4.928969 3.687874 2.314394 1.074240 6.847727 6.847384 7.016985 7.016645 8.215563 0.000000 C6H6 C1 1 C1 1 C1 1 0 0 0 0 0 0 0 0 0 0 0 0 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;; 21.4643973 1.2950653 1.2405257 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. 1 Symmetry operations used in ECPInt. ECPInt: NShTT= 1176 NPrTT= 6030 LenC2= 1130 LenP2D= 4328. LDataN: DoStor=T MaxTD1= 2 Len= 12 NBasis= 72 RedAO= T EigKep= 2.17D-03 NBF= 72 NBsUse= 72 1.00D-06 EigRej= -1.00D+00 NBFU= 72 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 0 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 71 71 71 71 71 MxSgAt= 12 MxSgA2= 12. 1 Closed 1 0 1 -231.672799016571 -231.715639317462 -0.042840300891 -231.773307167718 -0.057667850256 -231.771351204795 0.001955962923 -231.777740362105 -0.006389157310 -231.778957018262 -0.001216656158 -231.779145583974 -0.000188565712 -231.779148670905 -0.000003086931 -231.779196016669 -0.000047345764 -231.779196018445 -0.000000001776 -231.779196013710 0.000000004735 -231.779196034202 -0.000000020492 -231.779196035271 -0.000000001069 -231.779196035322 -0.000000000051 -231.779196035345 -0.000000000023 -231.779196035347 -0.000000000002 -231.779196035 16 2.303763751421e+02 -8.808815690469e+02 2.468268382103e+02 Using DIIS extrapolation, IDIIS= 1040. Integral symmetry usage will be decided dynamically. Keep J ints in memory in canonical form, NReq=4384010. IVT= 35110 IEndB= 35110 NGot= 939524096 MDV= 936034481 LenX= 936034481 LenY= 936028856 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. FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 1 NMatS0= 2628 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. Integral accuracy reduced to 1.0D-05 until final iterations. Using compressed storage, NAtomX= 12. Will process 13 centers per pass. Minotr: Closed shell wavefunction. IDoAtm=111111111111 Direct CPHF calculation. Differentiating once with respect to electric field. with respect to dipole field. Differentiating once with respect to nuclear coordinates. Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum. Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum. NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T. MDV= 939523900 using IRadAn= 2. Generate precomputed XC quadrature information. Keep J ints in memory in canonical form, NReq=4352308. FoFCou: FMM=F IPFlag= 0 FMFlag= 0 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 600 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 1 NMatS0= 2628 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. Solving linear equations simultaneously, MaxMat= 0. There are 39 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 36 vectors produced by pass 0 Test12= 2.75D-15 2.56D-09 XBig12= 4.23D+02 1.43D+01. AX will form 36 AO Fock derivatives at one time. 36 vectors produced by pass 1 Test12= 2.75D-15 2.56D-09 XBig12= 2.62D+02 2.88D+00. 36 vectors produced by pass 2 Test12= 2.75D-15 2.56D-09 XBig12= 3.38D+00 4.98D-01. 36 vectors produced by pass 3 Test12= 2.75D-15 2.56D-09 XBig12= 1.12D-03 6.73D-03. 18 vectors produced by pass 4 Test12= 2.75D-15 2.56D-09 XBig12= 2.34D-07 7.84D-05. 2 vectors produced by pass 5 Test12= 2.75D-15 2.56D-09 XBig12= 2.15D-11 9.17D-07. 1 vectors produced by pass 6 Test12= 2.75D-15 2.56D-09 XBig12= 1.06D-15 5.95D-09. InvSVY: IOpt=1 It= 1 EMax= 3.55D-15 Solved reduced A of dimension 165 with 39 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 68.26 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 131.452 -10.704 38.593 -0.006 0.001 34.722 316.414 -42.829 57.032 -0.023 0.004 49.645 (Enter /mnt/data/applications/G09/g09/l716.exe) PT116.100S 2017-07-12T16:50:46.000+02:00 -9.93424 -9.93230 -9.92745 -9.92491 -9.91643 -9.90015 -0.73892 -0.70895 -0.66048 -0.59316 -0.54666 -0.46356 -0.43348 -0.41759 -0.36535 -0.33505 -0.32911 -0.30163 -0.29996 -0.21702 -0.21620 -0.04918 -0.04764 0.07668 0.08914 0.09499 0.10516 0.12393 0.14650 0.15831 0.15981 0.17365 0.17585 0.19872 0.20159 0.23948 0.24708 0.25966 0.26586 0.27305 0.27810 0.31758 0.32026 0.37119 0.37148 0.40537 0.47400 0.47842 0.49388 0.58723 0.59663 0.60989 0.70312 0.76362 0.87157 0.89176 0.94978 0.96048 1.05239 1.07053 1.07798 1.07876 1.09498 1.17732 1.30712 1.32165 22.27182 22.52703 22.57481 22.63187 22.74720 22.82275 1-A. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 C C C C C C H H H H H H -0.467159 -0.651761 0.088221 -0.095472 0.151864 -0.465695 0.240130 0.240133 0.229183 0.229183 0.219527 0.281846 0.00000 Mulliken charges with hydrogens summed into heavy atoms: 1 1 2 3 4 5 6 C C C C C C 0.013103 0.026133 0.088221 -0.095472 0.151864 -0.183849 0.00000 6.26763878e-01 -4.36250213e-02 2.17378472e-04 1.31451621e+02 -1.07044327e+01 3.85932017e+01 -5.95866059e-03 7.60284322e-04 3.47222790e+01 -0.0007 -0.0006 0.0009 4.9396 8.7980 44.8643 99.7890 132.7971 228.5867 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 99.7745 132.7897 228.5474 233.1059 334.8523 453.2124 498.9455 513.7310 616.4030 619.5580 659.3026 778.9083 955.8310 1059.3203 1079.3776 1174.3935 1251.1283 1316.1223 1393.5359 1456.6924 1474.7857 1484.9494 2078.6164 2281.8085 2974.3674 2994.6856 3019.9445 3094.6524 3103.4977 3432.0680 3.7385 2.3671 1.3592 4.6385 3.0969 5.6052 10.5786 8.6987 1.2073 1.2091 3.7381 1.1880 2.3783 1.9656 1.4499 3.3763 1.1459 1.5458 1.1902 1.0788 1.0407 1.0529 6.8626 10.6609 1.0587 1.0351 1.1001 1.1005 1.1015 1.1510 0.0219 0.0246 0.0418 0.1485 0.2046 0.6783 1.5516 1.3526 0.2703 0.2735 0.9574 0.4247 1.2802 1.2996 0.9952 2.7436 1.0568 1.5776 1.3618 1.3488 1.3337 1.3679 17.4697 32.7041 5.5183 5.4691 5.9115 6.2095 6.2510 7.9882 2.7221 5.7166 1.0009 1.6609 1.0294 2.1644 0.2384 0.3613 73.9594 73.3060 1.0865 8.5268 2.0538 11.5723 0.3180 1.7135 0.4009 12.7122 7.7704 8.4227 12.4492 9.5322 5.5201 37.9286 24.2123 39.2420 7.9351 39.1020 32.4621 106.1435 6 6 6 6 6 6 1 1 1 1 1 1 -0.05 0.03 0.00 0.23 -0.16 0.00 -0.02 0.24 0.00 -0.03 0.19 0.00 -0.06 0.01 0.00 -0.10 -0.23 0.00 -0.17 -0.03 0.00 -0.17 -0.03 0.00 0.37 -0.10 0.00 0.37 -0.10 0.00 0.18 -0.40 0.00 -0.14 -0.43 0.00 0.00 0.00 -0.11 0.00 0.00 -0.05 0.00 0.00 0.17 0.00 0.00 0.21 0.00 0.00 0.06 0.00 0.00 -0.19 -0.17 0.16 -0.27 0.17 -0.16 -0.27 -0.27 0.21 0.16 0.27 -0.21 0.16 0.00 0.00 -0.43 0.00 0.00 -0.38 0.00 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 0.04 0.00 0.00 -0.11 0.00 0.00 -0.08 0.00 0.00 0.07 -0.01 -0.05 0.11 0.01 0.05 0.11 -0.43 0.20 0.24 0.43 -0.20 0.24 0.00 0.00 -0.59 0.00 0.00 0.17 0.01 -0.16 0.00 -0.23 -0.02 0.00 0.03 -0.13 0.00 0.11 0.33 0.00 0.11 0.24 0.00 0.03 -0.21 0.00 0.06 -0.13 0.00 0.06 -0.13 0.00 -0.37 -0.07 0.00 -0.37 -0.07 0.00 -0.18 0.23 0.00 -0.02 -0.52 0.00 0.00 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 -0.12 0.00 0.00 -0.21 0.00 0.00 0.10 -0.29 0.23 -0.31 0.29 -0.23 -0.31 0.23 -0.11 -0.15 -0.23 0.11 -0.15 0.00 0.00 0.30 0.00 0.00 0.27 0.05 0.13 0.00 0.21 0.10 0.00 -0.10 -0.36 0.00 -0.09 -0.15 0.00 -0.04 0.38 0.00 -0.13 -0.11 0.00 0.18 0.16 0.02 0.18 0.16 -0.02 0.38 0.15 -0.01 0.38 0.15 0.01 0.15 -0.19 0.00 -0.15 -0.23 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 -0.61 0.00 0.00 0.64 0.00 0.00 -0.22 -0.15 0.10 -0.10 0.15 -0.10 -0.10 0.01 -0.04 -0.04 -0.01 0.04 -0.04 0.00 0.00 0.03 0.00 0.00 -0.19 0.07 0.05 0.00 0.14 0.08 0.00 -0.08 -0.42 0.00 0.04 0.50 0.00 -0.16 -0.41 0.00 -0.08 0.17 0.00 0.21 0.09 0.01 0.21 0.09 -0.01 0.25 0.11 -0.01 0.25 0.11 0.01 0.11 -0.11 0.00 -0.10 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 -0.04 0.00 0.00 -0.02 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.01 -0.03 0.00 0.00 -0.02 0.00 0.02 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.16 -0.98 0.00 0.30 -0.19 0.00 0.06 0.03 0.00 0.10 0.10 0.00 -0.02 -0.02 0.00 -0.19 0.03 0.00 -0.24 0.04 0.00 0.27 -0.17 -0.02 0.27 -0.17 0.02 -0.25 -0.07 0.01 -0.25 -0.07 -0.01 0.17 0.56 0.00 -0.26 0.02 0.00 0.00 0.00 0.11 0.00 0.00 0.03 0.00 0.00 -0.06 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.47 -0.24 0.02 -0.47 -0.24 -0.18 -0.36 -0.17 0.19 0.36 -0.17 0.00 0.00 -0.19 0.00 0.00 0.00 -0.11 -0.16 0.00 0.19 0.15 0.00 -0.11 -0.01 0.00 -0.07 0.01 0.00 0.05 -0.01 0.00 0.09 -0.02 0.00 -0.31 -0.25 -0.01 -0.31 -0.25 0.01 -0.14 0.09 0.03 -0.14 0.09 -0.03 0.29 0.64 0.00 0.10 -0.02 0.00 0.04 0.21 0.00 0.06 -0.18 0.00 -0.04 -0.05 0.00 -0.02 0.01 0.00 0.01 0.00 0.00 0.02 0.00 0.00 -0.13 0.08 0.03 -0.13 0.08 -0.03 -0.43 -0.25 0.08 -0.43 -0.25 -0.08 0.20 0.56 0.00 0.02 -0.01 0.00 0.00 0.00 0.15 0.00 0.00 -0.10 0.00 0.00 -0.08 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 -0.48 0.15 -0.11 0.48 -0.15 -0.11 0.18 0.38 0.12 -0.18 -0.38 0.12 0.00 0.00 0.23 0.00 0.00 0.00 -0.18 0.05 0.00 0.04 0.04 0.00 0.25 -0.08 0.00 0.26 -0.04 0.00 -0.06 0.01 0.00 -0.18 0.03 0.00 -0.57 -0.18 0.03 -0.57 -0.18 -0.03 -0.07 0.03 0.02 -0.07 0.03 -0.02 0.04 0.08 0.00 -0.22 0.03 0.00 0.00 0.00 0.04 0.00 0.00 -0.10 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.32 -0.01 -0.55 -0.32 -0.01 0.09 0.26 0.06 -0.09 -0.26 0.06 0.00 0.00 0.15 0.00 0.00 0.00 0.19 0.06 0.00 -0.07 0.02 0.00 -0.04 -0.02 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 0.03 0.00 0.00 -0.53 -0.38 0.06 -0.53 -0.38 -0.06 0.18 0.04 -0.05 0.18 0.04 0.05 -0.10 -0.13 0.00 0.03 -0.01 0.00 0.02 0.00 0.00 0.07 0.11 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.01 -0.02 -0.04 0.01 0.02 -0.38 -0.38 -0.20 -0.38 -0.38 0.20 -0.09 -0.57 0.00 0.01 0.00 0.00 -0.05 0.06 0.00 0.01 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 -0.46 0.43 0.29 -0.46 -0.43 -0.07 0.04 0.05 -0.07 0.04 -0.05 -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.04 0.00 -0.02 -0.04 0.00 0.49 0.07 -0.06 -0.49 -0.07 -0.06 0.00 0.00 -0.71 0.00 0.00 0.00 0.03 -0.01 0.00 0.04 -0.03 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.03 -0.06 -0.07 0.03 0.06 -0.32 0.42 0.38 -0.32 0.42 -0.38 -0.05 -0.38 0.00 0.00 0.00 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 -0.30 0.05 0.00 0.16 -0.03 0.00 0.51 -0.08 0.00 -0.37 0.06 0.00 0.04 -0.01 0.00 0.04 -0.01 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.00 -0.01 0.00 -0.67 0.11 0.00 0.07 -0.01 0.00 0.01 0.00 0.00 -0.53 0.09 0.00 0.64 -0.11 0.00 -0.37 0.06 0.00 0.15 -0.03 0.00 0.06 -0.01 0.02 0.06 -0.01 -0.02 -0.01 0.00 -0.01 -0.01 0.00 0.01 0.01 -0.02 0.00 0.33 -0.05 0.00 0.03 -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.17 0.36 0.58 -0.17 0.36 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.01 0.02 -0.01 0.01 -0.02 0.13 -0.29 0.45 0.13 -0.29 -0.45 -0.60 0.14 0.00 0.00 0.00 0.00 0.00 0.00 -0.09 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.18 0.39 0.55 0.18 -0.39 0.55 -0.03 0.06 -0.09 0.03 -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.08 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.03 -0.04 0.01 -0.03 0.04 0.08 -0.23 0.37 0.08 -0.23 -0.37 0.76 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 -0.06 -0.09 -0.03 0.06 -0.09 -0.16 0.39 -0.56 0.16 -0.39 -0.56 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.11 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.98 0.16 0.00 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 6 6 6 6 6 6 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 78.04695 84.08068 1393.55224 1454.81968 0.99999 0.00347 0.0 -0.00347 0.99999 -2.0E-5 0.0 2.0E-5 1.0 asymmetric 1 1.03013 0.06215 0.05954 21.46440 1.29507 1.24053 244007.7 143.55 191.05 328.83 335.39 481.78 652.07 717.87 739.14 886.87 891.40 948.59 1120.67 1375.23 1524.12 1552.98 1689.69 1800.09 1893.60 2004.98 2095.85 2121.89 2136.51 2990.66 3283.01 4279.45 4308.68 4345.02 4452.51 4465.24 4937.97 0.092938 0.099968 0.100913 0.062487 -231.686258 -231.679228 -231.678283 -231.716709 62.731 24.383 80.873 0.000 0.000 0.000 0.889 2.981 38.979 0.889 2.981 26.636 60.954 18.421 15.258 1 0.604 1.949 3.459 2 0.613 1.921 2.905 3 0.651 1.797 1.890 4 0.654 1.790 1.855 5 0.716 1.606 1.237 6 0.812 1.354 0.786 7 0.854 1.252 0.661 8 0.869 1.220 0.625 9 0.976 0.997 0.422 10 0.980 0.991 0.417 0.181079e-28 -28.742131 -66.181203 0.101420e+15 14.006123 32.250290 0.452084e-41 -41.344781 -95.199877 1 0.205701e+01 0.313236 0.721251 2 0.153417e+01 0.185872 0.427987 3 0.862330e+00 -0.064327 -0.148117 4 0.843776e+00 -0.073773 -0.169868 5 0.556323e+00 -0.254673 -0.586407 6 0.377394e+00 -0.423205 -0.974467 7 0.329709e+00 -0.481869 -1.109545 8 0.316001e+00 -0.500311 -1.152008 9 0.238149e+00 -0.623152 -1.434860 10 0.236151e+00 -0.626811 -1.443286 0.253206e+02 1.403473 3.231617 1 0.261690e+01 0.417787 0.961991 2 0.211359e+01 0.325020 0.748387 3 0.149680e+01 0.175164 0.403330 4 0.148079e+01 0.170495 0.392579 5 0.124799e+01 0.096212 0.221537 6 0.112644e+01 0.051708 0.119061 7 0.109892e+01 0.040967 0.094330 8 0.109149e+01 0.038019 0.087541 9 0.105382e+01 0.022766 0.052420 10 0.105296e+01 0.022413 0.051607 0.100000e+01 0.000000 0.000000 0.271012e+08 7.432989 17.115090 0.147795e+06 5.169661 11.903584 000138254 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 1.5931 -0.1109 0.0006 1.5969 -25.2096 -36.4398 -36.7057 -2.1713 -0.0008 0.0000 7.5754 -3.6548 -3.9207 -2.1713 -0.0008 0.0000 -26.8877 -0.3793 0.0015 7.3203 4.2700 0.0082 7.6565 -0.2320 0.0006 -0.0010 -854.8589 -105.2096 -52.2417 -39.5174 -0.0347 -0.9751 0.0013 0.0017 -0.0026 -212.4336 -208.1595 -23.3341 0.0035 -0.0003 -0.3180 (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) 0 1-A -231.779196 2.184E-9 8.331E-5 0.0929376 0.0999685 C01 [X(C6H6)] -0.6272646 0.0357102 0.0002085 0.0690547 -0.0206129 0.0000127 -0.0557258 0.082998 0.0000276 -0.0000144 0.0000302 0.1586879 -0.002472 -0.0261454 0.0000114 0.1415327 0.0280482 0.0000147 -0.000025 0.0000181 0.0824008 0.3361694 -0.0546609 -0.0000821 -0.1343081 -0.1273532 0.0000374 -0.0001226 0.0000348 -0.0973123 -0.3532098 -0.0043484 0.0000592 0.0577324 -0.0787794 -0.0000211 0.0003445 -0.0000433 -0.0765664 0.5245026 -0.0617824 0.0000622 -0.0760514 0.0615211 -0.0000069 -0.0000387 0.0000038 0.0463661 -0.6953826 0.0384442 0.0000014 0.0598209 -0.327993 0.0000029 -0.0002809 0.0000385 -0.3224453 -0.0528703 0.0303982 -0.0385092 0.0115615 0.0195595 0.0948255 -0.0571804 0.1206593 -0.0188257 -0.0528223 0.0303832 0.0384702 0.0115581 0.0194367 -0.0948515 0.0571898 -0.1206911 -0.0187179 0.105593 0.0232081 0.0620215 -0.0103311 0.0021491 -0.0929012 0.0186601 -0.1180707 -0.0632843 0.105565 0.0232069 -0.0620784 -0.0103228 0.0022738 0.0928645 -0.0187038 0.1180237 -0.0633877 -0.2474638 0.0185341 0.0000372 0.0053119 0.0555279 0.0000093 0.0000564 0.0000128 0.1087814 0.2633361 0.0033752 -0.0000062 -0.0007783 0.2626112 -0.0000011 0.000115 -0.0000162 0.2643035 131.7070414|-9.5289882|38.3377796|0.0094341|-0.0024205|34.7222803 0.47812811 -0.04321107 0.45852610 0.00001316 0.00003221 0.53187442 -0.08988132 -0.04799552 0.00001753 0.52198656 -0.03986435 -0.15203638 0.00002955 -0.05341379 0.47431904 0.00001472 0.00003093 -0.07175726 0.00001976 0.00003397 0.55549513 -0.26678383 0.03526544 0.00002298 -0.03086432 -0.00715233 0.00000700 1.26032529 0.03500659 -0.06065091 -0.00000466 -0.02690836 0.00578751 0.00000257 -0.17903780 0.11146557 0.00002809 -0.00000554 -0.05963926 0.00001366 0.00000021 0.00022630 -0.00014561 0.00001917 0.08059838 -0.00499232 0.00248545 0.00000625 0.00274166 0.00565125 -0.00000179 -0.89290986 0.13275499 0.00011701 1.34777096 0.00109840 0.00236480 -0.00000288 -0.00038086 -0.00167851 0.00000121 0.13431565 -0.04867504 -0.00001743 -0.20005330 0.08834705 0.00000017 -0.00000200 0.00324753 -0.00000046 -0.00000058 0.00018562 0.00010455 -0.00001551 -0.02862915 -0.00003321 0.00000537 0.05733550 0.00837224 -0.00020824 -0.00000063 -0.00089817 -0.00196684 0.00000071 -0.06211305 0.01000756 -0.00000531 -0.39505975 0.05448204 -0.00005006 1.35189985 -0.00063863 0.00578659 0.00000128 0.00154173 -0.00013584 -0.00000053 0.01003913 -0.00122019 0.00000038 0.05436310 -0.04979699 0.00000786 -0.19748094 0.09317948 0.00000131 0.00000109 0.00587003 -0.00000045 -0.00000024 0.00013047 -0.00000343 0.00000021 0.00042533 -0.00006964 0.00001069 -0.04127736 0.00043879 -0.00006710 0.06288506 -0.00253723 0.00013991 0.00000008 0.00010706 0.00138620 -0.00000045 0.02872297 -0.00445287 -0.00000269 -0.05929023 0.00988945 -0.00002028 -0.91100553 0.13481534 -0.00037661 1.35004926 0.00038280 0.00010646 0.00000024 -0.00002657 -0.00017260 -0.00000010 -0.00424229 0.00186496 0.00000024 0.00986529 0.00251688 0.00000317 0.13467328 -0.04812599 0.00005745 -0.19938129 0.06982435 -0.00000102 0.00000034 0.00017857 0.00000005 0.00000040 -0.00005725 0.00001302 -0.00000230 0.00119688 -0.00002050 0.00000334 0.00406526 -0.00036902 0.00005629 -0.02745007 0.00047937 -0.00007296 0.03912546 -0.05576739 0.03591612 -0.05153196 0.00334540 -0.01159387 0.01373533 -0.01962385 0.01834600 -0.02632342 0.00093060 -0.00024002 0.00048931 -0.00079432 -0.00054491 0.00116853 -0.00025569 0.00002726 0.00002011 0.07041949 0.03375506 -0.11111945 0.10729920 0.00474138 -0.01722542 0.02256302 0.00456024 -0.00292652 0.00327953 -0.00148518 0.00046282 0.00028416 0.00078239 0.00007946 -0.00003047 -0.00026106 0.00000743 -0.00002564 -0.03601438 0.12522232 -0.04877100 0.10720746 -0.20583933 -0.00096435 -0.00256540 0.00060193 -0.00126484 -0.00146952 0.00217185 0.00224629 -0.00012181 -0.00013700 -0.00079784 0.00036353 -0.00010476 0.00026549 -0.00009098 -0.00001957 0.05572062 -0.11740861 0.22301041 -0.05573736 0.03591411 0.05146503 0.00334111 -0.01160101 -0.01372903 -0.01961012 0.01835971 0.02631755 0.00092746 -0.00023891 -0.00048780 -0.00079423 -0.00054604 -0.00116861 -0.00025593 0.00002704 -0.00002035 0.00246706 -0.00394021 -0.00711520 0.07038331 0.03375216 -0.11124884 -0.10736827 0.00473445 -0.01723731 -0.02255378 0.00455810 -0.00292696 -0.00327746 -0.00148651 0.00046237 -0.00028311 0.00078261 0.00007943 0.00002984 -0.00026106 0.00000746 0.00002537 -0.00393113 0.00734877 0.01468054 -0.03601019 0.12536351 0.04870580 -0.10727702 -0.20574423 0.00096061 0.00257946 0.00061766 0.00126787 0.00146760 0.00216485 -0.00224574 0.00012210 -0.00013643 0.00079717 -0.00036383 -0.00010390 -0.00026492 0.00009088 -0.00001982 0.00710977 -0.01469650 -0.02161930 -0.05565203 0.11747916 0.22290653 0.00134629 -0.01193029 -0.01428828 -0.05810625 0.03339363 0.04882259 0.00166258 -0.00053664 -0.00093755 -0.00029093 0.00030801 0.00014140 -0.00009595 -0.00004157 0.00002979 0.00014799 0.00000424 0.00001267 0.00032082 0.00097426 0.00009660 -0.00144130 -0.00323691 0.00001935 0.06168310 0.00470711 -0.01662222 -0.02246718 0.03199381 -0.11865920 -0.11392379 0.00193202 0.00089728 0.00012896 -0.00077936 0.00022872 0.00005025 0.00011816 -0.00009446 0.00000231 -0.00007849 0.00000479 0.00001585 0.00080045 0.00052353 -0.00001295 -0.00323884 -0.00363728 0.00082410 -0.03202579 0.13220864 0.00129586 0.00346094 0.00133763 0.04738415 -0.11535081 -0.22014056 -0.00002696 0.00005026 0.00025376 -0.00036265 0.00012172 -0.00001158 0.00003475 -0.00002863 -0.00001692 -0.00006490 0.00005256 -0.00000070 -0.00032089 -0.00028591 0.00074000 0.00034636 0.00097807 0.00126710 -0.05271857 0.12507918 0.23622491 0.00135024 -0.01192291 0.01429558 -0.05813543 0.03339877 -0.04889106 0.00166315 -0.00053610 0.00093720 -0.00029101 0.00030799 -0.00014167 -0.00009597 -0.00004160 -0.00002977 0.00014799 0.00000419 -0.00001246 -0.00144153 -0.00323717 -0.00001655 0.00032101 0.00097439 -0.00009699 0.00109749 -0.00355230 0.00722983 0.06171505 0.00471283 -0.01661131 0.02247688 0.03199964 -0.11851900 0.11385199 0.00193214 0.00089714 -0.00013022 -0.00077919 0.00022851 -0.00004998 0.00011817 -0.00009438 -0.00000228 -0.00007849 0.00000482 -0.00001588 -0.00323929 -0.00363838 -0.00082021 0.00080061 0.00052375 0.00001288 -0.00356137 0.00852855 -0.01552543 -0.03203157 0.13205643 -0.00129863 -0.00344643 0.00132230 -0.04745197 0.11527879 -0.22024974 0.00002535 -0.00005052 0.00025353 0.00036312 -0.00012194 -0.00001164 -0.00003487 0.00002872 -0.00001693 0.00006500 -0.00005256 -0.00000057 -0.00034362 -0.00097424 0.00126835 0.00032056 0.00028574 0.00073980 -0.00723400 0.01550935 -0.01970834 0.05279025 -0.12500600 0.23634387 -0.01368196 0.00562963 0.00000046 -0.29367493 0.05187860 0.00002209 -0.00071850 -0.00308090 0.00000110 0.00026605 -0.00020832 0.00000011 0.00008686 0.00017056 -0.00000004 -0.00034214 0.00004835 -0.00000011 0.00033369 0.00011309 0.00061816 0.00033329 0.00011260 -0.00061828 -0.00629798 0.00011519 -0.00280315 -0.00630514 0.00011852 0.00280497 0.31993359 -0.02959441 0.00183783 0.00000403 0.05379987 -0.05448800 -0.00000560 -0.00218109 -0.00495484 0.00000196 -0.00127117 0.00051911 0.00000009 0.00022298 0.00026414 -0.00000001 -0.00027916 0.00006096 -0.00000008 0.00043650 0.00129301 0.00025171 0.00043620 0.00129268 -0.00025273 0.01665371 -0.00338680 0.00146643 0.01663755 -0.00338456 -0.00146928 -0.05488903 0.06097674 0.00001111 -0.00000141 -0.00051782 0.00002154 -0.00000528 -0.04502215 0.00000098 0.00000221 0.00058973 0.00000030 -0.00000018 0.00019395 -0.00000003 -0.00000007 -0.00006046 0.00000014 0.00000005 0.00001709 0.00035664 0.00001320 -0.00007918 -0.00035704 -0.00001415 -0.00007877 0.02606820 -0.00519354 0.00005217 -0.02607650 0.00519570 0.00005691 -0.00002532 0.00000348 0.04484834 0.00018452 -0.00008263 -0.00000018 0.00003863 -0.00011626 0.00000012 0.00024954 0.00007782 -0.00000002 0.00019736 0.00071987 -0.00000208 0.01049802 -0.00163618 0.00001016 -0.40548850 0.05861768 -0.00010174 0.00006571 0.00001156 -0.00001738 0.00006570 0.00001149 0.00001739 -0.00002587 0.00000802 0.00000616 -0.00002587 0.00000801 -0.00000616 0.00006717 0.00002805 -0.00000003 0.39417361 -0.00010647 -0.00033268 -0.00000039 -0.00008580 0.00004570 0.00000011 0.00001080 0.00044199 0.00000021 0.00073463 0.00502028 0.00000029 -0.00153118 0.00007876 -0.00000151 0.05856150 -0.02609953 0.00001527 0.00003724 -0.00002755 -0.00001377 0.00003753 -0.00002759 0.00001389 -0.00000129 0.00000843 -0.00001838 -0.00000125 0.00000843 0.00001837 -0.00000830 -0.00003026 -0.00000002 -0.05764741 0.02091402 0.00000042 -0.00000058 -0.00033258 -0.00000007 -0.00000007 -0.00003017 -0.00000091 0.00000048 0.00038780 0.00000057 -0.00000018 0.00517530 -0.00001367 0.00000209 -0.00028050 -0.00008022 0.00001202 -0.01703526 -0.00008043 -0.00001774 0.00000660 0.00008057 0.00001804 0.00000652 -0.00001219 -0.00001253 0.00000252 0.00001214 0.00001254 0.00000246 0.00000002 0. 0.00000018 0.00009376 -0.00001408 0.01209714 -0.00020108 -0.00017873 0.00000887 0.00012441 0.00018162 -0.00000140 -0.00002338 0.00003402 0.00000109 0.00024538 -0.00001273 -0.00001018 -0.00023242 -0.00002937 -0.00000952 0.00004801 0.00003491 0.00001349 0.00003335 0.00002576 -0.00001828 0.00002719 0.00002631 0.00001737 -0.00000894 -0.00002844 -0.00001850 -0.00000905 -0.00002830 0.00001896 -0.00002570 -0.00002402 0.00000015 0.00002223 -0.00000102 -0.00000206 0.000201078 0.000178728 -0.000008865 -0.000124406 -0.000181620 0.000001400 0.000023380 -0.000034021 -0.000001085 -0.000245379 0.000012731 0.000010178 0.000232421 0.000029372 0.000009517 -0.000048008 -0.000034910 -0.000013493 -0.000033353 -0.000025757 0.000018281 -0.000027193 -0.000026306 -0.000017372 0.000008941 0.000028441 0.000018497 0.000009049 0.000028302 -0.000018964 0.000025704 0.000024020 -0.000000153 -0.000022234 0.000001019 0.000002059 72.0642 AuxInfo=1/0/N:6,2,5,1,4,3/CRV:1.2,3.2,5.2,6.2/rA:12CCC2C2C2C2HHHHHH/rB:s1;s1;s3;s4;s5;s1;s1;s2;s2;s2;s6;/rC:;;;;;;;;;;;;