Gaussian 09 GINC-KIMIK2210 EGARCIAP Opt freq EM64L-G09RevD.01 23-May-2024 Gaussian 09 24-Apr-2013 EM64L-G09RevD.01 35 35 (6D, 7F) 6-31G(d) UB3LYP 6-31G(d) FOpt #p b3lyp opt freq=noraman 6-31G(d) scrf=(solvent=ethanol,pcm) nosymm empiricaldispersion=gd3 scf=maxcyc=512 240.21399999999988 0 2 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0019,-.0019,-.0958;-.036,-1.1621,-.9608;-.0244,-.7267,-2.3232;-.1458,-2.5316,-.6676;-.0805,-1.6315,-3.3662;-.1968,-3.4491,-1.7119;-.2064,-2.8811,.3564;-.1564,-2.9929,-3.0364;-.0746,-1.323,-4.4043;-.2759,-4.5108,-1.5174;-.003,-.0052,1.3547;-.7401,.9538,2.0864;.7303,-.9684,2.0834;-.7448,.9403,3.4752;-1.351,1.6774,1.5566;.7301,-.9625,3.473;1.3376,-1.6938,1.5521;-.0059,-.0115,4.1973;-1.3383,1.6753,4.0129;1.316,-1.705,4.0086;.0348,1.1631,-.9545;.1412,2.5312,-.6538;.029,.7349,-2.3191;.1954,3.4542,-1.6931;.1964,2.8759,.3723;.0885,1.6451,-3.3572;.1613,3.0049,-3.0202;.0869,1.3419,-4.3968;.2718,4.5149,-1.4928;.016,.0076,5.7046;.7732,.7133,6.0715;-.9483,.3262,6.1143;.2595,-.9771,6.1155;.2038,3.726,-3.8096;-.1969,-3.71,-3.8295; g09 /mnt/data/applications/G09/g09/l1.exe "/scratch/Gau-195835.inp" -scrdir="/scratch/" nprocshared=24 mem=41GB #p b3lyp opt freq=noraman 6-31G(d) scrf=(solvent=ethanol,pcm) nosymm e 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=1,6=6,7=1,11=2,16=1,25=1,30=1,70=2201,71=1,72=4,74=-5,124=31/1,2,3 4//1 5/5=2,7=512,38=5,53=4/2 6/7=2,8=2,9=2,10=2,28=1/1 7/30=1/1,2,3,16 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=1,6=6,7=1,11=2,16=1,25=1,30=1,70=2205,71=1,72=4,74=-5,124=31/1,2,3 4/5=5,16=3,69=1/1 5/5=2,7=512,38=5,53=4/2 7/30=1/1,2,3,16 1/14=-1,18=20,19=15,26=3/3(-5) 2/9=110,15=1/2 6/7=2,8=2,9=2,10=2,19=2,28=1/1 99/9=1/99 Opt freq 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 12 12 12 12 12 12 1 12 1 1 12 12 12 12 1 12 1 12 1 1 12 12 12 12 1 12 12 1 1 12 1 1 1 1 1 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 1.0078250 12.0000000 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 12.0000000 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 1 0 1 1 0 0 0 0 1 0 1 0 1 1 0 0 0 0 1 0 0 1 1 0 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 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 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) Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 1 1 1 2 2 3 3 4 4 5 5 6 6 8 11 11 12 12 13 13 14 14 16 16 18 21 21 22 22 23 24 24 26 26 27 30 30 30 2 11 21 3 4 5 23 6 7 8 9 8 10 35 12 13 14 15 16 17 18 19 18 20 30 22 23 24 25 26 27 29 27 28 34 31 32 33 1.4477 1.4505 1.4477 1.4303 1.4048 1.382 1.4626 1.391 1.0838 1.4028 1.083 1.4015 1.0822 1.07 1.4136 1.413 1.3889 1.0851 1.3897 1.085 1.4047 1.087 1.4038 1.0869 1.5076 1.4048 1.4302 1.391 1.0838 1.3819 1.4015 1.0822 1.4028 1.0829 1.07 1.0982 1.095 1.0945 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|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|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|estimate D2E/DX2|estimate D2E/DX2 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 2 2 11 1 1 3 2 2 5 2 2 6 3 3 8 4 4 8 5 5 6 1 1 12 11 11 14 11 11 16 12 12 18 13 13 18 14 14 16 1 1 22 21 21 24 3 3 21 22 22 27 23 23 27 24 24 26 18 18 18 31 31 32 1 1 1 2 2 2 3 3 3 4 4 4 5 5 5 6 6 6 8 8 8 11 11 11 12 12 12 13 13 13 14 14 14 16 16 16 18 18 18 21 21 21 22 22 22 23 23 23 24 24 24 26 26 26 27 27 27 30 30 30 30 30 30 11 21 21 3 4 4 5 23 23 6 7 7 8 9 9 8 10 10 6 35 35 12 13 13 14 15 15 16 17 17 18 19 19 18 20 20 16 30 30 22 23 23 24 25 25 21 26 26 27 29 29 27 28 28 26 34 34 31 32 33 32 33 33 126.5617 106.9245 126.5137 108.9639 131.1815 119.7506 121.2837 107.5697 131.1379 119.2868 121.0666 119.6399 117.3941 122.4609 120.1436 119.5869 120.9903 119.4207 122.661 118.5679 118.7669 121.0955 121.1218 117.7827 120.8461 119.5518 119.5253 120.8457 119.588 119.5066 121.2555 119.332 119.4105 121.2582 119.3249 119.4158 118.005 120.8638 121.12 131.1963 108.9601 119.7421 119.2893 121.0766 119.6279 107.5785 131.1252 121.2886 119.5926 120.9842 119.4213 117.4028 122.4542 120.1418 122.6488 118.7868 118.5606 110.6175 111.4048 111.5419 107.1757 107.4155 108.4972 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|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|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|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|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|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 11 11 21 21 2 2 21 21 2 2 11 11 1 1 4 4 1 1 3 3 2 2 23 23 2 2 5 5 2 2 7 7 3 3 9 9 4 4 10 10 1 1 13 13 1 1 12 12 11 11 15 15 11 11 17 17 12 12 19 19 13 13 20 20 14 14 14 16 16 16 1 1 23 23 1 1 22 22 21 21 25 25 3 3 21 21 22 22 29 29 23 23 28 28 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 4 4 4 4 5 5 5 5 6 6 6 6 11 11 11 11 11 11 11 11 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 21 21 21 21 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 26 2 2 2 2 11 11 11 11 21 21 21 21 3 3 3 3 4 4 4 4 5 5 5 5 23 23 23 23 6 6 6 6 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 30 30 30 30 30 30 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 26 27 27 27 27 27 27 27 27 3 4 3 4 12 13 12 13 22 23 22 23 5 23 5 23 6 7 6 7 8 9 8 9 21 26 21 26 8 10 8 10 6 35 6 35 5 35 5 35 14 15 14 15 16 17 16 17 18 19 18 19 18 20 18 20 16 30 16 30 14 30 14 30 31 32 33 31 32 33 24 25 24 25 3 26 3 26 27 29 27 29 27 28 27 28 26 34 26 34 24 34 24 34 179.8999 3.7117 -0.1453 -176.3335 -140.8034 39.0683 39.2504 -140.8779 -176.4651 -0.2316 3.4897 179.7232 -178.5819 0.4564 -1.8857 177.1526 177.9753 -1.0812 2.1281 -176.9284 0.3238 179.8879 -178.4587 1.1053 -0.5948 178.3824 178.3139 -2.7089 -0.8628 179.6702 178.2074 -1.2596 0.9925 -179.7668 -178.5821 0.6586 -0.7335 -179.9728 178.7419 -0.4973 179.5629 2.7645 -0.313 -177.1114 179.7028 2.5272 -0.4214 -177.5969 0.8657 -178.6117 177.6649 -1.8125 0.6232 -178.9998 177.801 -1.822 -0.6606 178.1397 178.8165 -2.3833 -0.0809 -178.8779 179.5418 0.7448 -84.1699 34.9318 156.3375 94.5927 -146.3056 -24.8999 177.9995 -1.0928 2.1027 -176.9897 0.5103 -178.5881 177.2468 -1.8516 -0.8622 179.6522 178.2435 -1.2421 -178.5517 1.0378 0.3073 179.8968 -0.7162 -179.9907 178.7775 -0.497 0.9835 -179.7405 -178.6159 0.6601 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|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|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|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|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|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|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|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 3.00e-01 1.00e-07 1.00e-06 205 210 0.10000e-02 0.10000e-05 F 35 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 0 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=131 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. NBasis= 330 RedAO= T EigKep= 3.24D-04 NBF= 330 NBsUse= 330 1.00D-06 EigRej= -1.00D+00 NBFU= 330 Berny optimization. local minimum Step number 5 out of a maximum of 205 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00658 0.01448 0.01470 0.01586 0.01612 0.01655 0.01773 0.01800 0.01811 0.01841 0.01926 0.01950 0.02057 0.02060 0.02061 0.02082 0.02091 0.02099 0.02111 0.02114 0.02114 0.02143 0.02146 0.02148 0.02151 0.02162 0.02163 0.02208 0.02209 0.02957 0.07052 0.07188 0.12876 0.15966 0.15988 0.15998 0.15999 0.15999 0.15999 0.16000 0.16000 0.16000 0.16000 0.16000 0.16000 0.16034 0.16332 0.21410 0.21999 0.22001 0.22559 0.22592 0.23039 0.24114 0.24448 0.24953 0.24973 0.24992 0.24994 0.25000 0.26321 0.31658 0.33883 0.34240 0.34300 0.34657 0.34997 0.35160 0.35170 0.35391 0.35467 0.35501 0.35541 0.35641 0.35687 0.35725 0.35832 0.36887 0.37230 0.37816 0.38230 0.38709 0.39747 0.41281 0.41404 0.41855 0.43065 0.43871 0.43978 0.44211 0.44600 0.45001 0.45391 0.45931 0.46156 0.46194 0.47611 0.48188 0.51756 -1.39951102e-08 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 2.73968 2.74944 2.73972 2.70180 2.65327 2.62585 2.76465 2.63983 2.05079 2.65059 2.05423 2.65017 2.05315 2.05299 2.66969 2.66824 2.62802 2.05098 2.62955 2.05091 2.65258 2.05527 2.65093 2.05509 2.85187 2.65325 2.70172 2.63984 2.05083 2.62586 2.65017 2.05315 2.65059 2.05422 2.05299 2.07549 2.06992 2.06894 2.20849 1.86737 2.20733 1.89955 2.29571 2.08636 2.10845 1.87912 2.29549 2.07964 2.10781 2.09563 2.07636 2.10690 2.09990 2.10990 2.08570 2.08756 2.10516 2.08834 2.08962 2.11659 2.11741 2.04918 2.11323 2.08326 2.08577 2.11314 2.08389 2.08549 2.11731 2.08226 2.08357 2.11744 2.08215 2.08357 2.05602 2.11137 2.11561 2.29564 1.89959 2.08640 2.07962 2.10782 2.09564 1.87910 2.29553 2.10844 2.10989 2.08570 2.08756 2.07636 2.10690 2.09990 2.10515 2.08963 2.08834 1.93562 1.94491 1.94640 1.86967 1.87346 1.89047 3.13927 0.05975 -0.00281 -3.08233 -2.45630 0.68247 0.68587 -2.45854 -3.08309 -0.00340 0.05802 3.13771 -3.11842 0.00779 -0.03023 3.09598 3.10720 -0.01870 0.03315 -3.09275 0.00646 3.14045 -3.11555 0.01843 -0.00983 3.11438 3.11411 -0.04486 -0.01324 3.13619 3.11277 -0.02098 0.01395 -3.13975 -3.12007 0.00941 -0.01072 -3.14019 3.12303 -0.00644 3.13663 0.04151 -0.00226 -3.09737 3.13975 0.03735 -0.00455 -3.10695 0.00896 -3.12271 3.10401 -0.02766 0.00487 -3.12969 3.10723 -0.02733 -0.00854 3.11216 3.12312 -0.03937 0.00168 -3.11896 3.13624 0.01560 -1.46714 0.61408 2.72905 1.65284 -2.54912 -0.43415 3.10723 -0.01895 0.03299 -3.09319 0.00815 -3.11829 3.09649 -0.02996 -0.01330 3.13611 3.11299 -0.02078 -3.11602 0.01807 0.00630 3.14039 -0.01055 -3.14013 3.12322 -0.00636 0.01389 -3.13971 -3.12023 0.00936 0.00000 -0.00002 0.00000 0.00001 -0.00001 0.00002 0.00000 0.00002 0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 0.00002 0.00001 0.00002 0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00001 -0.00001 0.00002 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00002 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00002 -0.00001 -0.00001 0.00001 0.00001 -0.00002 0.00000 -0.00001 0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 0.00000 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 0.00000 0.00003 0.00002 0.00003 0.00000 0.00000 -0.00002 0.00000 -0.00002 -0.00002 0.00000 0.00000 0.00001 -0.00001 0.00001 -0.00001 0.00000 0.00000 0.00000 0.00000 0.00001 0.00000 0.00001 0.00003 0.00000 0.00003 0.00000 -0.00002 0.00000 -0.00002 -0.00002 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00001 0.00001 -0.00002 0.00002 -0.00001 -0.00001 0.00002 -0.00001 -0.00001 -0.00002 0.00004 -0.00003 -0.00002 0.00005 -0.00003 0.00002 -0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00001 0.00001 -0.00002 0.00001 0.00001 -0.00002 -0.00001 0.00000 0.00001 0.00001 0.00001 -0.00002 0.00002 -0.00001 -0.00001 -0.00001 -0.00001 0.00002 -0.00002 0.00005 -0.00003 -0.00002 0.00004 -0.00003 0.00002 -0.00001 -0.00001 0.00000 0.00000 0.00001 -0.00001 0.00000 0.00000 0.00000 0.00001 -0.00001 0.00001 -0.00004 -0.00004 -0.00004 -0.00004 0.00001 0.00000 0.00001 0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00001 0.00001 0.00001 0.00000 0.00000 -0.00001 -0.00001 0.00000 0.00000 0.00001 -0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00000 0.00000 0.00001 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00000 0.00001 0.00001 -0.00001 0.00001 -0.00001 0.00000 0.00002 -0.00001 0.00001 0.00005 0.00004 0.00005 0.00003 0.00002 0.00003 0.00000 0.00000 0.00001 0.00001 0.00001 0.00000 0.00000 -0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00000 0.00001 -0.00001 -0.00005 -0.00001 0.00001 -0.00002 0.00001 -0.00001 0.00001 0.00002 -0.00001 -0.00001 0.00000 -0.00002 0.00004 0.00003 0.00002 -0.00004 -0.00001 -0.00003 -0.00001 0.00001 0.00001 0.00000 0.00001 -0.00004 -0.00002 0.00000 0.00001 0.00002 0.00001 0.00001 -0.00002 -0.00001 -0.00001 0.00004 0.00000 0.00001 0.00000 -0.00002 0.00004 -0.00003 -0.00004 0.00007 -0.00003 0.00002 0.00001 -0.00004 0.00004 0.00006 -0.00010 -0.00002 -0.00001 0.00002 -0.00003 0.00001 0.00002 0.00002 -0.00001 -0.00001 -0.00001 0.00001 0.00001 -0.00001 0.00003 -0.00002 -0.00001 0.00003 -0.00003 -0.00001 -0.00001 0.00002 -0.00001 0.00000 0.00002 0.00003 -0.00003 0.00000 0.00006 -0.00003 -0.00002 0.00004 0.00006 -0.00009 0.00001 -0.00003 0.00002 -0.00003 0.00001 0.00002 -0.00002 0.00000 0.00002 0.00002 -0.00001 -0.00001 -0.00002 -0.00001 -0.00001 0.00000 0.00003 0.00002 0.00002 0.00004 0.00006 0.00008 -0.00016 -0.00017 -0.00021 -0.00022 0.00004 -0.00001 0.00008 0.00003 -0.00005 -0.00008 -0.00007 -0.00009 0.00004 0.00004 0.00006 0.00007 0.00001 -0.00002 0.00005 0.00002 0.00007 0.00005 0.00004 0.00002 -0.00001 -0.00003 -0.00001 -0.00003 0.00004 0.00000 0.00008 0.00003 -0.00005 0.00000 -0.00003 0.00002 0.00000 0.00007 0.00001 0.00008 -0.00002 0.00009 -0.00003 0.00008 0.00002 0.00003 -0.00005 -0.00004 0.00001 0.00002 -0.00010 -0.00009 -0.00004 0.00005 -0.00005 0.00004 0.00003 -0.00006 0.00002 -0.00007 0.00064 0.00062 0.00062 0.00073 0.00071 0.00071 0.00000 0.00001 0.00005 0.00006 -0.00004 -0.00002 -0.00008 -0.00005 0.00000 -0.00001 -0.00001 -0.00003 0.00004 0.00002 0.00001 -0.00001 -0.00004 -0.00001 -0.00003 0.00001 0.00004 0.00000 0.00006 0.00002 -0.00001 -0.00005 -0.00001 0.00002 -0.00002 0.00004 0.00000 0.00004 0.00002 -0.00001 -0.00003 0.00001 -0.00003 0.00002 0.00003 0.00002 -0.00002 -0.00001 -0.00001 -0.00001 0.00001 0.00001 0.00000 0.00000 -0.00003 -0.00002 0.00001 0.00004 0.00002 0.00004 0.00001 -0.00003 -0.00001 -0.00003 0.00002 0.00000 0.00000 -0.00001 -0.00001 0.00004 -0.00002 -0.00003 0.00008 -0.00005 0.00004 0.00001 -0.00004 0.00006 0.00005 -0.00011 -0.00003 0.00004 0.00000 -0.00005 0.00006 -0.00001 0.00004 -0.00002 -0.00002 -0.00001 0.00001 0.00000 0.00000 0.00002 -0.00002 0.00000 0.00002 -0.00003 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00002 0.00001 0.00007 -0.00002 -0.00005 0.00006 0.00005 -0.00011 0.00001 -0.00004 0.00003 -0.00005 0.00006 -0.00001 -0.00003 0.00004 -0.00001 0.00004 -0.00002 -0.00002 -0.00002 -0.00001 0.00000 -0.00001 0.00003 0.00001 0.00001 0.00004 0.00005 0.00008 -0.00020 -0.00021 -0.00025 -0.00026 0.00005 -0.00001 0.00009 0.00003 -0.00005 -0.00007 -0.00007 -0.00009 0.00004 0.00004 0.00007 0.00007 0.00002 -0.00002 0.00005 0.00000 0.00006 0.00004 0.00004 0.00002 -0.00002 -0.00003 -0.00002 -0.00003 0.00004 0.00000 0.00008 0.00004 -0.00004 0.00000 -0.00003 0.00001 0.00000 0.00007 0.00001 0.00007 -0.00001 0.00009 -0.00002 0.00008 0.00001 0.00002 -0.00005 -0.00004 0.00000 0.00002 -0.00010 -0.00008 -0.00003 0.00004 -0.00004 0.00003 0.00002 -0.00004 0.00001 -0.00006 0.00069 0.00066 0.00067 0.00076 0.00073 0.00074 -0.00001 0.00000 0.00006 0.00007 -0.00003 -0.00001 -0.00008 -0.00006 -0.00001 -0.00001 -0.00002 -0.00002 0.00004 0.00001 0.00002 -0.00001 -0.00004 0.00000 -0.00003 0.00000 0.00003 0.00000 0.00006 0.00003 2.73967 2.74939 2.73971 2.70182 2.65325 2.62589 2.76465 2.63987 2.05081 2.65058 2.05420 2.65018 2.05312 2.05301 2.66972 2.66826 2.62799 2.05097 2.62954 2.05090 2.65259 2.05528 2.65092 2.05509 2.85185 2.65323 2.70174 2.63988 2.05085 2.62590 2.65018 2.05312 2.65058 2.05419 2.05301 2.07549 2.06993 2.06894 2.20847 1.86741 2.20730 1.89952 2.29579 2.08630 2.10848 1.87913 2.29544 2.07970 2.10786 2.09552 2.07632 2.10694 2.09990 2.10985 2.08575 2.08756 2.10520 2.08832 2.08960 2.11658 2.11742 2.04918 2.11322 2.08328 2.08575 2.11314 2.08392 2.08547 2.11731 2.08226 2.08357 2.11744 2.08215 2.08357 2.05603 2.11134 2.11562 2.29570 1.89957 2.08635 2.07968 2.10787 2.09553 1.87910 2.29549 2.10847 2.10984 2.08576 2.08756 2.07633 2.10694 2.09989 2.10519 2.08961 2.08832 1.93559 1.94490 1.94640 1.86966 1.87349 1.89048 3.13928 0.05980 -0.00276 -3.08224 -2.45651 0.68226 0.68561 -2.45880 -3.08304 -0.00341 0.05811 3.13774 -3.11847 0.00771 -0.03030 3.09588 3.10724 -0.01866 0.03322 -3.09268 0.00648 3.14042 -3.11550 0.01844 -0.00977 3.11443 3.11415 -0.04484 -0.01325 3.13616 3.11276 -0.02101 0.01399 -3.13976 -3.11999 0.00945 -0.01076 -3.14019 3.12300 -0.00643 3.13663 0.04158 -0.00225 -3.09729 3.13974 0.03744 -0.00457 -3.10687 0.00897 -3.12268 3.10396 -0.02770 0.00487 -3.12967 3.10714 -0.02741 -0.00857 3.11219 3.12308 -0.03934 0.00171 -3.11900 3.13625 0.01554 -1.46645 0.61474 2.72973 1.65360 -2.54839 -0.43341 3.10722 -0.01894 0.03305 -3.09312 0.00812 -3.11831 3.09641 -0.03002 -0.01331 3.13610 3.11297 -0.02081 -3.11597 0.01808 0.00632 3.14037 -0.01058 -3.14013 3.12319 -0.00636 0.01392 -3.13971 -3.12017 0.00939 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000019 0.000006 0.000878 0.000191 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -2.319569e-08 Optimization completed. -- Stationary point found. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 1 1 1 2 2 3 3 4 4 5 5 6 6 8 11 11 12 12 13 13 14 14 16 16 18 21 21 22 22 23 24 24 26 26 27 30 30 30 2 11 21 3 4 5 23 6 7 8 9 8 10 35 12 13 14 15 16 17 18 19 18 20 30 22 23 24 25 26 27 29 27 28 34 31 32 33 1.4498 1.4549 1.4498 1.4297 1.404 1.3895 1.463 1.3969 1.0852 1.4026 1.0871 1.4024 1.0865 1.0864 1.4127 1.412 1.3907 1.0853 1.3915 1.0853 1.4037 1.0876 1.4028 1.0875 1.5091 1.404 1.4297 1.3969 1.0853 1.3895 1.4024 1.0865 1.4026 1.087 1.0864 1.0983 1.0954 1.0948 -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|-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|-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|-DE/DX = 0.0|-DE/DX = 0.0 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 2 2 11 1 1 3 2 2 5 2 2 6 3 3 8 4 4 8 5 5 6 1 1 12 11 11 14 11 11 16 12 12 18 13 13 18 14 14 16 1 1 22 21 21 24 3 3 21 22 22 27 23 23 27 24 24 26 18 18 18 31 31 32 1 1 1 2 2 2 3 3 3 4 4 4 5 5 5 6 6 6 8 8 8 11 11 11 12 12 12 13 13 13 14 14 14 16 16 16 18 18 18 21 21 21 22 22 22 23 23 23 24 24 24 26 26 26 27 27 27 30 30 30 30 30 30 11 21 21 3 4 4 5 23 23 6 7 7 8 9 9 8 10 10 6 35 35 12 13 13 14 15 15 16 17 17 18 19 19 18 20 20 16 30 30 22 23 23 24 25 25 21 26 26 27 29 29 27 28 28 26 34 34 31 32 33 32 33 33 126.537 106.9925 126.4705 108.836 131.5346 119.5394 120.805 107.6659 131.5217 119.1547 120.7685 120.0707 118.9666 120.7163 120.3156 120.8882 119.5017 119.6085 120.6167 119.6531 119.7266 121.2714 121.3188 117.4096 121.079 119.362 119.5059 121.074 119.3982 119.49 121.3132 119.3048 119.3796 121.3207 119.2982 119.3799 117.8011 120.9723 121.2155 131.5303 108.8384 119.5418 119.1537 120.7693 120.0711 107.6642 131.5241 120.8045 120.8881 119.5018 119.6086 118.9668 120.7164 120.3154 120.6163 119.727 119.6532 110.9027 111.4349 111.5203 107.1243 107.3416 108.3158 -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|-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|-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|-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|-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|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 11 11 21 21 2 2 21 21 2 2 11 11 1 1 4 4 1 1 3 3 2 2 23 23 2 2 5 5 2 2 7 7 3 3 9 9 4 4 10 10 1 1 13 13 1 1 12 12 11 11 15 15 11 11 17 17 12 12 19 19 13 13 20 20 14 14 14 16 16 16 1 1 23 23 1 1 22 22 21 21 25 25 3 3 21 21 22 22 29 29 23 23 28 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 4 4 4 4 5 5 5 5 6 6 6 6 11 11 11 11 11 11 11 11 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 21 21 21 21 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 2 2 2 2 11 11 11 11 21 21 21 21 3 3 3 3 4 4 4 4 5 5 5 5 23 23 23 23 6 6 6 6 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 30 30 30 30 30 30 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 26 27 27 27 27 27 27 27 3 4 3 4 12 13 12 13 22 23 22 23 5 23 5 23 6 7 6 7 8 9 8 9 21 26 21 26 8 10 8 10 6 35 6 35 5 35 5 35 14 15 14 15 16 17 16 17 18 19 18 19 18 20 18 20 16 30 16 30 14 30 14 30 31 32 33 31 32 33 24 25 24 25 3 26 3 26 27 29 27 29 27 28 27 28 26 34 26 34 24 34 24 179.8667 3.4235 -0.1611 -176.6043 -140.7359 39.1028 39.2972 -140.8641 -176.6478 -0.1949 3.3244 179.7773 -178.6723 0.4462 -1.7321 177.3864 178.0296 -1.0712 1.8994 -177.2015 0.37 179.9343 -178.508 1.0562 -0.5633 178.4411 178.4253 -2.5703 -0.7584 179.6905 178.3488 -1.2023 0.7994 -179.8947 -178.7667 0.5393 -0.6143 -179.9198 178.9364 -0.3691 179.7155 2.3786 -0.1292 -177.4662 179.8943 2.14 -0.261 -178.0152 0.5133 -178.918 177.8464 -1.5849 0.2792 -179.3181 178.0314 -1.5659 -0.4893 178.3134 178.9416 -2.2556 0.0964 -178.7033 179.6934 0.8937 -84.061 35.1843 156.3633 94.7007 -146.054 -24.875 178.0313 -1.0856 1.8904 -177.2265 0.4672 -178.665 177.4156 -1.7166 -0.7619 179.686 178.3613 -1.1909 -178.5346 1.0353 0.3609 179.9309 -0.6042 -179.9161 178.9474 -0.3645 0.7957 -179.8919 -178.776 -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|-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|-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|-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|-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|-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|-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|-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 1 Grimme-D3 -0.0308051879 PCM (using non-symmetric T matrix) UFF Total charges None On-the-fly selection Ethanol 24.852000 1.852593 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 240.21399999999988 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0019,-.0018,-.0958;-.036,-1.1621,-.9608;-.0244,-.7267,-2.3232;-.1458,-2.5316,-.6676;-.0805,-1.6315,-3.3662;-.1968,-3.4491,-1.7118;-.2064,-2.8811,.3564;-.1564,-2.9929,-3.0364;-.0746,-1.323,-4.4043;-.2759,-4.5108,-1.5174;-.003,-.0052,1.3547;-.7401,.9538,2.0864;.7303,-.9684,2.0834;-.7448,.9403,3.4753;-1.351,1.6774,1.5566;.7301,-.9625,3.473;1.3376,-1.6938,1.5521;-.0059,-.0115,4.1973;-1.3383,1.6753,4.0129;1.316,-1.705,4.0086;.0348,1.1631,-.9545;.1412,2.5312,-.6538;.029,.7349,-2.3191;.1954,3.4542,-1.6931;.1964,2.8759,.3723;.0885,1.6451,-3.3572;.1613,3.0049,-3.0202;.0869,1.3419,-4.3968;.2718,4.5149,-1.4928;.016,.0076,5.7046;.7732,.7133,6.0715;-.9483,.3262,6.1143;.2595,-.9771,6.1155;.2038,3.726,-3.8096;-.1969,-3.71,-3.8295; 0.000000 1.447667 0.000000 2.342463 1.430263 0.000000 2.597541 1.404773 2.452156 0.000000 3.654842 2.451176 1.381968 2.845506 0.000000 3.812219 2.412458 2.795467 1.390982 2.460487 0.000000 2.921752 2.172362 3.443081 1.083752 3.928812 2.144851 0.000000 4.197305 2.770215 2.379419 2.413307 1.402800 1.401489 3.395028 0.000000 4.507093 3.447428 2.165447 3.927915 1.082957 3.432848 5.010950 2.160185 0.000000 4.735656 3.403031 3.877039 2.157842 3.427284 1.082238 2.484310 2.150701 4.305399 0.000000 1.450490 2.588696 3.748030 3.239267 4.993822 4.615379 3.051082 5.313349 5.908275 5.350130 0.000000 2.494040 3.776045 4.772911 4.481692 6.070438 5.840124 4.240797 6.493075 6.910549 6.562334 1.413627 0.000000 2.493806 3.145161 4.477223 3.283135 5.549366 4.627848 2.741939 5.576455 6.547024 5.150391 1.412984 2.420113 0.000000 3.767203 4.959968 6.076134 5.438370 7.339029 6.817085 4.961875 7.630039 8.225484 7.406779 2.437383 1.388914 2.784995 0.000000 2.714849 4.016163 4.753148 4.910709 6.066105 6.188345 4.850851 6.658406 6.794402 6.992753 2.165357 1.085070 3.407241 2.142860 0.000000 3.767643 4.503997 5.849845 4.513762 6.919558 5.824524 3.777732 6.876114 7.926525 6.205379 2.437473 2.785035 1.389670 2.407447 3.869413 0.000000 2.715271 2.912849 4.219988 2.798147 5.119126 4.011107 2.285452 4.997433 6.132791 4.467760 2.165135 3.407681 1.085030 3.869521 4.312025 2.143305 0.000000 4.293141 5.285042 6.559636 5.480711 7.735489 6.839003 4.798722 7.825493 8.701311 7.278385 2.842651 2.434509 2.434447 1.404697 3.410970 1.403837 3.410634 0.000000 4.634698 5.872405 6.902324 6.405242 8.183464 7.767558 5.950814 8.537071 9.024192 8.365423 3.416602 2.142401 3.871866 1.087020 2.456327 3.395237 4.956504 2.157413 0.000000 4.635046 5.178628 6.545615 4.968622 7.506275 6.168803 4.127879 7.311558 8.535626 6.398726 3.416500 3.871903 2.142934 3.395396 4.956346 1.086936 2.456599 2.156628 4.297857 0.000000 1.447685 2.326314 2.334128 3.710183 3.693199 4.679668 4.258221 4.652208 4.253666 5.710168 2.588166 3.145050 3.775670 4.503322 2.913854 4.960307 4.017786 5.284186 5.179095 5.873664 0.000000 2.597723 3.710301 3.664437 5.070913 4.973387 6.082536 5.516769 6.023343 5.382123 7.106960 3.238531 3.282364 4.481791 4.512788 2.800329 5.439091 4.914102 5.479109 4.969949 6.408099 1.404787 0.000000 2.342381 2.334038 1.462583 3.664373 2.590063 4.233817 4.504368 3.800680 2.931493 5.315298 3.747711 4.477484 4.772274 5.849378 4.220657 6.076284 4.753670 6.559116 6.545871 6.902830 1.430213 2.452019 0.000000 3.812399 4.679739 4.233787 6.082521 5.360928 6.914386 6.670686 6.594879 5.499482 7.980781 4.614714 4.627311 5.840145 5.823715 4.013622 6.817793 6.191797 6.837317 6.170574 7.770633 2.412544 1.391032 2.795341 0.000000 2.922249 4.258699 4.504728 5.517129 5.862552 6.671043 5.771086 6.795992 6.365463 7.639112 3.050449 2.740381 4.241626 3.776336 2.287643 4.963146 4.855579 4.796758 4.129312 5.954911 2.172540 1.083826 3.443121 2.144830 0.000000 3.654786 3.693072 2.589912 4.973287 3.281026 5.360920 5.862167 4.655542 3.151620 6.435257 4.993373 5.549536 6.069791 6.919059 5.120430 7.339179 6.067176 7.734614 7.507028 8.184462 2.451171 2.845364 1.381944 2.460301 3.928759 0.000000 4.197521 4.652296 3.800671 6.023386 4.655573 6.594951 6.795725 6.006182 4.549903 7.676859 5.312919 5.576473 6.492864 6.875641 4.999671 7.630590 6.660923 7.824278 7.313128 8.539357 2.770440 2.413410 2.379477 1.401477 3.395100 1.402763 0.000000 4.506894 4.253347 2.931109 5.381866 3.151375 5.499323 6.364973 4.549722 2.669753 6.532663 5.907812 6.547255 6.909697 7.926036 6.133802 8.225451 6.794815 8.700535 8.536162 9.024687 3.447338 3.927755 2.165335 3.432677 5.010884 1.082930 2.160112 0.000000 4.735812 5.710248 5.315282 7.106946 6.435288 7.980794 7.638735 7.676814 6.532848 9.042337 5.349316 5.149431 6.562500 6.204287 4.470376 7.407574 6.996891 7.276220 6.400743 8.369209 3.403065 2.157822 3.876921 1.082237 2.484099 3.427150 2.150696 4.305312 0.000000 5.800466 6.767543 8.061421 6.861441 9.218296 8.185254 6.082586 9.243299 10.196533 8.524039 4.350006 3.815558 3.817914 2.533522 4.675731 2.535983 4.678140 1.507583 2.734401 2.738553 6.758659 6.842086 8.056624 8.163203 6.057523 9.208884 9.226460 10.189417 8.496149 0.000000 6.256791 7.322955 8.554523 7.535866 9.762052 8.879561 6.822135 9.876919 10.705474 9.272707 4.833922 4.269531 4.328390 3.016002 5.081874 3.092277 5.151432 2.155180 3.101881 3.224622 7.078974 6.995272 8.423526 8.254421 6.122951 9.499321 9.395984 10.509560 8.480698 1.098191 0.000000 6.290349 7.287306 8.552949 7.403053 9.719374 8.721579 6.632540 9.766197 10.682873 9.060427 4.863863 4.081799 4.554329 2.717185 4.770753 3.384362 5.488085 2.162593 2.527416 3.699534 7.185717 7.201148 8.499650 8.488116 6.386076 9.618919 9.583613 10.610669 8.769389 1.095013 1.765021 0.000000 6.292857 7.084960 8.447186 6.970783 9.510413 8.221121 6.083566 9.380527 10.530819 8.428256 4.866128 4.578374 4.059560 3.414102 5.515751 2.684113 4.743478 2.163879 3.742872 2.466795 7.390282 7.625381 8.609694 8.978623 6.916257 9.830467 9.966327 10.766456 9.383478 1.094471 1.767305 1.776897 0.000000 5.266037 5.662720 4.699779 7.010775 5.383317 7.486129 7.821615 6.772776 5.091468 8.563162 6.374473 6.583219 7.552567 7.856758 5.950668 8.677289 7.707641 8.838739 8.232584 9.584183 3.840371 3.374939 3.346449 2.133844 4.267380 2.132562 1.070000 2.458127 2.448380 10.216740 10.345807 10.553159 10.983171 0.000000 5.265836 3.840144 3.346470 3.374714 2.132674 2.133640 4.267183 1.070000 2.458326 2.448056 6.374885 7.552733 6.583160 8.676659 7.704946 7.857143 5.948244 8.839988 9.581619 8.230717 5.662729 7.010841 4.699952 7.486210 7.821961 5.383514 6.772964 5.091570 8.563282 10.235506 10.887420 10.757982 10.323778 7.446808 0.000000 0.5326713 0.2525967 0.1757967 -10.19423 -10.19421 -10.19389 -10.19358 -10.19263 -10.19262 -10.19212 -10.19210 -10.19074 -10.19073 -10.19025 -10.19017 -10.18883 -10.18883 -10.18245 -0.89570 -0.86102 -0.84494 -0.81029 -0.78350 -0.76102 -0.75134 -0.74357 -0.71503 -0.70660 -0.66591 -0.63164 -0.61232 -0.59695 -0.58846 -0.57305 -0.56271 -0.52077 -0.49875 -0.49788 -0.46736 -0.46590 -0.45605 -0.44624 -0.44348 -0.42719 -0.42276 -0.42223 -0.41862 -0.41339 -0.40807 -0.40167 -0.38479 -0.36670 -0.36623 -0.35834 -0.35408 -0.34679 -0.34478 -0.33111 -0.32752 -0.30912 -0.28793 -0.25770 -0.25603 -0.24714 -0.21746 -0.17537 -0.03089 -0.01294 -0.00771 -0.00018 0.03571 0.04908 0.09981 0.10810 0.10968 0.12577 0.13121 0.13634 0.13916 0.15812 0.16376 0.16567 0.17402 0.17820 0.18572 0.18868 0.19483 0.20311 0.21101 0.22084 0.22589 0.24679 0.25583 0.26290 0.27624 0.27707 0.29795 0.31039 0.31208 0.32210 0.32981 0.36585 0.37145 0.38031 0.39462 0.40768 0.42211 0.48076 0.48531 0.49724 0.50261 0.51312 0.51720 0.52355 0.53196 0.53854 0.54225 0.55557 0.55713 0.55984 0.56623 0.56900 0.57550 0.57611 0.57940 0.58674 0.59403 0.59634 0.60194 0.60801 0.61163 0.61195 0.61457 0.62358 0.63232 0.63626 0.63900 0.64339 0.64411 0.64483 0.65694 0.68571 0.69617 0.70401 0.71494 0.73279 0.74292 0.74989 0.76755 0.78643 0.79742 0.80473 0.80751 0.82927 0.83718 0.84325 0.84703 0.85447 0.86009 0.86592 0.86687 0.88014 0.88472 0.89796 0.90784 0.91132 0.91489 0.91861 0.92302 0.94871 0.95836 0.97123 0.97835 0.98449 0.99691 1.00052 1.01071 1.02020 1.03365 1.06203 1.07694 1.08564 1.09838 1.11339 1.13607 1.14277 1.17407 1.18643 1.18960 1.20112 1.20675 1.23081 1.24056 1.24815 1.26011 1.27218 1.32271 1.33186 1.34294 1.35990 1.39092 1.40166 1.42191 1.43605 1.44197 1.44728 1.44897 1.44979 1.47017 1.47362 1.47529 1.48694 1.48723 1.49809 1.50098 1.52032 1.57249 1.57518 1.59693 1.60829 1.66046 1.68889 1.75093 1.77093 1.77448 1.78204 1.79998 1.80144 1.83180 1.83938 1.85422 1.85869 1.87962 1.90087 1.90349 1.90778 1.91592 1.92813 1.93321 1.95518 1.97693 1.98050 1.99302 1.99546 2.00987 2.03589 2.03775 2.07639 2.09268 2.10373 2.10989 2.13234 2.14042 2.14842 2.16085 2.17968 2.19480 2.20818 2.21142 2.23258 2.23780 2.24439 2.25192 2.27017 2.28214 2.29042 2.29609 2.31826 2.32642 2.34716 2.35417 2.37597 2.40461 2.40689 2.43131 2.44275 2.50572 2.53471 2.55372 2.59698 2.60992 2.63806 2.64208 2.64596 2.65749 2.67428 2.68093 2.68906 2.70213 2.70787 2.73935 2.75864 2.78780 2.79065 2.81936 2.85270 2.86897 2.87505 2.92900 2.94600 2.99306 3.00766 3.15252 3.18181 3.31863 3.35704 3.43115 3.51936 4.07292 4.08638 4.09213 4.09578 4.10098 4.12094 4.13366 4.14316 4.16957 4.19910 4.25252 4.30379 4.33609 4.35199 4.40024 4.43740 4.49519 4.67361 4.81728 4.81966 -10.20497 -10.20344 -10.20180 -10.19413 -10.19412 -10.19344 -10.19338 -10.19290 -10.19286 -10.19219 -10.19218 -10.19207 -10.19178 -10.19085 -10.19078 -10.18972 -10.18971 -10.18865 -10.18864 -10.18253 -0.89114 -0.85926 -0.84302 -0.80501 -0.78080 -0.75858 -0.74963 -0.74141 -0.71467 -0.70288 -0.66029 -0.63024 -0.61080 -0.59481 -0.58683 -0.57112 -0.56048 -0.51930 -0.49696 -0.49594 -0.46619 -0.46425 -0.45522 -0.44497 -0.44247 -0.42511 -0.42182 -0.42122 -0.41709 -0.41100 -0.40010 -0.39972 -0.38397 -0.36519 -0.36391 -0.35297 -0.35152 -0.34508 -0.34416 -0.32943 -0.32631 -0.29338 -0.27824 -0.25450 -0.24734 -0.24173 -0.21716 -0.10870 -0.02618 -0.00794 -0.00453 0.00725 0.04387 0.06620 0.10058 0.10818 0.11052 0.12637 0.13298 0.13665 0.14023 0.16126 0.16567 0.16878 0.17465 0.17907 0.18709 0.19343 0.19768 0.20507 0.21247 0.22468 0.22738 0.24913 0.26035 0.26512 0.27942 0.28045 0.29840 0.31137 0.31389 0.32288 0.33051 0.36717 0.37844 0.38134 0.39685 0.40934 0.42513 0.48515 0.48671 0.49881 0.50421 0.51512 0.51807 0.52516 0.53495 0.54329 0.54601 0.55729 0.55877 0.56163 0.56897 0.57031 0.57677 0.57902 0.58209 0.58847 0.59605 0.59732 0.60442 0.60996 0.61268 0.61434 0.61599 0.62560 0.63285 0.63908 0.64043 0.64501 0.64590 0.65020 0.65922 0.68824 0.69944 0.70602 0.71780 0.73402 0.74482 0.75287 0.77745 0.78964 0.79921 0.80772 0.80808 0.83055 0.83774 0.84386 0.84750 0.85599 0.86121 0.86615 0.86819 0.88075 0.88633 0.89866 0.90854 0.91196 0.91882 0.92056 0.92401 0.95113 0.95899 0.97397 0.98026 0.98567 1.00017 1.00157 1.01278 1.02308 1.03460 1.06342 1.07848 1.08695 1.10136 1.11478 1.13713 1.14395 1.17582 1.18737 1.19139 1.20260 1.20895 1.23200 1.24250 1.25083 1.26391 1.27481 1.32746 1.33581 1.34434 1.36599 1.39274 1.40345 1.42319 1.43734 1.44366 1.44910 1.45192 1.45345 1.47218 1.47573 1.47737 1.48826 1.48872 1.50253 1.50584 1.52188 1.57562 1.57857 1.60030 1.61475 1.66534 1.69306 1.75769 1.77411 1.77657 1.78577 1.80133 1.80276 1.83293 1.84119 1.85590 1.86112 1.88396 1.90216 1.90503 1.90893 1.91620 1.93298 1.93529 1.95836 1.98250 1.98857 1.99596 2.00052 2.01113 2.03681 2.03873 2.07763 2.09621 2.10631 2.11212 2.13464 2.14173 2.15133 2.16275 2.18272 2.19722 2.21114 2.21380 2.23434 2.24253 2.24629 2.25780 2.27117 2.28562 2.29217 2.29932 2.32007 2.32663 2.34821 2.35481 2.38373 2.40923 2.41146 2.44421 2.44675 2.51157 2.54103 2.55583 2.59975 2.61157 2.64086 2.64530 2.64824 2.66017 2.67630 2.68341 2.69237 2.70432 2.70866 2.73988 2.75944 2.78889 2.79363 2.82025 2.85363 2.87028 2.87677 2.93646 2.94800 2.99538 3.00936 3.15439 3.18440 3.31995 3.35790 3.43226 3.52036 4.07610 4.08873 4.09383 4.09810 4.10298 4.12172 4.13563 4.14484 4.16933 4.20530 4.25300 4.30570 4.33725 4.35331 4.40146 4.43976 4.49914 4.67488 4.82171 4.82193 0.0298 0.0440 1.4874 1.4883 -119.0578 -102.2387 -92.5880 -2.4662 0.1398 0.2344 -14.4296 2.3895 12.0401 -2.4662 0.1398 0.2344 -0.3209 -0.3401 21.5671 0.3921 0.5038 15.0637 0.9584 1.2221 -10.1539 -11.8444 -238.5245 -2334.2384 -4826.9883 -12.6926 -1.8240 14.1265 -2.2552 3.7674 6.2191 -505.5179 -982.3668 -1243.8354 3.0459 2.4282 -27.0590 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 240.21399999999988 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0013,-.0019,-.0944;-.0369,-1.1644,-.96;-.0257,-.727,-2.3211;-.1424,-2.535,-.6742;-.0819,-1.6439,-3.3637;-.1942,-3.4483,-1.73;-.1983,-2.8856,.3513;-.1581,-3.0116,-3.0622;-.0743,-1.3096,-4.3981;-.2708,-4.5106,-1.5153;-.0023,-.005,1.3605;-.7376,.9516,2.0954;.7286,-.9657,2.0929;-.7403,.9414,3.486;-1.3438,1.6791,1.565;.7259,-.9626,3.4844;1.3308,-1.6957,1.5615;-.0059,-.0108,4.21;-1.3308,1.6806,4.0226;1.3081,-1.7092,4.0194;.0361,1.1651,-.9537;.1402,2.5342,-.6603;.0285,.735,-2.3172;.1944,3.4532,-1.7111;.1928,2.8794,.3672;.0872,1.6574,-3.3547;.1621,3.0235,-3.0457;.0825,1.3287,-4.3909;.2698,4.5144,-1.4904;.0158,.0084,5.7189;.7727,.7119,6.091;-.9489,.3258,6.1291;.2568,-.9775,6.1296;.2067,3.7545,-3.8481;-.2008,-3.7382,-3.8687; 0.000000 1.449775 0.000000 2.341886 1.429733 0.000000 2.602428 1.404048 2.448446 0.000000 3.659321 2.451484 1.389538 2.833942 0.000000 3.819668 2.415333 2.789887 1.396940 2.436751 0.000000 2.924578 2.169804 3.439664 1.085231 3.918782 2.156016 0.000000 4.229656 2.801036 2.405411 2.435087 1.402632 1.402411 3.416028 0.000000 4.498526 3.441355 2.157680 3.920890 1.087051 3.421566 5.005570 2.165252 0.000000 4.734921 3.399993 3.876247 2.150979 3.416259 1.086481 2.475839 2.157041 4.312277 0.000000 1.454941 2.594273 3.751828 3.249765 5.001058 4.630845 3.058616 5.350144 5.904963 5.351901 0.000000 2.499323 3.782054 4.778071 4.492413 6.080148 5.855633 4.249397 6.530176 6.907825 6.564355 1.412737 0.000000 2.499240 3.153698 4.484384 3.298270 5.558030 4.650769 2.752905 5.616654 6.549510 5.155960 1.411972 2.413721 0.000000 3.775673 4.969557 6.084176 5.454447 7.350932 6.839237 4.976633 7.670997 8.226164 7.413372 2.440951 1.390687 2.781338 0.000000 2.716882 4.021027 4.756884 4.920952 6.076671 6.202288 4.860213 6.694645 6.789798 6.996512 2.162728 1.085332 3.401240 2.144461 0.000000 3.776205 4.513904 5.858713 4.529999 6.929180 5.849414 3.790606 6.916478 7.930603 6.211163 2.440929 2.781243 1.391500 2.403123 3.865995 0.000000 2.717621 2.917332 4.225303 2.805957 5.124079 4.028815 2.284433 5.032570 6.135153 4.467123 2.162402 3.401702 1.085297 3.866241 4.306072 2.144992 0.000000 4.304468 5.297256 6.570324 5.499667 7.748179 6.865565 4.815761 7.868467 8.705808 7.286788 2.849527 2.435858 2.435891 1.403685 3.412025 1.402810 3.411791 0.000000 4.642024 5.881714 6.909604 6.422142 8.195704 7.790385 5.967542 8.578219 9.023748 8.373919 3.419482 2.144181 3.868821 1.087604 2.457704 3.391999 4.953812 2.156652 0.000000 4.642537 5.186568 6.553341 4.981611 7.513139 6.191723 4.136227 7.348135 8.539632 6.401047 3.419249 3.868692 2.144757 3.392106 4.953487 1.087505 2.458076 2.155788 4.295822 0.000000 1.449796 2.330727 2.335318 3.715012 3.703024 4.683985 4.262261 4.682752 4.242648 5.711717 2.593533 3.152974 3.781846 4.512688 2.917514 4.969928 4.023324 5.296143 5.186343 5.883224 0.000000 2.602398 3.715007 3.663507 5.077159 4.981365 6.086625 5.523854 6.050929 5.365802 7.108422 3.248344 3.296826 4.491815 4.528206 2.808084 5.454323 4.924065 5.497186 4.982230 6.424251 1.404040 0.000000 2.341903 2.335378 1.462992 3.663539 2.601225 4.230188 4.503445 3.824472 2.919105 5.314980 3.751503 4.483787 4.778220 5.857535 4.224368 6.084922 4.759009 6.569750 6.552459 6.911135 1.429689 2.448430 0.000000 3.819655 4.684017 4.230187 6.086648 5.365389 6.912469 6.677441 6.613835 5.475074 7.979779 4.629494 4.649231 5.855130 5.847426 4.030597 6.839186 6.205817 6.862856 6.192215 7.792901 2.415316 1.396944 2.789884 0.000000 2.924533 4.262247 4.503427 5.523857 5.869844 6.677432 5.778303 6.825489 6.350361 7.640078 3.056845 2.751084 4.248534 3.788596 2.288335 4.976116 4.863402 4.812480 4.137703 5.969729 2.169822 1.085250 3.439669 2.156041 0.000000 3.659337 3.703100 2.601255 4.981411 3.305629 5.365409 5.869869 4.684585 3.149297 6.446438 5.000483 5.557140 6.080204 6.927700 5.123597 7.351580 6.079385 7.747052 7.512405 8.197715 2.451443 2.833931 1.389544 2.436745 3.918796 0.000000 4.229663 4.682814 3.824493 6.050969 4.684581 6.613849 6.825509 6.043624 4.545453 7.700201 5.349141 5.615383 6.529943 6.914658 5.033198 7.671294 6.697978 7.866417 7.347991 8.580655 2.801011 2.435089 2.405418 1.402412 3.416053 1.402630 0.000000 4.498546 4.242739 2.919153 5.365861 3.149321 5.475111 6.350396 4.545478 2.642997 6.518567 5.904579 6.548731 6.908048 7.929199 6.134220 8.227005 6.792325 8.705011 8.538604 9.025728 3.441311 3.920877 2.157684 3.421559 5.005585 1.087049 2.165246 0.000000 4.734901 5.711746 5.314984 7.108446 6.446426 7.979784 7.640087 7.700195 6.518540 9.041179 5.350355 5.154202 6.563705 6.208965 4.469652 7.413085 7.000340 7.283430 6.402026 8.376716 3.399981 2.150984 3.876247 1.086482 2.475860 3.416258 2.157044 4.312277 0.000000 5.813358 6.781280 8.073677 6.882290 9.232185 8.214551 6.101824 9.287492 10.202860 8.534409 4.358445 3.819338 3.821596 2.535386 4.679212 2.537666 4.681539 1.509146 2.736245 2.740076 6.772197 6.862229 8.068854 8.191653 6.075747 9.222511 9.269855 10.195819 8.505468 0.000000 6.274388 7.341138 8.571534 7.559638 9.781168 8.911240 6.843185 9.925270 10.715612 9.285382 4.846839 4.278232 4.335998 3.021218 5.089170 3.098429 5.159862 2.160212 3.104994 3.231052 7.097611 7.021483 8.441040 8.289816 6.147821 9.517599 9.444289 10.522616 8.496430 1.098300 0.000000 6.303816 7.301245 8.565479 7.424308 9.733728 8.750967 6.652827 9.810378 10.689323 9.071225 4.872920 4.087498 4.557757 2.721880 4.776936 3.385155 5.490598 2.164607 2.533524 3.699446 7.200137 7.222225 8.512513 8.518031 6.405032 9.632767 9.627534 10.617908 8.779948 1.095357 1.764801 0.000000 6.305338 7.098170 8.459181 6.991269 9.522736 8.251199 6.102242 9.423324 10.538155 8.438336 4.874163 4.581004 4.064215 3.415444 5.518641 2.686533 4.747329 2.165271 3.745023 2.468505 7.403637 7.645235 8.621665 9.006196 6.934349 9.845010 10.010162 10.771702 9.392875 1.094837 1.766850 1.775445 0.000000 5.314551 5.709342 4.740205 7.053637 5.427719 7.518501 7.867057 6.821323 5.101624 8.601304 6.427080 6.638759 7.605852 7.912028 6.001086 8.734214 7.760944 8.897008 8.283358 9.641765 3.887338 3.414019 3.390141 2.158238 4.305251 2.157645 1.086394 2.488844 2.477929 10.276097 10.409787 10.613099 11.043108 0.000000 5.314545 3.887365 3.390136 3.414015 2.157647 2.158234 4.305222 1.086396 2.488850 2.477920 6.428121 7.606090 6.640111 8.733936 7.757416 7.913958 6.000372 8.899264 9.639115 8.283467 5.709274 7.053595 4.740177 7.518483 7.867038 5.427714 6.821316 5.101639 8.601295 10.295878 10.951981 10.818119 10.382535 7.503807 0.000000 0.5303950 0.2511019 0.1747843 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= 328 328 328 328 328 MxSgAt= 35 MxSgA2= 35. 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. NBasis= 330 RedAO= T EigKep= 3.17D-04 NBF= 330 NBsUse= 330 1.00D-06 EigRej= -1.00D+00 NBFU= 330 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= 328 328 328 328 328 MxSgAt= 35 MxSgA2= 35. 1 0.7731 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 C C C C C C H C H H C C C C H C H C H H C C C C H C C H H C H H H H H 13 13 13 13 13 13 1 13 1 1 13 13 13 13 1 13 1 13 1 1 13 13 13 13 1 13 13 1 1 13 1 1 1 1 1 0.06200 -0.02244 0.01132 0.01673 -0.00874 -0.01056 -0.00230 0.01616 0.00056 0.00073 -0.02121 0.01756 0.01781 -0.00701 -0.00150 -0.00710 -0.00153 0.01186 0.00084 0.00084 -0.02243 0.01672 0.01131 -0.01055 -0.00230 -0.00874 0.01615 0.00056 0.00073 -0.00298 0.00323 0.00098 0.00068 -0.00236 -0.00236 69.69802 -25.22937 12.73046 18.80752 -9.82425 -11.86943 -10.28969 18.16596 2.48240 3.25230 -23.84486 19.73769 20.01714 -7.88539 -6.70884 -7.98302 -6.83389 13.33565 3.73308 3.77381 -25.21937 18.79981 12.71289 -11.86562 -10.28769 -9.82050 18.15560 2.48252 3.24948 -3.34644 14.45626 4.39569 3.03230 -10.54200 -10.54741 24.86998 -9.00247 4.54255 6.71099 -3.50553 -4.23531 -3.67162 6.48207 0.88578 1.16050 -8.50844 7.04290 7.14261 -2.81370 -2.39388 -2.84854 -2.43850 4.75849 1.33205 1.34659 -8.99890 6.70824 4.53627 -4.23395 -3.67090 -3.50420 6.47837 0.88583 1.15949 -1.19409 5.15835 1.56849 1.08200 -3.76165 -3.76358 23.24876 -8.41561 4.24643 6.27351 -3.27702 -3.95921 -3.43227 6.05951 0.82804 1.08485 -7.95379 6.58379 6.67700 -2.63028 -2.23783 -2.66285 -2.27954 4.44830 1.24522 1.25881 -8.41228 6.27094 4.24056 -3.95795 -3.43161 -3.27577 6.05606 0.82808 1.08391 -1.11625 4.82209 1.46624 1.01146 -3.51643 -3.51824 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 0.575689 -0.071943 0.120857 0.143191 -0.038684 -0.050680 -0.003284 0.152940 -0.002925 -0.002553 -0.027684 0.007126 0.008071 -0.019697 -0.001678 -0.020576 -0.001669 0.050355 -0.001381 -0.001351 -0.071904 0.143358 0.120774 -0.050689 -0.003292 -0.038690 0.152878 -0.002925 -0.002550 -0.000525 -0.000845 -0.000722 -0.000978 -0.001145 -0.001151 -0.285966 0.043265 -0.060351 -0.070122 0.022000 0.023053 -0.003806 -0.075949 0.002456 0.000364 -0.008022 0.033969 0.034288 -0.005107 0.003383 -0.004155 0.003422 0.000198 -0.001083 -0.001092 0.043324 -0.070178 -0.060293 0.023087 -0.003859 0.022041 -0.075903 0.002467 0.000380 -0.000728 -0.000931 -0.000950 -0.000639 0.000616 0.000500 -0.289724 0.028678 -0.060507 -0.073069 0.016684 0.027627 0.007090 -0.076991 0.000468 0.002189 0.035706 -0.041095 -0.042359 0.024804 -0.001704 0.024732 -0.001753 -0.050553 0.002464 0.002443 0.028580 -0.073181 -0.060480 0.027602 0.007151 0.016650 -0.076975 0.000458 0.002170 0.001253 0.001776 0.001672 0.001617 0.000529 0.000650 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 -0.021235 0.005371 -0.006475 -0.021658 0.003539 0.005074 0.000416 -0.013485 0.000297 0.000089 -0.042705 0.067432 0.069161 -0.029807 -0.004399 -0.029471 -0.004412 0.077436 -0.000780 -0.000805 0.005242 -0.021128 -0.006300 0.004958 0.000375 0.003474 -0.013145 0.000294 0.000094 0.001643 0.000573 -0.000236 -0.000201 0.000154 0.000108 0.001166 -0.001154 -0.001349 0.013969 0.000356 -0.001287 -0.001706 -0.001103 0.000047 0.000104 -0.000052 0.012061 -0.011871 0.001173 0.000473 -0.001239 -0.000566 -0.001387 0.000572 -0.000552 0.000808 -0.012933 0.002185 0.000963 0.001640 -0.000551 0.001930 -0.000060 -0.000120 0.000040 0.000791 -0.000977 0.000441 -0.000642 0.000655 -0.000039 0.006160 0.002636 -0.000490 0.002895 0.002363 -0.005738 0.003672 0.000927 0.001626 -0.000203 0.020494 -0.020112 -0.000291 -0.001023 0.000003 0.001123 -0.001006 -0.000700 0.000656 -0.006067 0.000367 -0.002668 -0.002360 0.005702 -0.002856 -0.003714 -0.000919 -0.001634 0.000023 0.000775 0.000539 -0.001063 -0.011736 0.011743 -0.0013 0.0032 1.0 0.0246 0.9997 -0.0032 0.9997 -0.0246 0.0013 -0.2897 -0.2865 0.5762 -38.878 -38.444 77.322 -13.873 -13.718 27.591 -12.968 -12.824 25.792 1 C 13 0.9988 -0.0472 0.0143 -0.0294 -0.3366 0.9412 0.0396 0.9405 0.3376 -0.0722 0.0265 0.0457 -9.69 3.558 6.133 -3.458 1.269 2.188 -3.232 1.187 2.046 2 C 13 0.0199 0.7112 -0.7027 0.0308 0.7021 0.7114 0.9993 -0.0358 -0.0079 -0.0631 -0.058 0.1211 -8.472 -7.778 16.25 -3.023 -2.775 5.799 -2.826 -2.595 5.421 3 C 13 -0.098 -0.3957 0.9131 0.0658 0.913 0.4027 0.993 -0.0995 0.0635 -0.0744 -0.0719 0.1463 -9.978 -9.648 19.626 -3.56 -3.443 7.003 -3.328 -3.218 6.547 4 C 13 0.9983 -0.0579 -0.0034 -0.0198 -0.3944 0.9187 0.0545 0.9171 0.3949 -0.0389 0.0154 0.0235 -5.219 2.071 3.148 -1.862 0.739 1.123 -1.741 0.691 1.05 5 C 13 0.9975 -0.0689 0.0184 0.0705 0.9148 -0.3976 0.0106 0.3979 0.9174 -0.0511 0.0224 0.0286 -6.851 3.008 3.843 -2.445 1.073 1.371 -2.285 1.003 1.282 6 C 13 0.1023 0.9096 0.4028 0.986 -0.1462 0.0798 -0.1314 -0.389 0.9118 -0.0063 -0.0035 0.0098 -3.362 -1.859 5.221 -1.199 -0.663 1.863 -1.121 -0.62 1.741 7 H 1 -0.0367 -0.6934 0.7196 0.0462 0.7181 0.6944 0.9983 -0.0587 -0.0057 -0.0805 -0.0733 0.1537 -10.799 -9.832 20.63 -3.853 -3.508 7.361 -3.602 -3.279 6.882 8 C 13 0.9985 -0.0551 0.0011 -0.0211 -0.3643 0.9311 0.0509 0.9297 0.3649 -0.0029 1.0E-4 0.0028 -1.569 0.056 1.513 -0.56 0.02 0.54 -0.523 0.019 0.505 9 H 1 0.9996 -0.0227 -0.0141 0.0124 0.8627 -0.5056 0.0237 0.5052 0.8626 -0.0026 -6.0E-4 0.0031 -1.364 -0.314 1.678 -0.487 -0.112 0.599 -0.455 -0.105 0.56 10 H 1 0.7824 0.6228 0.0017 -0.6227 0.7823 0.013 0.0068 -0.0112 0.9999 -0.0617 0.026 0.0357 -8.276 3.485 4.792 -2.953 1.243 1.71 -2.761 1.162 1.598 11 C 13 -0.5847 0.5987 -0.5474 -0.5215 0.2395 0.8189 0.6214 0.7643 0.1722 -0.0506 -0.0428 0.0934 -6.794 -5.741 12.535 -2.424 -2.048 4.473 -2.266 -1.915 4.181 12 C 13 -0.5835 0.5981 0.5493 0.5175 -0.2474 0.8191 0.6259 0.7622 -0.1652 -0.0517 -0.0438 0.0954 -6.931 -5.875 12.806 -2.473 -2.096 4.57 -2.312 -1.96 4.272 13 C 13 0.7867 0.6172 -0.0109 -0.6098 0.7798 0.1416 0.0959 -0.1047 0.9899 -0.0431 0.0181 0.0249 -5.783 2.435 3.348 -2.064 0.869 1.195 -1.929 0.812 1.117 14 C 13 0.8625 0.5043 0.0428 -0.1085 0.1018 0.9889 -0.4943 0.8575 -0.1425 -0.0042 -0.0019 0.0061 -2.255 -0.993 3.248 -0.805 -0.354 1.159 -0.752 -0.331 1.084 15 H 1 0.7964 0.6046 0.0145 -0.5995 0.7923 -0.1131 -0.0799 0.0814 0.9935 -0.043 0.0181 0.0248 -5.767 2.434 3.332 -2.058 0.869 1.189 -1.924 0.812 1.111 16 C 13 0.8636 0.5032 -0.031 0.1053 -0.12 0.9872 -0.493 0.8558 0.1566 -0.0042 -0.0019 0.0062 -2.251 -1.04 3.292 -0.803 -0.371 1.175 -0.751 -0.347 1.098 17 H 1 -0.5882 0.8087 -5.0E-4 0.0085 0.0068 0.9999 0.8087 0.5881 -0.0109 -0.0561 -0.0506 0.1067 -7.531 -6.786 14.317 -2.687 -2.421 5.109 -2.512 -2.264 4.776 18 C 13 0.7702 0.6378 0.0014 -0.6135 0.7403 0.275 0.1743 -0.2126 0.9615 -0.002 -7.0E-4 0.0027 -1.081 -0.371 1.452 -0.386 -0.133 0.518 -0.361 -0.124 0.484 19 H 1 0.7606 0.6493 -0.0014 -0.6259 0.7326 -0.2674 -0.1726 0.2043 0.9636 -0.002 -6.0E-4 0.0027 -1.087 -0.344 1.43 -0.388 -0.123 0.51 -0.363 -0.115 0.477 20 H 1 0.9989 -0.0459 -0.0108 0.0254 0.3315 0.9431 0.0397 0.9423 -0.3323 -0.0722 0.0265 0.0457 -9.682 3.552 6.13 -3.455 1.267 2.188 -3.23 1.185 2.045 21 C 13 0.0922 0.3885 0.9168 0.0662 0.9163 -0.3949 0.9935 -0.0971 -0.0587 -0.0743 -0.0719 0.1462 -9.974 -9.643 19.617 -3.559 -3.441 7.0 -3.327 -3.217 6.544 22 C 13 0.0158 0.7072 0.7068 -0.0335 -0.7061 0.7073 0.9993 -0.0349 0.0125 -0.0631 -0.0579 0.121 -8.467 -7.772 16.24 -3.021 -2.773 5.795 -2.824 -2.593 5.417 23 C 13 0.9976 -0.0672 -0.0142 0.0672 0.9129 0.4026 -0.0141 -0.4026 0.9153 -0.051 0.0224 0.0286 -6.849 3.007 3.841 -2.444 1.073 1.371 -2.284 1.003 1.281 24 C 13 0.1034 0.9113 -0.3986 0.9867 -0.1446 -0.0747 0.1258 0.3855 0.9141 -0.0063 -0.0035 0.0098 -3.367 -1.852 5.219 -1.201 -0.661 1.862 -1.123 -0.618 1.741 25 H 1 0.9984 -0.0566 0.007 0.0156 0.3896 0.9208 0.0548 0.9192 -0.3899 -0.0389 0.0154 0.0235 -5.219 2.071 3.148 -1.862 0.739 1.123 -1.741 0.691 1.05 26 C 13 0.0329 0.6895 0.7235 0.0479 0.722 -0.6902 0.9983 -0.0573 0.0093 -0.0804 -0.0732 0.1537 -10.793 -9.826 20.618 -3.851 -3.506 7.357 -3.6 -3.278 6.878 27 C 13 0.9985 -0.0538 0.003 0.0166 0.3602 0.9327 0.0513 0.9313 -0.3605 -0.0029 1.0E-4 0.0028 -1.569 0.054 1.515 -0.56 0.019 0.54 -0.523 0.018 0.505 28 H 1 0.9996 -0.0221 0.0178 0.0099 0.8601 0.5101 -0.0266 -0.5097 0.8599 -0.0026 -6.0E-4 0.0031 -1.363 -0.314 1.677 -0.486 -0.112 0.598 -0.455 -0.105 0.559 29 H 1 -0.685 0.7285 0.003 0.7156 0.6736 -0.1846 0.1365 0.1243 0.9828 -0.0023 0.001 0.0013 -0.305 0.136 0.169 -0.109 0.048 0.06 -0.102 0.045 0.056 30 C 13 -0.6704 0.7419 -0.0137 0.685 0.6116 -0.3958 0.2853 0.2748 0.9182 -0.0015 -8.0E-4 0.0023 -0.781 -0.422 1.203 -0.279 -0.151 0.429 -0.26 -0.141 0.401 31 H 1 0.7427 0.6562 0.1339 -0.5816 0.7311 -0.3567 -0.3319 0.187 0.9246 -0.0011 -0.001 0.0021 -0.591 -0.547 1.137 -0.211 -0.195 0.406 -0.197 -0.182 0.379 32 H 1 0.6436 0.7421 0.1873 0.7496 -0.5617 -0.3501 0.1546 -0.3657 0.9178 -0.0011 -0.001 0.0021 -0.577 -0.551 1.128 -0.206 -0.197 0.403 -0.193 -0.184 0.376 33 H 1 0.0345 0.7048 0.7086 0.9985 -0.0539 0.0049 0.0417 0.7074 -0.7056 -0.0112 -0.0012 0.0123 -5.963 -0.617 6.58 -2.128 -0.22 2.348 -1.989 -0.206 2.195 34 H 1 1.17277526e-02 1.73146956e-02 5.85182213e-01 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 6 6 6 6 6 6 1 6 1 1 6 6 6 6 1 6 1 6 1 1 6 6 6 6 1 6 6 1 1 6 1 1 1 1 1 -0.000012305 -0.000000253 -0.002776306 -0.000392909 -0.002443194 0.000241617 0.000348142 0.007489381 0.003382155 0.000056083 0.000855013 0.004416181 -0.000306833 -0.008568418 0.005653036 0.000491934 0.006469557 -0.005892381 0.000090438 0.000823616 0.001630474 0.000003741 0.000644060 -0.000421898 0.000122439 0.002029908 -0.001712946 -0.000136966 -0.002167322 0.001662796 0.000064659 -0.000032339 0.001010515 0.000344942 -0.001753119 -0.000331614 -0.000323925 0.001825032 -0.000373714 0.000881319 -0.000850150 0.001264488 0.000249226 0.000034624 -0.000334074 -0.000885622 0.000862739 0.001285738 -0.000280386 -0.000057090 -0.000345827 -0.000231532 -0.000263210 -0.000713039 -0.000112930 0.000243415 0.000361217 0.000083123 -0.000250327 0.000358847 0.000388360 0.002462927 0.000240837 -0.000054116 -0.000852324 0.004429883 -0.000374957 -0.007522031 0.003290603 -0.000462334 -0.006430079 -0.005904038 -0.000083481 -0.000858088 0.001591769 0.000273600 0.008532118 0.005673180 -0.000012768 -0.000668434 -0.000406019 -0.000110657 -0.002025748 -0.001743560 0.000131163 0.002161337 0.001673885 0.000403940 0.000470345 0.000150767 -0.000006381 -0.000023860 0.000512821 -0.000117338 -0.000089126 0.000292697 -0.000066139 -0.000114717 0.000245571 0.000580446 0.008643265 -0.009172483 -0.000541980 -0.008577509 -0.009241176 0.009241176 0.002978706 (Enter /mnt/data/applications/G09/g09/l716.exe) 0.7730 0.7730 0.7729 open 1 1 1 -771.203883646309 -771.203934357801 -0.000050711492 -771.203934912585 -0.000000554784 -771.203935267040 -0.000000354454 -771.203935316731 -0.000000049692 -771.203935320815 -0.000000004084 -771.203935322290 -0.000000001474 -771.203935322711 -0.000000000421 -771.203935323064 -0.000000000353 -771.203935323149 -0.000000000085 -771.203935323151 -0.000000000002 -771.203935323 11 0.7729 7.636570057840e+02 -4.488390221880e+03 1.602271990119e+03 Using DIIS extrapolation, IDIIS= 1040. Two-electron integral symmetry not used. Keep R1 and R2 ints in memory in canonical form, NReq=3001587920. IVT= 602900 IEndB= 602900 NGot= 5502926848 MDV= 2519471109 LenX= 2519471109 LenY= 2519361768 Requested convergence on RMS density matrix=1.00D-08 within 512 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= 54615 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. 0.7729 (Enter /mnt/data/applications/G09/g09/l716.exe) 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 C C C C C C H C H H C C C C H C H C H H C C C C H C C H H C H H H H H 13 13 13 13 13 13 1 13 1 1 13 13 13 13 1 13 1 13 1 1 13 13 13 13 1 13 13 1 1 13 1 1 1 1 1 0.06307 -0.02241 0.01123 0.01684 -0.00888 -0.01062 -0.00232 0.01615 0.00056 0.00072 -0.02129 0.01766 0.01793 -0.00692 -0.00149 -0.00700 -0.00152 0.01164 0.00083 0.00083 -0.02241 0.01682 0.01122 -0.01061 -0.00231 -0.00887 0.01614 0.00056 0.00072 -0.00293 0.00316 0.00097 0.00066 -0.00235 -0.00236 70.90727 -25.19828 12.61990 18.92703 -9.97838 -11.93704 -10.35112 18.15209 2.52539 3.23302 -23.93492 19.85342 20.15569 -7.77602 -6.65178 -7.86661 -6.77497 13.08793 3.69128 3.71919 -25.18760 18.91130 12.60844 -11.93100 -10.34679 -9.97350 18.14070 2.52400 3.23031 -3.29378 14.12298 4.32990 2.96260 -10.52606 -10.53193 25.30148 -8.99137 4.50309 6.75364 -3.56053 -4.25943 -3.69354 6.47712 0.90112 1.15362 -8.54057 7.08419 7.19205 -2.77468 -2.37352 -2.80700 -2.41748 4.67010 1.31714 1.32710 -8.98756 6.74802 4.49901 -4.25728 -3.69199 -3.55879 6.47305 0.90063 1.15265 -1.17530 5.03943 1.54502 1.05713 -3.75596 -3.75806 23.65212 -8.40524 4.20954 6.31338 -3.32843 -3.98177 -3.45276 6.05489 0.84238 1.07842 -7.98383 6.62239 6.72321 -2.59380 -2.21879 -2.62402 -2.25989 4.36566 1.23128 1.24059 -8.40168 6.30813 4.20572 -3.97975 -3.45132 -3.32680 6.05109 0.84192 1.07752 -1.09869 4.71092 1.44430 0.98822 -3.51112 -3.51307 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 0.582245 -0.071173 0.119835 0.143909 -0.039056 -0.050470 -0.003328 0.149960 -0.002919 -0.002524 -0.027178 0.007478 0.008552 -0.019767 -0.001773 -0.020644 -0.001767 0.049768 -0.001380 -0.001348 -0.071131 0.143936 0.119762 -0.050450 -0.003329 -0.039039 0.149872 -0.002918 -0.002522 -0.000510 -0.000834 -0.000716 -0.000967 -0.001302 -0.001306 -0.289263 0.043148 -0.060099 -0.070314 0.022369 0.022726 -0.003741 -0.074469 0.002438 0.000430 -0.008146 0.033123 0.033311 -0.004820 0.003422 -0.003851 0.003467 -0.000244 -0.001084 -0.001093 0.043197 -0.070294 -0.060039 0.022745 -0.003798 0.022394 -0.074395 0.002450 0.000449 -0.000724 -0.000919 -0.000939 -0.000634 0.000643 0.000522 -0.292982 0.028026 -0.059736 -0.073596 0.016688 0.027744 0.007069 -0.075491 0.000481 0.002095 0.035324 -0.040601 -0.041863 0.024587 -0.001649 0.024495 -0.001699 -0.049524 0.002464 0.002441 0.027934 -0.073642 -0.059724 0.027706 0.007127 0.016645 -0.075477 0.000468 0.002073 0.001235 0.001753 0.001654 0.001601 0.000659 0.000784 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 -0.022191 0.005069 -0.006419 -0.021092 0.003519 0.004893 0.000390 -0.013302 0.000293 0.000097 -0.042070 0.066870 0.068602 -0.029420 -0.004376 -0.029063 -0.004386 0.075822 -0.000766 -0.000792 0.005027 -0.020862 -0.006367 0.004859 0.000356 0.003506 -0.013214 0.000294 0.000102 0.001609 0.000555 -0.000233 -0.000198 0.000165 0.000133 0.000942 -0.001135 -0.001549 0.012929 0.000346 -0.001105 -0.001641 -0.001430 0.000060 0.000127 -0.000041 0.012092 -0.011895 0.001303 0.000398 -0.001383 -0.000486 -0.001458 0.000558 -0.000540 0.000925 -0.012287 0.002028 0.000903 0.001596 -0.000477 0.001944 -0.000067 -0.000137 0.000042 0.000777 -0.000958 0.000430 -0.000634 0.000635 -0.000037 0.006196 0.002745 -0.000314 0.003011 0.002401 -0.005740 0.003568 0.001150 0.001820 -0.000196 0.020431 -0.020009 -0.000123 -0.000953 -0.000167 0.001053 -0.001050 -0.000671 0.000628 -0.006105 0.000252 -0.002769 -0.002410 0.005694 -0.002972 -0.003594 -0.001140 -0.001827 0.000029 0.000760 0.000529 -0.001045 -0.011254 0.011260 -0.001 0.0041 1.0 0.0254 0.9997 -0.004 0.9997 -0.0254 0.0011 -0.293 -0.2898 0.5828 -39.315 -38.892 78.208 -14.029 -13.878 27.906 -13.114 -12.973 26.087 1 C 13 0.9989 -0.045 0.0142 -0.0283 -0.3304 0.9434 0.0377 0.9428 0.3313 -0.0714 0.0259 0.0455 -9.584 3.474 6.109 -3.42 1.24 2.18 -3.197 1.159 2.038 2 C 13 0.0205 0.7436 -0.6683 0.0307 0.6677 0.7438 0.9993 -0.0357 -0.0092 -0.0627 -0.0573 0.1201 -8.42 -7.694 16.113 -3.004 -2.745 5.75 -2.808 -2.566 5.375 3 C 13 -0.0899 -0.3639 0.9271 0.0683 0.9264 0.3703 0.9936 -0.0966 0.0584 -0.0747 -0.072 0.1467 -10.028 -9.661 19.689 -3.578 -3.447 7.025 -3.345 -3.223 6.567 4 C 13 0.9984 -0.0569 -0.0031 -0.0193 -0.3888 0.9211 0.0536 0.9196 0.3893 -0.0393 0.0154 0.0238 -5.268 2.068 3.2 -1.88 0.738 1.142 -1.757 0.69 1.067 5 C 13 0.9976 -0.0669 0.0161 0.068 0.9228 -0.3792 0.0105 0.3794 0.9252 -0.0508 0.0221 0.0287 -6.819 2.966 3.853 -2.433 1.058 1.375 -2.275 0.989 1.285 6 C 13 0.1057 0.9084 0.4045 0.9864 -0.1473 0.0731 -0.126 -0.3912 0.9116 -0.0063 -0.0035 0.0098 -3.335 -1.872 5.207 -1.19 -0.668 1.858 -1.113 -0.624 1.737 7 H 1 -0.0358 -0.6935 0.7196 0.0475 0.718 0.6944 0.9982 -0.0591 -0.0072 -0.0789 -0.0719 0.1508 -10.582 -9.648 20.23 -3.776 -3.443 7.219 -3.53 -3.218 6.748 8 C 13 0.9985 -0.0546 9.0E-4 -0.0237 -0.4172 0.9085 0.0492 0.9072 0.4179 -0.0029 0.0 0.003 -1.566 -0.026 1.592 -0.559 -0.009 0.568 -0.522 -0.009 0.531 9 H 1 0.9996 -0.0211 -0.0192 0.0074 0.8412 -0.5406 0.0275 0.5403 0.8411 -0.0025 -7.0E-4 0.0033 -1.349 -0.394 1.744 -0.481 -0.141 0.622 -0.45 -0.132 0.582 10 H 1 0.7812 0.6243 0.0016 -0.6242 0.7811 0.0129 0.0068 -0.0111 0.9999 -0.0608 0.0255 0.0353 -8.158 3.418 4.74 -2.911 1.22 1.691 -2.721 1.14 1.581 11 C 13 -0.5832 0.6018 -0.5457 -0.5203 0.2392 0.8198 0.6239 0.762 0.1736 -0.0502 -0.0423 0.0925 -6.738 -5.678 12.416 -2.404 -2.026 4.43 -2.247 -1.894 4.141 12 C 13 -0.5816 0.6017 0.5475 0.5158 -0.2476 0.8202 0.629 0.7594 -0.1663 -0.0512 -0.0433 0.0945 -6.873 -5.811 12.683 -2.452 -2.073 4.526 -2.292 -1.938 4.231 13 C 13 0.7894 0.6137 -0.0142 -0.6068 0.7836 0.1334 0.093 -0.0967 0.991 -0.0427 0.0179 0.0247 -5.725 2.407 3.317 -2.043 0.859 1.184 -1.91 0.803 1.107 14 C 13 0.8654 0.4985 0.0498 -0.1087 0.0899 0.99 -0.4891 0.8622 -0.132 -0.0043 -0.0018 0.006 -2.279 -0.949 3.228 -0.813 -0.339 1.152 -0.76 -0.317 1.077 15 H 1 0.7992 0.6008 0.018 -0.596 0.796 -0.1054 -0.0776 0.0735 0.9943 -0.0425 0.0179 0.0246 -5.706 2.406 3.3 -2.036 0.859 1.177 -1.903 0.803 1.101 16 C 13 0.8667 0.4973 -0.0398 0.1069 -0.1072 0.9885 -0.4873 0.8609 0.1461 -0.0043 -0.0019 0.0061 -2.274 -0.996 3.269 -0.811 -0.355 1.167 -0.758 -0.332 1.091 17 H 1 -0.586 0.8103 -7.0E-4 0.0091 0.0074 0.9999 0.8103 0.586 -0.0117 -0.0551 -0.0495 0.1046 -7.391 -6.648 14.039 -2.637 -2.372 5.01 -2.465 -2.218 4.683 18 C 13 0.7714 0.6364 -7.0E-4 -0.6132 0.7437 0.2664 0.17 -0.205 0.9639 -0.002 -7.0E-4 0.0027 -1.074 -0.37 1.443 -0.383 -0.132 0.515 -0.358 -0.123 0.481 19 H 1 0.7615 0.6482 9.0E-4 -0.6258 0.7355 -0.2596 -0.1689 0.1971 0.9657 -0.002 -6.0E-4 0.0027 -1.079 -0.342 1.421 -0.385 -0.122 0.507 -0.36 -0.114 0.474 20 H 1 0.9989 -0.0445 -0.012 0.0259 0.3253 0.9452 0.0381 0.9446 -0.3261 -0.0714 0.0259 0.0455 -9.577 3.47 6.107 -3.417 1.238 2.179 -3.194 1.157 2.037 21 C 13 0.0863 0.3567 0.9302 0.0692 0.9293 -0.3627 0.9939 -0.0956 -0.0555 -0.0747 -0.0719 0.1466 -10.022 -9.654 19.676 -3.576 -3.445 7.021 -3.343 -3.22 6.563 22 C 13 0.0183 0.7398 0.6726 -0.0326 -0.6719 0.7399 0.9993 -0.0355 0.0118 -0.0627 -0.0573 0.12 -8.416 -7.689 16.105 -3.003 -2.744 5.746 -2.807 -2.565 5.372 23 C 13 0.9977 -0.0664 -0.0135 0.0665 0.9208 0.3844 -0.0131 -0.3844 0.9231 -0.0508 0.0221 0.0287 -6.815 2.964 3.851 -2.432 1.058 1.374 -2.273 0.989 1.284 24 C 13 0.1072 0.9102 -0.4 0.9867 -0.1468 -0.0696 0.122 0.3872 0.9139 -0.0063 -0.0035 0.0098 -3.339 -1.865 5.204 -1.191 -0.665 1.857 -1.114 -0.622 1.736 25 H 1 0.9984 -0.0565 0.0055 0.0166 0.3839 0.9232 0.0543 0.9216 -0.3843 -0.0392 0.0154 0.0238 -5.266 2.067 3.199 -1.879 0.737 1.142 -1.756 0.689 1.067 26 C 13 0.0337 0.6895 0.7235 0.0491 0.7219 -0.6903 0.9982 -0.0588 0.0095 -0.0788 -0.0719 0.1507 -10.576 -9.642 20.218 -3.774 -3.441 7.214 -3.528 -3.216 6.744 27 C 13 0.9985 -0.0543 0.0014 0.0212 0.4127 0.9106 0.05 0.9092 -0.4132 -0.0029 0.0 0.003 -1.566 -0.026 1.592 -0.559 -0.009 0.568 -0.522 -0.009 0.531 28 H 1 0.9995 -0.021 0.0214 0.006 0.8383 0.5452 -0.0294 -0.5448 0.8381 -0.0025 -7.0E-4 0.0033 -1.348 -0.394 1.742 -0.481 -0.14 0.622 -0.45 -0.131 0.581 29 H 1 -0.6833 0.7301 0.0021 0.7152 0.6698 -0.1996 0.1472 0.1349 0.9799 -0.0022 0.001 0.0012 -0.299 0.132 0.167 -0.107 0.047 0.06 -0.1 0.044 0.056 30 C 13 -0.6691 0.7431 -0.0141 0.6869 0.611 -0.3934 0.2837 0.2729 0.9192 -0.0014 -8.0E-4 0.0022 -0.765 -0.419 1.184 -0.273 -0.149 0.422 -0.255 -0.14 0.395 31 H 1 0.7347 0.6662 0.1279 -0.5928 0.7221 -0.3566 -0.33 0.1862 0.9254 -0.0011 -0.001 0.0021 -0.584 -0.538 1.122 -0.208 -0.192 0.4 -0.195 -0.179 0.374 32 H 1 0.654 0.7343 0.1819 0.7409 -0.573 -0.3505 0.1532 -0.3639 0.9188 -0.0011 -0.001 0.0021 -0.571 -0.543 1.113 -0.204 -0.194 0.397 -0.19 -0.181 0.371 33 H 1 0.0356 0.7063 0.707 0.9985 -0.0554 0.005 -0.0427 -0.7058 0.7072 -0.0106 -0.0013 0.0119 -5.664 -0.701 6.365 -2.021 -0.25 2.271 -1.889 -0.234 2.123 34 H 1 PT10786.600S 2024-05-23T09:55:38.000 -10.19522 -10.19516 -10.19512 -10.19491 -10.19422 -10.19422 -10.19347 -10.19346 -10.19337 -10.19335 -10.19060 -10.19051 -10.19039 -10.19039 -10.18282 -0.89527 -0.86104 -0.84410 -0.80990 -0.78303 -0.76009 -0.75086 -0.74300 -0.71435 -0.70666 -0.66636 -0.63127 -0.61243 -0.59665 -0.58786 -0.57272 -0.56239 -0.51988 -0.49893 -0.49674 -0.46732 -0.46593 -0.45574 -0.44494 -0.44249 -0.42787 -0.42179 -0.41985 -0.41837 -0.41390 -0.40817 -0.40250 -0.38482 -0.36814 -0.36556 -0.35803 -0.35344 -0.34798 -0.34432 -0.33087 -0.32775 -0.30955 -0.28698 -0.25739 -0.25640 -0.24794 -0.21733 -0.17687 -0.03181 -0.01290 -0.00805 -0.00072 0.03434 0.04838 0.09858 0.10686 0.10712 0.12545 0.13085 0.13611 0.13921 0.15738 0.16076 0.16372 0.17338 0.17724 0.18505 0.18792 0.19428 0.20285 0.20954 0.21996 0.22534 0.24560 0.25584 0.25796 0.27446 0.27674 0.29445 0.30795 0.31313 0.32150 0.32821 0.36315 0.37045 0.37888 0.39343 0.41014 0.41895 0.48099 0.48303 0.49729 0.50269 0.51310 0.51653 0.52330 0.53128 0.53741 0.53858 0.55458 0.55529 0.56051 0.56449 0.56890 0.57541 0.57624 0.57921 0.58717 0.59271 0.59653 0.60036 0.60633 0.61055 0.61103 0.61299 0.62135 0.63141 0.63506 0.63576 0.64229 0.64356 0.64467 0.65591 0.68592 0.69487 0.70274 0.71504 0.73183 0.74224 0.74991 0.76711 0.78662 0.79708 0.80210 0.80749 0.82941 0.83604 0.83990 0.84136 0.85382 0.85626 0.86251 0.86635 0.87731 0.88349 0.89774 0.90476 0.90956 0.91222 0.91571 0.91842 0.94703 0.95782 0.97042 0.97713 0.98194 0.99558 1.00050 1.00762 1.01954 1.03183 1.06083 1.07645 1.08403 1.10022 1.11260 1.13645 1.13857 1.17432 1.18630 1.19002 1.20010 1.20509 1.22543 1.23999 1.24778 1.26100 1.27172 1.32369 1.33090 1.34356 1.35754 1.39007 1.40074 1.42596 1.43664 1.44432 1.44638 1.44919 1.45023 1.46985 1.47217 1.47503 1.48639 1.49208 1.49505 1.49648 1.51873 1.56914 1.57159 1.59437 1.60758 1.65985 1.68572 1.74934 1.76946 1.76994 1.77924 1.79827 1.79959 1.83013 1.83752 1.85182 1.85567 1.87839 1.90102 1.90702 1.91404 1.91532 1.92380 1.92572 1.94683 1.97434 1.97515 1.97793 1.99170 2.00375 2.03350 2.03946 2.07073 2.08786 2.09538 2.10766 2.12819 2.13416 2.14552 2.15759 2.17672 2.19220 2.20565 2.20816 2.22910 2.23781 2.24610 2.25125 2.27009 2.27160 2.29014 2.29371 2.31745 2.32486 2.34111 2.35397 2.37331 2.40263 2.40750 2.42849 2.44204 2.50377 2.53038 2.54041 2.59373 2.60807 2.63599 2.63686 2.64326 2.65642 2.66957 2.67305 2.68484 2.69533 2.71094 2.74483 2.75806 2.78342 2.78897 2.81379 2.84779 2.86925 2.86992 2.93141 2.94657 2.98128 3.00217 3.14540 3.17645 3.31953 3.34987 3.42846 3.50818 4.06871 4.08297 4.08811 4.09435 4.09840 4.11945 4.13258 4.14272 4.16765 4.19796 4.25256 4.30414 4.33521 4.34991 4.39907 4.43522 4.49261 4.67286 4.81445 4.81555 -10.20559 -10.20497 -10.20210 -10.19496 -10.19494 -10.19428 -10.19425 -10.19378 -10.19372 -10.19346 -10.19327 -10.19326 -10.19315 -10.19216 -10.19216 -10.19119 -10.19112 -10.19112 -10.19111 -10.18290 -0.89066 -0.85931 -0.84222 -0.80466 -0.78039 -0.75756 -0.74916 -0.74081 -0.71405 -0.70289 -0.66066 -0.62993 -0.61092 -0.59454 -0.58621 -0.57081 -0.56010 -0.51842 -0.49614 -0.49581 -0.46613 -0.46430 -0.45493 -0.44356 -0.44148 -0.42581 -0.42052 -0.41903 -0.41698 -0.41177 -0.40101 -0.39949 -0.38406 -0.36658 -0.36304 -0.35276 -0.35108 -0.34631 -0.34374 -0.32922 -0.32657 -0.29395 -0.27712 -0.25421 -0.24769 -0.24258 -0.21709 -0.10981 -0.02724 -0.00801 -0.00487 0.00659 0.04240 0.06556 0.09935 0.10699 0.10803 0.12604 0.13266 0.13643 0.14029 0.16058 0.16231 0.16741 0.17399 0.17800 0.18650 0.19281 0.19716 0.20468 0.21061 0.22403 0.22682 0.24825 0.26007 0.26076 0.27751 0.27979 0.29486 0.30897 0.31492 0.32232 0.32896 0.36449 0.37746 0.37995 0.39566 0.41184 0.42185 0.48410 0.48601 0.49884 0.50426 0.51509 0.51745 0.52492 0.53426 0.54058 0.54346 0.55623 0.55697 0.56254 0.56739 0.57014 0.57660 0.57952 0.58180 0.58884 0.59510 0.59753 0.60277 0.60809 0.61207 0.61372 0.61405 0.62313 0.63195 0.63603 0.63922 0.64420 0.64490 0.64988 0.65816 0.68828 0.69819 0.70475 0.71783 0.73308 0.74389 0.75271 0.77670 0.78991 0.79906 0.80549 0.80772 0.83071 0.83649 0.84053 0.84210 0.85553 0.85761 0.86257 0.86744 0.87786 0.88508 0.89842 0.90553 0.90989 0.91630 0.91768 0.91919 0.94940 0.95840 0.97307 0.97899 0.98301 0.99919 1.00149 1.00977 1.02219 1.03278 1.06239 1.07794 1.08533 1.10313 1.11404 1.13752 1.13977 1.17588 1.18726 1.19207 1.20151 1.20716 1.22674 1.24189 1.25053 1.26484 1.27435 1.32847 1.33507 1.34485 1.36363 1.39179 1.40252 1.42720 1.43795 1.44597 1.44817 1.45276 1.45330 1.47211 1.47453 1.47733 1.48777 1.49348 1.49961 1.49994 1.52029 1.57242 1.57462 1.59788 1.61407 1.66481 1.69009 1.75680 1.77112 1.77264 1.78292 1.79975 1.80106 1.83116 1.83933 1.85366 1.85796 1.88278 1.90244 1.90798 1.91451 1.91682 1.92543 1.92948 1.95144 1.97827 1.98213 1.98643 1.99379 2.00580 2.03442 2.03990 2.07208 2.09070 2.09855 2.10960 2.13002 2.13583 2.14834 2.15959 2.17954 2.19459 2.20724 2.21161 2.23098 2.24284 2.24841 2.25724 2.27111 2.27502 2.29211 2.29679 2.31925 2.32509 2.34216 2.35456 2.38052 2.40845 2.41112 2.44160 2.44616 2.50957 2.53682 2.54254 2.59634 2.60969 2.63861 2.63934 2.64555 2.65929 2.67367 2.67483 2.68778 2.69773 2.71151 2.74528 2.75886 2.78446 2.79199 2.81480 2.84867 2.87087 2.87124 2.93919 2.94823 2.98396 3.00369 3.14722 3.17909 3.32084 3.35076 3.42955 3.50918 4.07169 4.08588 4.08982 4.09638 4.10045 4.12023 4.13462 4.14441 4.16740 4.20414 4.25302 4.30601 4.33635 4.35119 4.40030 4.43753 4.49655 4.67413 4.81756 4.81913 1.13630887e-02 1.68044480e-02 6.10026037e-01 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 0.0289 0.0427 1.5505 1.5514 -119.2447 -102.2320 -92.5856 -2.4536 0.1415 0.2314 -14.5573 2.4554 12.1018 -2.4536 0.1415 0.2314 -0.3416 -0.3704 24.4189 0.4233 0.5026 15.3648 0.9118 1.2119 -11.1695 -11.9086 -237.9702 -2350.9007 -4856.6559 -12.8083 -2.0827 13.5500 -2.5431 3.8499 6.3463 -508.7738 -989.5370 -1243.1253 2.9926 2.3151 -26.4812 0 -771.2039353 0.772944 0. 0.750499 4.83E-9 1.31E-5 -10.8229776,1.8255669,8.9974107,-1.824214,0.1052358,0.1720294 C01 [X(C20H15)] 0.0113631 0.0168044 0.610026 0.000002595 0.000001003 -0.000006682 0.000005361 -0.000008477 0.000034807 0.000001656 -0.000000193 0.000014278 0.000004840 0.000044066 -0.000015449 0.000003723 -0.000000851 -0.000035851 -0.000001176 -0.000044298 0.000004618 -0.000000535 -0.000013614 0.000002403 0.000004517 0.000017954 0.000012466 -0.000000605 -0.000006173 0.000008601 0.000005360 0.000009726 -0.000006648 0.000002355 -0.000002167 -0.000027997 -0.000003183 0.000013396 0.000011527 -0.000000563 -0.000012335 0.000005565 0.000000612 0.000005512 -0.000010480 -0.000002297 -0.000004769 0.000004871 -0.000004938 -0.000003377 -0.000005379 0.000003180 0.000005651 0.000005816 0.000009256 -0.000002451 0.000004464 -0.000002304 -0.000000151 0.000001131 0.000002200 0.000000442 0.000000828 -0.000008531 0.000008655 0.000032325 -0.000004668 -0.000044024 -0.000015863 -0.000002019 -0.000000623 0.000015105 0.000000958 0.000044074 0.000006097 0.000000024 0.000013086 0.000003164 -0.000002807 0.000001947 -0.000035778 -0.000004505 -0.000018882 0.000011667 -0.000000092 0.000006144 0.000008388 -0.000005071 -0.000009720 -0.000007062 -0.000000238 -0.000005407 -0.000002661 -0.000004169 0.000006715 -0.000002108 -0.000002933 -0.000003270 -0.000000256 0.000004202 0.000002493 -0.000002339 -0.000003413 0.000006679 -0.000006840 0.000003209 -0.000006758 -0.000006729 240.21399999999988 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0013,-.0019,-.0944;-.0369,-1.1644,-.96;-.0257,-.727,-2.3211;-.1424,-2.535,-.6742;-.0819,-1.6439,-3.3637;-.1942,-3.4483,-1.73;-.1983,-2.8856,.3513;-.1581,-3.0116,-3.0622;-.0743,-1.3096,-4.3981;-.2708,-4.5106,-1.5153;-.0023,-.005,1.3605;-.7376,.9516,2.0954;.7286,-.9657,2.0929;-.7403,.9414,3.486;-1.3438,1.6791,1.565;.7259,-.9626,3.4844;1.3308,-1.6957,1.5615;-.0059,-.0108,4.21;-1.3308,1.6806,4.0226;1.3081,-1.7092,4.0194;.0361,1.1651,-.9537;.1402,2.5342,-.6603;.0285,.735,-2.3172;.1944,3.4532,-1.7111;.1928,2.8794,.3672;.0872,1.6574,-3.3547;.1621,3.0235,-3.0457;.0825,1.3287,-4.3909;.2698,4.5144,-1.4904;.0158,.0084,5.7189;.7727,.7119,6.091;-.9489,.3258,6.1291;.2568,-.9775,6.1296;.2067,3.7545,-3.8481;-.2008,-3.7382,-3.8687; Gaussian 09 GINC-KIMIK2210 EGARCIAP Opt freq EM64L-G09RevD.01 UB3LYP 6-31G(d) Freq #P Geom=AllCheck Guess=TCheck SCRF=Check GenChk UB3LYP/6-31G(d) Freq 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 240.21399999999988 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0013,-.0019,-.0944;-.0369,-1.1644,-.96;-.0257,-.727,-2.3211;-.1424,-2.535,-.6742;-.0819,-1.6439,-3.3637;-.1942,-3.4483,-1.73;-.1983,-2.8856,.3513;-.1581,-3.0116,-3.0622;-.0743,-1.3096,-4.3981;-.2708,-4.5106,-1.5153;-.0023,-.005,1.3605;-.7376,.9516,2.0954;.7286,-.9657,2.0929;-.7403,.9414,3.486;-1.3438,1.6791,1.565;.7259,-.9626,3.4844;1.3308,-1.6957,1.5615;-.0059,-.0108,4.21;-1.3308,1.6806,4.0226;1.3081,-1.7092,4.0194;.0361,1.1651,-.9537;.1402,2.5342,-.6603;.0285,.735,-2.3172;.1944,3.4532,-1.7111;.1928,2.8794,.3672;.0872,1.6574,-3.3547;.1621,3.0235,-3.0457;.0825,1.3287,-4.3909;.2698,4.5144,-1.4904;.0158,.0084,5.7189;.7727,.7119,6.091;-.9489,.3258,6.1291;.2568,-.9775,6.1296;.2067,3.7545,-3.8481;-.2008,-3.7382,-3.8687; Opt freq Redundant internal coordinates found in file. 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 12 12 12 12 12 12 1 12 1 1 12 12 12 12 1 12 1 12 1 1 12 12 12 12 1 12 12 1 1 12 1 1 1 1 1 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 1.0078250 12.0000000 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 12.0000000 1.0078250 12.0000000 12.0000000 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 1.0078250 1.0078250 0 0 0 0 0 0 1 0 1 1 0 0 0 0 1 0 1 0 1 1 0 0 0 0 1 0 0 1 1 0 1 1 1 1 1 -3.6000000 -3.6000000 -3.6000000 -3.6000000 -3.6000000 -3.6000000 -1.0000000 -3.6000000 -1.0000000 -1.0000000 -3.6000000 -3.6000000 -3.6000000 -3.6000000 -1.0000000 -3.6000000 -1.0000000 -3.6000000 -1.0000000 -1.0000000 -3.6000000 -3.6000000 -3.6000000 -3.6000000 -1.0000000 -3.6000000 -3.6000000 -1.0000000 -1.0000000 -3.6000000 -1.0000000 -1.0000000 -1.0000000 -1.0000000 -1.0000000 (Enter /mnt/data/applications/G09/g09/l101.exe) Structure from the checkpoint file: "/scratch/Gau-195836.chk" Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 1 1 1 2 2 3 3 4 4 5 5 6 6 8 11 11 12 12 13 13 14 14 16 16 18 21 21 22 22 23 24 24 26 26 27 30 30 30 2 11 21 3 4 5 23 6 7 8 9 8 10 35 12 13 14 15 16 17 18 19 18 20 30 22 23 24 25 26 27 29 27 28 34 31 32 33 1.4498 1.4549 1.4498 1.4297 1.404 1.3895 1.463 1.3969 1.0852 1.4026 1.0871 1.4024 1.0865 1.0864 1.4127 1.412 1.3907 1.0853 1.3915 1.0853 1.4037 1.0876 1.4028 1.0875 1.5091 1.404 1.4297 1.3969 1.0853 1.3895 1.4024 1.0865 1.4026 1.087 1.0864 1.0983 1.0954 1.0948 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 2 2 11 1 1 3 2 2 5 2 2 6 3 3 8 4 4 8 5 5 6 1 1 12 11 11 14 11 11 16 12 12 18 13 13 18 14 14 16 1 1 22 21 21 24 3 3 21 22 22 27 23 23 27 24 24 26 18 18 18 31 31 32 1 1 1 2 2 2 3 3 3 4 4 4 5 5 5 6 6 6 8 8 8 11 11 11 12 12 12 13 13 13 14 14 14 16 16 16 18 18 18 21 21 21 22 22 22 23 23 23 24 24 24 26 26 26 27 27 27 30 30 30 30 30 30 11 21 21 3 4 4 5 23 23 6 7 7 8 9 9 8 10 10 6 35 35 12 13 13 14 15 15 16 17 17 18 19 19 18 20 20 16 30 30 22 23 23 24 25 25 21 26 26 27 29 29 27 28 28 26 34 34 31 32 33 32 33 33 126.537 106.9925 126.4705 108.836 131.5346 119.5394 120.805 107.6659 131.5217 119.1547 120.7685 120.0707 118.9666 120.7163 120.3156 120.8882 119.5017 119.6085 120.6167 119.6531 119.7266 121.2714 121.3188 117.4096 121.079 119.362 119.5059 121.074 119.3982 119.49 121.3132 119.3048 119.3796 121.3207 119.2982 119.3799 117.8011 120.9723 121.2155 131.5303 108.8384 119.5418 119.1537 120.7693 120.0711 107.6642 131.5241 120.8045 120.8881 119.5018 119.6086 118.9668 120.7164 120.3154 120.6163 119.727 119.6532 110.9027 111.4349 111.5203 107.1243 107.3416 108.3158 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 11 11 21 21 2 2 21 21 2 2 11 11 1 1 4 4 1 1 3 3 2 2 23 23 2 2 5 5 2 2 7 7 3 3 9 9 4 4 10 10 1 1 13 13 1 1 12 12 11 11 15 15 11 11 17 17 12 12 19 19 13 13 20 20 14 14 14 16 16 16 1 1 23 23 1 1 22 22 21 21 25 25 3 3 21 21 22 22 29 29 23 23 28 28 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 4 4 4 4 5 5 5 5 6 6 6 6 11 11 11 11 11 11 11 11 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 21 21 21 21 21 21 21 21 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 26 2 2 2 2 11 11 11 11 21 21 21 21 3 3 3 3 4 4 4 4 5 5 5 5 23 23 23 23 6 6 6 6 8 8 8 8 8 8 8 8 12 12 12 12 13 13 13 13 14 14 14 14 16 16 16 16 18 18 18 18 18 18 18 18 30 30 30 30 30 30 22 22 22 22 23 23 23 23 24 24 24 24 26 26 26 26 27 27 27 27 27 27 27 27 3 4 3 4 12 13 12 13 22 23 22 23 5 23 5 23 6 7 6 7 8 9 8 9 21 26 21 26 8 10 8 10 6 35 6 35 5 35 5 35 14 15 14 15 16 17 16 17 18 19 18 19 18 20 18 20 16 30 16 30 14 30 14 30 31 32 33 31 32 33 24 25 24 25 3 26 3 26 27 29 27 29 27 28 27 28 26 34 26 34 24 34 24 34 179.8667 3.4235 -0.1611 -176.6043 -140.7359 39.1028 39.2972 -140.8641 -176.6478 -0.1949 3.3244 179.7773 -178.6723 0.4462 -1.7321 177.3864 178.0296 -1.0712 1.8994 -177.2015 0.37 179.9343 -178.508 1.0562 -0.5633 178.4411 178.4253 -2.5703 -0.7584 179.6905 178.3488 -1.2023 0.7994 -179.8947 -178.7667 0.5393 -0.6143 -179.9198 178.9364 -0.3691 179.7155 2.3786 -0.1292 -177.4662 179.8943 2.14 -0.261 -178.0152 0.5133 -178.918 177.8464 -1.5849 0.2792 -179.3181 178.0314 -1.5659 -0.4893 178.3134 178.9416 -2.2556 0.0964 -178.7033 179.6934 0.8937 -84.061 35.1843 156.3633 94.7007 -146.054 -24.875 178.0313 -1.0856 1.8904 -177.2265 0.4672 -178.665 177.4156 -1.7166 -0.7619 179.686 178.3613 -1.1909 -178.5346 1.0353 0.3609 179.9309 -0.6042 -179.9161 178.9474 -0.3645 0.7957 -179.8919 -178.776 0.5364 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically 3.00e-01 1.00e-07 1.00e-07 2 2 Berny optimization. local minimum Step number 1 out of a maximum of 2 All quantities printed in internal units (Hartrees-Bohrs-Radians) Second derivative matrix not updated -- analytic derivatives used. 0.00021 0.00982 0.01036 0.01273 0.01381 0.01557 0.01651 0.01672 0.01701 0.01709 0.01804 0.01810 0.02003 0.02067 0.02081 0.02149 0.02168 0.02361 0.02388 0.02447 0.02554 0.02603 0.02637 0.02676 0.02696 0.02737 0.02742 0.02882 0.02940 0.02951 0.05844 0.06070 0.11054 0.11238 0.11441 0.11825 0.11855 0.12185 0.12304 0.12478 0.12510 0.12517 0.12554 0.12674 0.13223 0.14822 0.15021 0.15836 0.17099 0.17762 0.18417 0.18916 0.19075 0.19288 0.19289 0.19420 0.19890 0.20020 0.20162 0.21681 0.23088 0.26558 0.27964 0.29384 0.29949 0.31156 0.31511 0.33149 0.33224 0.33999 0.34476 0.34871 0.35385 0.35704 0.35911 0.35935 0.35975 0.36093 0.36142 0.36219 0.36223 0.36318 0.36411 0.36932 0.38933 0.40448 0.40906 0.41435 0.42636 0.43658 0.44019 0.44238 0.45074 0.45483 0.46212 0.46331 0.50321 0.50378 0.50752 Angle between quadratic step and forces= 81.63 degrees. 1 2 3 0.00490171 0.00004885 0.00000000 0.00004723 0.00000002 0.00000002 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 2.73968 2.74944 2.73972 2.70180 2.65327 2.62585 2.76465 2.63983 2.05079 2.65059 2.05423 2.65017 2.05315 2.05299 2.66969 2.66824 2.62802 2.05098 2.62955 2.05091 2.65258 2.05527 2.65093 2.05509 2.85187 2.65325 2.70172 2.63984 2.05083 2.62586 2.65017 2.05315 2.65059 2.05422 2.05299 2.07549 2.06992 2.06894 2.20849 1.86737 2.20733 1.89955 2.29571 2.08636 2.10845 1.87912 2.29549 2.07964 2.10781 2.09563 2.07636 2.10690 2.09990 2.10990 2.08570 2.08756 2.10516 2.08834 2.08962 2.11659 2.11741 2.04918 2.11323 2.08326 2.08577 2.11314 2.08389 2.08549 2.11731 2.08226 2.08357 2.11744 2.08215 2.08357 2.05602 2.11137 2.11561 2.29564 1.89959 2.08640 2.07962 2.10782 2.09564 1.87910 2.29553 2.10844 2.10989 2.08570 2.08756 2.07636 2.10690 2.09990 2.10515 2.08963 2.08834 1.93562 1.94491 1.94640 1.86967 1.87346 1.89047 3.13927 0.05975 -0.00281 -3.08233 -2.45630 0.68247 0.68587 -2.45854 -3.08309 -0.00340 0.05802 3.13771 -3.11842 0.00779 -0.03023 3.09598 3.10720 -0.01870 0.03315 -3.09275 0.00646 3.14045 -3.11555 0.01843 -0.00983 3.11438 3.11411 -0.04486 -0.01324 3.13619 3.11277 -0.02098 0.01395 -3.13975 -3.12007 0.00941 -0.01072 -3.14019 3.12303 -0.00644 3.13663 0.04151 -0.00226 -3.09737 3.13975 0.03735 -0.00455 -3.10695 0.00896 -3.12271 3.10401 -0.02766 0.00487 -3.12969 3.10723 -0.02733 -0.00854 3.11216 3.12312 -0.03937 0.00168 -3.11896 3.13624 0.01560 -1.46714 0.61408 2.72905 1.65284 -2.54912 -0.43415 3.10723 -0.01895 0.03299 -3.09319 0.00815 -3.11829 3.09649 -0.02996 -0.01330 3.13611 3.11299 -0.02078 -3.11602 0.01807 0.00630 3.14039 -0.01055 -3.14013 3.12322 -0.00636 0.01389 -3.13971 -3.12023 0.00936 0.00000 -0.00002 0.00000 0.00001 -0.00001 0.00002 0.00000 0.00002 0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00001 0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 -0.00001 0.00001 0.00002 0.00001 0.00002 0.00000 -0.00001 0.00000 -0.00001 0.00001 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00001 -0.00001 0.00002 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00001 -0.00002 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00001 0.00000 0.00002 -0.00001 -0.00001 0.00001 0.00001 -0.00002 0.00000 -0.00001 0.00001 -0.00001 0.00001 0.00000 -0.00001 0.00001 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 0.00000 0.00000 0.00001 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 -0.00008 0.00003 0.00002 -0.00003 0.00004 -0.00002 0.00005 0.00002 -0.00001 -0.00003 0.00000 -0.00004 0.00003 0.00021 -0.00011 -0.00022 -0.00002 0.00016 -0.00002 0.00020 0.00002 -0.00019 -0.00002 -0.00003 -0.00002 0.00002 0.00004 0.00002 0.00004 0.00000 -0.00004 -0.00002 -0.00003 0.00003 -0.00003 0.00015 -0.00012 -0.00002 0.00003 -0.00001 -0.00003 0.00012 -0.00009 0.00007 0.00002 -0.00009 0.00007 0.00009 -0.00016 -0.00004 0.00004 0.00000 -0.00004 0.00004 0.00000 0.00003 -0.00001 -0.00002 -0.00004 0.00008 -0.00005 0.00002 -0.00001 -0.00001 0.00002 0.00006 -0.00009 0.00001 0.00004 -0.00005 0.00000 -0.00004 0.00004 0.00000 -0.00059 0.00060 0.00012 -0.00003 -0.00009 0.00008 0.00009 -0.00017 0.00002 -0.00008 0.00007 -0.00005 0.00005 0.00000 -0.00004 0.00004 0.00000 0.00003 -0.00002 -0.00001 0.00003 -0.00025 0.00019 -0.00042 0.00054 -0.00009 -0.00003 0.00003 0.00002 0.00009 -0.00059 -0.00054 -0.00065 -0.00061 0.00012 0.00002 0.00017 0.00008 -0.00007 -0.00006 -0.00011 -0.00011 0.00005 0.00007 0.00011 0.00014 0.00003 0.00000 0.00003 -0.00001 0.00008 0.00007 0.00008 0.00008 -0.00003 -0.00004 -0.00006 -0.00007 0.00005 0.00002 0.00009 0.00006 -0.00005 -0.00002 -0.00004 -0.00001 0.00009 0.00014 0.00005 0.00010 -0.00004 0.00018 0.00000 0.00022 -0.00008 -0.00001 -0.00012 -0.00006 -0.00003 0.00008 -0.00025 -0.00014 0.00005 0.00048 -0.00002 0.00042 0.00001 -0.00041 -0.00010 -0.00052 0.02135 0.02068 0.02052 0.02179 0.02112 0.02096 0.00002 0.00005 0.00012 0.00015 -0.00006 -0.00005 -0.00013 -0.00013 -0.00004 -0.00004 -0.00006 -0.00006 0.00005 0.00002 0.00004 0.00001 -0.00006 -0.00003 -0.00005 -0.00002 0.00005 0.00002 0.00008 0.00005 0.00002 -0.00008 0.00003 0.00002 -0.00003 0.00004 -0.00002 0.00005 0.00002 -0.00001 -0.00003 0.00000 -0.00004 0.00003 0.00021 -0.00011 -0.00022 -0.00002 0.00016 -0.00002 0.00020 0.00002 -0.00019 -0.00002 -0.00003 -0.00002 0.00002 0.00004 0.00002 0.00004 0.00000 -0.00004 -0.00002 -0.00003 0.00003 -0.00003 0.00015 -0.00012 -0.00002 0.00003 -0.00001 -0.00003 0.00012 -0.00009 0.00007 0.00002 -0.00009 0.00007 0.00009 -0.00016 -0.00004 0.00004 0.00000 -0.00004 0.00004 0.00000 0.00003 -0.00001 -0.00002 -0.00004 0.00008 -0.00005 0.00002 -0.00001 -0.00001 0.00002 0.00006 -0.00009 0.00001 0.00004 -0.00005 0.00000 -0.00004 0.00004 0.00000 -0.00059 0.00060 0.00012 -0.00003 -0.00009 0.00008 0.00009 -0.00017 0.00002 -0.00008 0.00007 -0.00005 0.00005 0.00000 -0.00004 0.00004 0.00000 0.00003 -0.00002 -0.00001 0.00003 -0.00025 0.00019 -0.00042 0.00054 -0.00009 -0.00003 0.00003 0.00002 0.00009 -0.00059 -0.00054 -0.00065 -0.00061 0.00012 0.00002 0.00017 0.00008 -0.00007 -0.00006 -0.00011 -0.00011 0.00005 0.00007 0.00011 0.00014 0.00003 0.00000 0.00003 -0.00001 0.00008 0.00007 0.00008 0.00008 -0.00003 -0.00004 -0.00006 -0.00007 0.00005 0.00002 0.00009 0.00006 -0.00005 -0.00002 -0.00004 -0.00001 0.00009 0.00014 0.00005 0.00010 -0.00004 0.00018 0.00000 0.00022 -0.00008 -0.00001 -0.00012 -0.00006 -0.00003 0.00008 -0.00025 -0.00014 0.00005 0.00048 -0.00002 0.00042 0.00001 -0.00041 -0.00010 -0.00052 0.02135 0.02068 0.02052 0.02179 0.02112 0.02096 0.00002 0.00005 0.00012 0.00015 -0.00006 -0.00005 -0.00013 -0.00013 -0.00004 -0.00004 -0.00006 -0.00006 0.00005 0.00002 0.00004 0.00001 -0.00006 -0.00003 -0.00005 -0.00002 0.00005 0.00002 0.00008 0.00005 2.73970 2.74935 2.73974 2.70182 2.65324 2.62588 2.76464 2.63988 2.05081 2.65058 2.05420 2.65017 2.05312 2.05302 2.66990 2.66813 2.62780 2.05096 2.62972 2.05089 2.65278 2.05530 2.65073 2.05507 2.85185 2.65323 2.70174 2.63989 2.05085 2.62590 2.65018 2.05312 2.65057 2.05419 2.05302 2.07545 2.07007 2.06882 2.20847 1.86740 2.20731 1.89952 2.29583 2.08627 2.10851 1.87914 2.29540 2.07972 2.10790 2.09547 2.07632 2.10693 2.09991 2.10985 2.08574 2.08756 2.10518 2.08833 2.08961 2.11655 2.11749 2.04914 2.11324 2.08325 2.08576 2.11316 2.08395 2.08541 2.11733 2.08230 2.08351 2.11745 2.08210 2.08361 2.05601 2.11078 2.11621 2.29575 1.89956 2.08631 2.07970 2.10792 2.09547 1.87911 2.29545 2.10850 2.10985 2.08575 2.08756 2.07632 2.10694 2.09990 2.10518 2.08961 2.08833 1.93565 1.94465 1.94659 1.86925 1.87400 1.89038 3.13923 0.05978 -0.00279 -3.08224 -2.45689 0.68193 0.68521 -2.45915 -3.08297 -0.00338 0.05819 3.13779 -3.11849 0.00772 -0.03034 3.09587 3.10725 -0.01863 0.03326 -3.09261 0.00649 3.14044 -3.11553 0.01842 -0.00976 3.11445 3.11419 -0.04478 -0.01327 3.13615 3.11272 -0.02105 0.01400 -3.13973 -3.11998 0.00947 -0.01077 -3.14021 3.12299 -0.00645 3.13672 0.04165 -0.00220 -3.09727 3.13971 0.03753 -0.00455 -3.10673 0.00888 -3.12272 3.10388 -0.02772 0.00484 -3.12961 3.10699 -0.02746 -0.00849 3.11264 3.12310 -0.03895 0.00169 -3.11937 3.13614 0.01507 -1.44579 0.63476 2.74958 1.67463 -2.52800 -0.41319 3.10726 -0.01890 0.03312 -3.09304 0.00809 -3.11835 3.09635 -0.03009 -0.01333 3.13607 3.11293 -0.02085 -3.11597 0.01809 0.00634 3.14040 -0.01060 -3.14015 3.12317 -0.00638 0.01394 -3.13968 -3.12015 0.00941 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000019 0.000006 0.036134 0.004902 0.000450 0.000300 0.001800 0.001200 YES YES NO NO -3.054952e-07 6-31G(d) (6D, 7F) 0.10000e-02 0.10000e-05 F 35 35 35 1.00e+00 60 F IExCor= 402 DFT=T Ex+Corr=B3LYP ExCW=0 ScaHFX= 0.200000 ScaDFX= 0.800000 0.720000 1.000000 0.810000 ScalE2= 1.000000 1.000000 IRadAn= 0 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=131 Grimme-D3 -0.0307499049 PCM (using non-symmetric T matrix) UFF Total charges None Matrix inversion Ethanol 24.852000 1.852593 0.000000 1.449775 0.000000 2.341886 1.429733 0.000000 2.602428 1.404048 2.448446 0.000000 3.659321 2.451484 1.389538 2.833942 0.000000 3.819668 2.415333 2.789887 1.396940 2.436751 0.000000 2.924578 2.169804 3.439664 1.085231 3.918782 2.156016 0.000000 4.229656 2.801036 2.405411 2.435087 1.402632 1.402411 3.416028 0.000000 4.498526 3.441355 2.157680 3.920890 1.087051 3.421566 5.005570 2.165252 0.000000 4.734921 3.399993 3.876247 2.150979 3.416259 1.086481 2.475839 2.157041 4.312277 0.000000 1.454941 2.594273 3.751828 3.249765 5.001058 4.630845 3.058616 5.350144 5.904963 5.351901 0.000000 2.499323 3.782054 4.778071 4.492413 6.080148 5.855633 4.249397 6.530176 6.907825 6.564355 1.412737 0.000000 2.499240 3.153698 4.484384 3.298270 5.558030 4.650769 2.752905 5.616654 6.549510 5.155960 1.411972 2.413721 0.000000 3.775673 4.969557 6.084176 5.454447 7.350932 6.839237 4.976633 7.670997 8.226164 7.413372 2.440951 1.390687 2.781338 0.000000 2.716882 4.021027 4.756884 4.920952 6.076671 6.202288 4.860213 6.694645 6.789798 6.996512 2.162728 1.085332 3.401240 2.144461 0.000000 3.776205 4.513904 5.858713 4.529999 6.929180 5.849414 3.790606 6.916478 7.930603 6.211163 2.440929 2.781243 1.391500 2.403123 3.865995 0.000000 2.717621 2.917332 4.225303 2.805957 5.124079 4.028815 2.284433 5.032570 6.135153 4.467123 2.162402 3.401702 1.085297 3.866241 4.306072 2.144992 0.000000 4.304468 5.297256 6.570324 5.499667 7.748179 6.865565 4.815761 7.868467 8.705808 7.286788 2.849527 2.435858 2.435891 1.403685 3.412025 1.402810 3.411791 0.000000 4.642024 5.881714 6.909604 6.422142 8.195704 7.790385 5.967542 8.578219 9.023748 8.373919 3.419482 2.144181 3.868821 1.087604 2.457704 3.391999 4.953812 2.156652 0.000000 4.642537 5.186568 6.553341 4.981611 7.513139 6.191723 4.136227 7.348135 8.539632 6.401047 3.419249 3.868692 2.144757 3.392106 4.953487 1.087505 2.458076 2.155788 4.295822 0.000000 1.449796 2.330727 2.335318 3.715012 3.703024 4.683985 4.262261 4.682752 4.242648 5.711717 2.593533 3.152974 3.781846 4.512688 2.917514 4.969928 4.023324 5.296143 5.186343 5.883224 0.000000 2.602398 3.715007 3.663507 5.077159 4.981365 6.086625 5.523854 6.050929 5.365802 7.108422 3.248344 3.296826 4.491815 4.528206 2.808084 5.454323 4.924065 5.497186 4.982230 6.424251 1.404040 0.000000 2.341903 2.335378 1.462992 3.663539 2.601225 4.230188 4.503445 3.824472 2.919105 5.314980 3.751503 4.483787 4.778220 5.857535 4.224368 6.084922 4.759009 6.569750 6.552459 6.911135 1.429689 2.448430 0.000000 3.819655 4.684017 4.230187 6.086648 5.365389 6.912469 6.677441 6.613835 5.475074 7.979779 4.629494 4.649231 5.855130 5.847426 4.030597 6.839186 6.205817 6.862856 6.192215 7.792901 2.415316 1.396944 2.789884 0.000000 2.924533 4.262247 4.503427 5.523857 5.869844 6.677432 5.778303 6.825489 6.350361 7.640078 3.056845 2.751084 4.248534 3.788596 2.288335 4.976116 4.863402 4.812480 4.137703 5.969729 2.169822 1.085250 3.439669 2.156041 0.000000 3.659337 3.703100 2.601255 4.981411 3.305629 5.365409 5.869869 4.684585 3.149297 6.446438 5.000483 5.557140 6.080204 6.927700 5.123597 7.351580 6.079385 7.747052 7.512405 8.197715 2.451443 2.833931 1.389544 2.436745 3.918796 0.000000 4.229663 4.682814 3.824493 6.050969 4.684581 6.613849 6.825509 6.043624 4.545453 7.700201 5.349141 5.615383 6.529943 6.914658 5.033198 7.671294 6.697978 7.866417 7.347991 8.580655 2.801011 2.435089 2.405418 1.402412 3.416053 1.402630 0.000000 4.498546 4.242739 2.919153 5.365861 3.149321 5.475111 6.350396 4.545478 2.642997 6.518567 5.904579 6.548731 6.908048 7.929199 6.134220 8.227005 6.792325 8.705011 8.538604 9.025728 3.441311 3.920877 2.157684 3.421559 5.005585 1.087049 2.165246 0.000000 4.734901 5.711746 5.314984 7.108446 6.446426 7.979784 7.640087 7.700195 6.518540 9.041179 5.350355 5.154202 6.563705 6.208965 4.469652 7.413085 7.000340 7.283430 6.402026 8.376716 3.399981 2.150984 3.876247 1.086482 2.475860 3.416258 2.157044 4.312277 0.000000 5.813358 6.781280 8.073677 6.882290 9.232185 8.214551 6.101824 9.287492 10.202860 8.534409 4.358445 3.819338 3.821596 2.535386 4.679212 2.537666 4.681539 1.509146 2.736245 2.740076 6.772197 6.862229 8.068854 8.191653 6.075747 9.222511 9.269855 10.195819 8.505468 0.000000 6.274388 7.341138 8.571534 7.559638 9.781168 8.911240 6.843185 9.925270 10.715612 9.285382 4.846839 4.278232 4.335998 3.021218 5.089170 3.098429 5.159862 2.160212 3.104994 3.231052 7.097611 7.021483 8.441040 8.289816 6.147821 9.517599 9.444289 10.522616 8.496430 1.098300 0.000000 6.303816 7.301245 8.565479 7.424308 9.733728 8.750967 6.652827 9.810378 10.689323 9.071225 4.872920 4.087498 4.557757 2.721880 4.776936 3.385155 5.490598 2.164607 2.533524 3.699446 7.200137 7.222225 8.512513 8.518031 6.405032 9.632767 9.627534 10.617908 8.779948 1.095357 1.764801 0.000000 6.305338 7.098170 8.459181 6.991269 9.522736 8.251199 6.102242 9.423324 10.538155 8.438336 4.874163 4.581004 4.064215 3.415444 5.518641 2.686533 4.747329 2.165271 3.745023 2.468505 7.403637 7.645235 8.621665 9.006196 6.934349 9.845010 10.010162 10.771702 9.392875 1.094837 1.766850 1.775445 0.000000 5.314551 5.709342 4.740205 7.053637 5.427719 7.518501 7.867057 6.821323 5.101624 8.601304 6.427080 6.638759 7.605852 7.912028 6.001086 8.734214 7.760944 8.897008 8.283358 9.641765 3.887338 3.414019 3.390141 2.158238 4.305251 2.157645 1.086394 2.488844 2.477929 10.276097 10.409787 10.613099 11.043108 0.000000 5.314545 3.887365 3.390136 3.414015 2.157647 2.158234 4.305222 1.086396 2.488850 2.477920 6.428121 7.606090 6.640111 8.733936 7.757416 7.913958 6.000372 8.899264 9.639115 8.283467 5.709274 7.053595 4.740177 7.518483 7.867038 5.427714 6.821316 5.101639 8.601295 10.295878 10.951981 10.818119 10.382535 7.503807 0.000000 0.5303950 0.2511019 0.1747843 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. NBasis= 330 RedAO= T EigKep= 3.17D-04 NBF= 330 NBsUse= 330 1.00D-06 EigRej= -1.00D+00 NBFU= 330 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= 328 328 328 328 328 MxSgAt= 35 MxSgA2= 35. 1 open 1 1 1 -771.203935323171 -771.203935323 1 0.7729 7.636570063854e+02 -4.488390211537e+03 1.602271979175e+03 Using DIIS extrapolation, IDIIS= 1040. Two-electron integral symmetry not used. Keep R1 and R2 ints in memory in canonical form, NReq=3001587920. IVT= 602900 IEndB= 602900 NGot= 5502926848 MDV= 2519471109 LenX= 2519471109 LenY= 2519361768 Requested convergence on RMS density matrix=1.00D-08 within 512 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= 54615 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. 0.7729 Using compressed storage, NAtomX= 35. Will process 36 centers per pass. Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 Minotr: UHF open shell wavefunction. IDoAtm=11111111111111111111111111111111111 NEqPCM: Using equilibrium solvation (IEInf=0, Eps= 24.8520, EpsInf= 1.8526) 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= 5502925834 using IRadAn= 2. Generate precomputed XC quadrature information. Keep R1 and R2 ints in memory in canonical form, NReq=3000996528. 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= 54615 NMatT0= 0 NMatD0= 1 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. Solving linear equations simultaneously, MaxMat= 0. There are 108 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 105 vectors produced by pass 0 Test12= 3.54D-14 1.00D-09 XBig12= 1.02D+03 1.73D+01. AX will form 105 AO Fock derivatives at one time. 105 vectors produced by pass 1 Test12= 3.54D-14 1.00D-09 XBig12= 1.18D+02 2.42D+00. 105 vectors produced by pass 2 Test12= 3.54D-14 1.00D-09 XBig12= 1.38D+00 2.30D-01. 105 vectors produced by pass 3 Test12= 3.54D-14 1.00D-09 XBig12= 2.52D-02 2.65D-02. 105 vectors produced by pass 4 Test12= 3.54D-14 1.00D-09 XBig12= 9.70D-05 1.40D-03. 105 vectors produced by pass 5 Test12= 3.54D-14 1.00D-09 XBig12= 4.90D-07 6.18D-05. 75 vectors produced by pass 6 Test12= 3.54D-14 1.00D-09 XBig12= 1.72D-09 2.79D-06. 13 vectors produced by pass 7 Test12= 3.54D-14 1.00D-09 XBig12= 6.85D-12 2.02D-07. 3 vectors produced by pass 8 Test12= 3.54D-14 1.00D-09 XBig12= 2.60D-14 1.35D-08. InvSVY: IOpt=1 It= 1 EMax= 2.13D-14 Solved reduced A of dimension 721 with 108 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 318.98 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 110.507 -14.420 397.762 0.423 1.010 448.675 144.219 -22.070 475.735 0.261 0.949 495.110 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 C C C C C C H C H H C C C C H C H C H H C C C C H C C H H C H H H H H 13 13 13 13 13 13 1 13 1 1 13 13 13 13 1 13 1 13 1 1 13 13 13 13 1 13 13 1 1 13 1 1 1 1 1 0.06307 -0.02241 0.01123 0.01684 -0.00888 -0.01062 -0.00232 0.01615 0.00056 0.00072 -0.02129 0.01766 0.01793 -0.00692 -0.00149 -0.00700 -0.00152 0.01164 0.00083 0.00083 -0.02241 0.01682 0.01122 -0.01061 -0.00231 -0.00887 0.01614 0.00056 0.00072 -0.00293 0.00316 0.00097 0.00066 -0.00235 -0.00236 70.90755 -25.19841 12.61992 18.92704 -9.97837 -11.93703 -10.35112 18.15210 2.52537 3.23300 -23.93503 19.85351 20.15576 -7.77611 -6.65183 -7.86670 -6.77501 13.08791 3.69139 3.71930 -25.18773 18.91131 12.60846 -11.93099 -10.34679 -9.97349 18.14071 2.52399 3.23029 -3.29378 14.12295 4.32990 2.96261 -10.52608 -10.53195 25.30158 -8.99142 4.50310 6.75364 -3.56053 -4.25943 -3.69354 6.47712 0.90111 1.15362 -8.54061 7.08422 7.19208 -2.77471 -2.37354 -2.80703 -2.41749 4.67009 1.31718 1.32714 -8.98761 6.74802 4.49901 -4.25727 -3.69199 -3.55879 6.47306 0.90062 1.15265 -1.17530 5.03942 1.54502 1.05713 -3.75597 -3.75806 23.65221 -8.40528 4.20955 6.31338 -3.32843 -3.98176 -3.45276 6.05489 0.84237 1.07841 -7.98387 6.62242 6.72324 -2.59383 -2.21881 -2.62405 -2.25990 4.36566 1.23131 1.24062 -8.40172 6.30813 4.20573 -3.97975 -3.45132 -3.32680 6.05109 0.84191 1.07751 -1.09869 4.71091 1.44430 0.98822 -3.51112 -3.51308 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 0.582245 -0.071173 0.119835 0.143909 -0.039056 -0.050470 -0.003328 0.149960 -0.002919 -0.002524 -0.027178 0.007478 0.008552 -0.019767 -0.001773 -0.020644 -0.001767 0.049768 -0.001380 -0.001348 -0.071131 0.143936 0.119762 -0.050450 -0.003329 -0.039039 0.149872 -0.002918 -0.002522 -0.000510 -0.000834 -0.000716 -0.000967 -0.001302 -0.001306 -0.289263 0.043148 -0.060099 -0.070314 0.022369 0.022726 -0.003741 -0.074469 0.002438 0.000430 -0.008146 0.033123 0.033311 -0.004820 0.003422 -0.003851 0.003467 -0.000244 -0.001084 -0.001093 0.043197 -0.070294 -0.060039 0.022745 -0.003798 0.022394 -0.074395 0.002450 0.000449 -0.000724 -0.000919 -0.000939 -0.000634 0.000643 0.000522 -0.292982 0.028026 -0.059736 -0.073596 0.016688 0.027744 0.007069 -0.075491 0.000481 0.002095 0.035324 -0.040601 -0.041863 0.024587 -0.001649 0.024495 -0.001699 -0.049524 0.002464 0.002441 0.027934 -0.073642 -0.059724 0.027706 0.007127 0.016645 -0.075477 0.000468 0.002073 0.001235 0.001753 0.001654 0.001601 0.000659 0.000784 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 -0.022191 0.005069 -0.006419 -0.021092 0.003519 0.004893 0.000390 -0.013302 0.000293 0.000097 -0.042070 0.066870 0.068602 -0.029420 -0.004376 -0.029063 -0.004386 0.075822 -0.000766 -0.000792 0.005027 -0.020862 -0.006367 0.004859 0.000356 0.003506 -0.013214 0.000294 0.000102 0.001609 0.000555 -0.000233 -0.000198 0.000165 0.000133 0.000942 -0.001135 -0.001549 0.012929 0.000346 -0.001105 -0.001641 -0.001430 0.000060 0.000127 -0.000041 0.012092 -0.011895 0.001303 0.000398 -0.001383 -0.000486 -0.001458 0.000558 -0.000540 0.000925 -0.012287 0.002028 0.000903 0.001596 -0.000477 0.001944 -0.000067 -0.000137 0.000042 0.000777 -0.000958 0.000430 -0.000634 0.000635 -0.000037 0.006196 0.002745 -0.000314 0.003011 0.002401 -0.005740 0.003568 0.001150 0.001820 -0.000196 0.020431 -0.020009 -0.000123 -0.000953 -0.000167 0.001053 -0.001050 -0.000671 0.000628 -0.006105 0.000252 -0.002769 -0.002410 0.005694 -0.002972 -0.003594 -0.001140 -0.001827 0.000029 0.000760 0.000529 -0.001045 -0.011254 0.011260 -0.001 0.0041 1.0 0.0254 0.9997 -0.004 0.9997 -0.0254 0.0011 -0.293 -0.2898 0.5828 -39.316 -38.892 78.208 -14.029 -13.878 27.906 -13.114 -12.973 26.087 1 C 13 0.9989 -0.045 0.0142 -0.0283 -0.3304 0.9434 0.0377 0.9428 0.3313 -0.0714 0.0259 0.0455 -9.584 3.474 6.109 -3.42 1.24 2.18 -3.197 1.159 2.038 2 C 13 0.0205 0.7436 -0.6683 0.0307 0.6677 0.7438 0.9993 -0.0357 -0.0092 -0.0627 -0.0573 0.1201 -8.42 -7.694 16.113 -3.004 -2.745 5.75 -2.808 -2.566 5.375 3 C 13 -0.0899 -0.3639 0.9271 0.0683 0.9264 0.3703 0.9936 -0.0966 0.0584 -0.0747 -0.072 0.1467 -10.028 -9.661 19.689 -3.578 -3.447 7.025 -3.345 -3.223 6.567 4 C 13 0.9984 -0.0569 -0.0031 -0.0193 -0.3888 0.9211 0.0536 0.9196 0.3893 -0.0393 0.0154 0.0238 -5.268 2.068 3.2 -1.88 0.738 1.142 -1.757 0.69 1.067 5 C 13 0.9976 -0.0669 0.0161 0.068 0.9228 -0.3792 0.0105 0.3794 0.9252 -0.0508 0.0221 0.0287 -6.819 2.966 3.853 -2.433 1.058 1.375 -2.275 0.989 1.285 6 C 13 0.1057 0.9084 0.4045 0.9864 -0.1473 0.0731 -0.126 -0.3912 0.9116 -0.0063 -0.0035 0.0098 -3.335 -1.872 5.207 -1.19 -0.668 1.858 -1.113 -0.624 1.737 7 H 1 -0.0358 -0.6935 0.7196 0.0475 0.718 0.6944 0.9982 -0.0591 -0.0072 -0.0789 -0.0719 0.1508 -10.582 -9.648 20.23 -3.776 -3.443 7.219 -3.53 -3.218 6.748 8 C 13 0.9985 -0.0546 9.0E-4 -0.0237 -0.4172 0.9085 0.0492 0.9072 0.4179 -0.0029 0.0 0.003 -1.566 -0.026 1.592 -0.559 -0.009 0.568 -0.522 -0.009 0.531 9 H 1 0.9996 -0.0211 -0.0192 0.0074 0.8412 -0.5406 0.0275 0.5403 0.8411 -0.0025 -7.0E-4 0.0033 -1.349 -0.394 1.744 -0.481 -0.141 0.622 -0.45 -0.132 0.582 10 H 1 0.7812 0.6243 0.0016 -0.6242 0.7811 0.0129 0.0068 -0.0111 0.9999 -0.0608 0.0255 0.0353 -8.158 3.418 4.74 -2.911 1.22 1.691 -2.721 1.14 1.581 11 C 13 -0.5832 0.6018 -0.5457 -0.5203 0.2392 0.8198 0.6239 0.762 0.1736 -0.0502 -0.0423 0.0925 -6.738 -5.678 12.416 -2.404 -2.026 4.43 -2.247 -1.894 4.141 12 C 13 -0.5816 0.6017 0.5475 0.5158 -0.2476 0.8202 0.629 0.7594 -0.1663 -0.0512 -0.0433 0.0945 -6.873 -5.811 12.683 -2.452 -2.073 4.526 -2.292 -1.938 4.231 13 C 13 0.7894 0.6137 -0.0142 -0.6068 0.7836 0.1334 0.093 -0.0967 0.991 -0.0427 0.0179 0.0247 -5.725 2.407 3.317 -2.043 0.859 1.184 -1.91 0.803 1.107 14 C 13 0.8654 0.4985 0.0498 -0.1087 0.0899 0.99 -0.4891 0.8622 -0.132 -0.0043 -0.0018 0.006 -2.279 -0.949 3.228 -0.813 -0.339 1.152 -0.76 -0.317 1.077 15 H 1 0.7992 0.6008 0.018 -0.596 0.796 -0.1054 -0.0776 0.0735 0.9943 -0.0425 0.0179 0.0246 -5.706 2.406 3.3 -2.036 0.859 1.177 -1.903 0.803 1.101 16 C 13 0.8667 0.4973 -0.0398 0.1069 -0.1072 0.9885 -0.4873 0.8609 0.1461 -0.0043 -0.0019 0.0061 -2.274 -0.996 3.269 -0.811 -0.355 1.167 -0.758 -0.332 1.091 17 H 1 -0.586 0.8103 -7.0E-4 0.0091 0.0074 0.9999 0.8103 0.586 -0.0117 -0.0551 -0.0495 0.1046 -7.391 -6.648 14.039 -2.637 -2.372 5.01 -2.465 -2.218 4.683 18 C 13 0.7714 0.6364 -7.0E-4 -0.6132 0.7437 0.2664 0.17 -0.205 0.9639 -0.002 -7.0E-4 0.0027 -1.074 -0.37 1.443 -0.383 -0.132 0.515 -0.358 -0.123 0.481 19 H 1 0.7615 0.6482 9.0E-4 -0.6258 0.7355 -0.2596 -0.1689 0.1971 0.9657 -0.002 -6.0E-4 0.0027 -1.079 -0.342 1.421 -0.385 -0.122 0.507 -0.36 -0.114 0.474 20 H 1 0.9989 -0.0445 -0.012 0.0259 0.3253 0.9452 0.0381 0.9446 -0.3261 -0.0714 0.0259 0.0455 -9.577 3.47 6.107 -3.417 1.238 2.179 -3.194 1.157 2.037 21 C 13 0.0863 0.3567 0.9302 0.0692 0.9293 -0.3627 0.9939 -0.0956 -0.0555 -0.0747 -0.0719 0.1466 -10.022 -9.654 19.676 -3.576 -3.445 7.021 -3.343 -3.22 6.563 22 C 13 0.0183 0.7398 0.6726 -0.0326 -0.6719 0.7399 0.9993 -0.0355 0.0118 -0.0627 -0.0573 0.12 -8.416 -7.689 16.105 -3.003 -2.744 5.746 -2.807 -2.565 5.372 23 C 13 0.9977 -0.0664 -0.0135 0.0665 0.9208 0.3844 -0.0131 -0.3844 0.9231 -0.0508 0.0221 0.0287 -6.815 2.964 3.851 -2.432 1.058 1.374 -2.273 0.989 1.284 24 C 13 0.1072 0.9102 -0.4 0.9867 -0.1468 -0.0696 0.122 0.3872 0.9139 -0.0063 -0.0035 0.0098 -3.339 -1.865 5.204 -1.191 -0.665 1.857 -1.114 -0.622 1.736 25 H 1 0.9984 -0.0565 0.0055 0.0166 0.3839 0.9232 0.0543 0.9216 -0.3843 -0.0392 0.0154 0.0238 -5.266 2.067 3.199 -1.879 0.737 1.142 -1.756 0.689 1.067 26 C 13 0.0337 0.6895 0.7235 0.0491 0.7219 -0.6903 0.9982 -0.0588 0.0095 -0.0788 -0.0719 0.1507 -10.576 -9.642 20.218 -3.774 -3.441 7.214 -3.528 -3.216 6.744 27 C 13 0.9985 -0.0543 0.0014 0.0212 0.4127 0.9106 0.05 0.9092 -0.4132 -0.0029 0.0 0.003 -1.566 -0.026 1.592 -0.559 -0.009 0.568 -0.522 -0.009 0.531 28 H 1 0.9995 -0.021 0.0214 0.006 0.8383 0.5452 -0.0294 -0.5448 0.8381 -0.0025 -7.0E-4 0.0033 -1.348 -0.394 1.742 -0.481 -0.14 0.622 -0.45 -0.131 0.581 29 H 1 -0.6833 0.7301 0.0021 0.7152 0.6698 -0.1996 0.1472 0.1349 0.9799 -0.0022 0.001 0.0012 -0.299 0.132 0.167 -0.107 0.047 0.06 -0.1 0.044 0.056 30 C 13 -0.6691 0.7431 -0.0141 0.6869 0.611 -0.3934 0.2837 0.2729 0.9192 -0.0014 -8.0E-4 0.0022 -0.765 -0.419 1.184 -0.273 -0.149 0.422 -0.255 -0.14 0.395 31 H 1 0.7347 0.6662 0.1279 -0.5928 0.7221 -0.3566 -0.33 0.1862 0.9254 -0.0011 -0.001 0.0021 -0.584 -0.538 1.122 -0.208 -0.192 0.4 -0.195 -0.179 0.374 32 H 1 0.654 0.7344 0.1819 0.7409 -0.573 -0.3505 0.1532 -0.3639 0.9188 -0.0011 -0.001 0.0021 -0.571 -0.543 1.113 -0.204 -0.194 0.397 -0.19 -0.181 0.371 33 H 1 0.0356 0.7063 0.707 0.9985 -0.0554 0.005 -0.0427 -0.7058 0.7072 -0.0106 -0.0013 0.0119 -5.664 -0.701 6.365 -2.021 -0.25 2.271 -1.889 -0.234 2.123 34 H 1 (Enter /mnt/data/applications/G09/g09/l716.exe) PT6765.400S 2024-05-23T10:00:23.000 -10.19522 -10.19516 -10.19512 -10.19491 -10.19422 -10.19422 -10.19347 -10.19346 -10.19337 -10.19335 -10.19060 -10.19051 -10.19039 -10.19039 -10.18282 -0.89527 -0.86104 -0.84410 -0.80990 -0.78303 -0.76009 -0.75086 -0.74300 -0.71435 -0.70666 -0.66636 -0.63127 -0.61243 -0.59665 -0.58786 -0.57272 -0.56239 -0.51988 -0.49893 -0.49674 -0.46732 -0.46593 -0.45574 -0.44494 -0.44249 -0.42787 -0.42179 -0.41985 -0.41837 -0.41390 -0.40817 -0.40250 -0.38482 -0.36814 -0.36556 -0.35803 -0.35344 -0.34798 -0.34432 -0.33087 -0.32775 -0.30955 -0.28698 -0.25739 -0.25640 -0.24794 -0.21733 -0.17687 -0.03181 -0.01290 -0.00805 -0.00072 0.03434 0.04838 0.09858 0.10686 0.10712 0.12545 0.13085 0.13611 0.13921 0.15738 0.16076 0.16372 0.17338 0.17724 0.18505 0.18792 0.19428 0.20285 0.20954 0.21996 0.22534 0.24560 0.25584 0.25796 0.27446 0.27674 0.29445 0.30795 0.31313 0.32150 0.32821 0.36315 0.37045 0.37888 0.39343 0.41014 0.41895 0.48099 0.48303 0.49729 0.50269 0.51310 0.51653 0.52330 0.53128 0.53741 0.53858 0.55458 0.55529 0.56051 0.56449 0.56890 0.57541 0.57624 0.57921 0.58717 0.59271 0.59653 0.60036 0.60633 0.61055 0.61103 0.61299 0.62135 0.63141 0.63506 0.63576 0.64229 0.64356 0.64467 0.65591 0.68592 0.69487 0.70274 0.71504 0.73183 0.74224 0.74991 0.76711 0.78662 0.79708 0.80210 0.80749 0.82941 0.83604 0.83990 0.84136 0.85382 0.85626 0.86251 0.86635 0.87731 0.88349 0.89774 0.90476 0.90956 0.91222 0.91571 0.91842 0.94703 0.95782 0.97042 0.97713 0.98194 0.99558 1.00050 1.00762 1.01954 1.03183 1.06083 1.07645 1.08403 1.10022 1.11260 1.13645 1.13857 1.17432 1.18630 1.19002 1.20010 1.20509 1.22543 1.23999 1.24778 1.26100 1.27172 1.32369 1.33090 1.34356 1.35754 1.39007 1.40074 1.42596 1.43664 1.44432 1.44638 1.44919 1.45023 1.46985 1.47217 1.47503 1.48639 1.49208 1.49505 1.49648 1.51873 1.56914 1.57159 1.59437 1.60758 1.65985 1.68572 1.74934 1.76946 1.76994 1.77924 1.79827 1.79959 1.83013 1.83752 1.85182 1.85567 1.87839 1.90102 1.90702 1.91404 1.91532 1.92380 1.92572 1.94683 1.97434 1.97515 1.97793 1.99170 2.00375 2.03350 2.03946 2.07073 2.08786 2.09538 2.10766 2.12819 2.13416 2.14552 2.15759 2.17672 2.19220 2.20565 2.20816 2.22910 2.23781 2.24610 2.25125 2.27009 2.27160 2.29014 2.29371 2.31745 2.32486 2.34111 2.35397 2.37331 2.40263 2.40750 2.42849 2.44204 2.50377 2.53038 2.54041 2.59373 2.60807 2.63599 2.63686 2.64326 2.65642 2.66957 2.67305 2.68484 2.69533 2.71094 2.74483 2.75806 2.78342 2.78897 2.81379 2.84779 2.86925 2.86992 2.93141 2.94657 2.98128 3.00217 3.14540 3.17645 3.31953 3.34987 3.42846 3.50818 4.06871 4.08297 4.08811 4.09435 4.09840 4.11945 4.13258 4.14272 4.16765 4.19796 4.25256 4.30414 4.33521 4.34991 4.39907 4.43522 4.49261 4.67286 4.81445 4.81555 -10.20559 -10.20497 -10.20210 -10.19496 -10.19494 -10.19428 -10.19425 -10.19378 -10.19372 -10.19346 -10.19327 -10.19326 -10.19315 -10.19216 -10.19216 -10.19119 -10.19112 -10.19112 -10.19111 -10.18290 -0.89066 -0.85931 -0.84222 -0.80466 -0.78039 -0.75756 -0.74916 -0.74081 -0.71405 -0.70289 -0.66066 -0.62993 -0.61092 -0.59454 -0.58621 -0.57081 -0.56010 -0.51842 -0.49614 -0.49581 -0.46613 -0.46430 -0.45493 -0.44356 -0.44148 -0.42581 -0.42052 -0.41903 -0.41698 -0.41177 -0.40101 -0.39949 -0.38406 -0.36658 -0.36304 -0.35276 -0.35108 -0.34631 -0.34374 -0.32922 -0.32657 -0.29395 -0.27712 -0.25421 -0.24769 -0.24258 -0.21709 -0.10981 -0.02724 -0.00801 -0.00487 0.00659 0.04240 0.06556 0.09935 0.10699 0.10803 0.12604 0.13266 0.13643 0.14029 0.16058 0.16231 0.16741 0.17399 0.17800 0.18650 0.19281 0.19716 0.20468 0.21061 0.22403 0.22682 0.24825 0.26007 0.26076 0.27751 0.27979 0.29486 0.30897 0.31492 0.32232 0.32896 0.36449 0.37746 0.37995 0.39566 0.41184 0.42185 0.48410 0.48601 0.49884 0.50426 0.51509 0.51745 0.52492 0.53426 0.54058 0.54346 0.55623 0.55697 0.56254 0.56739 0.57014 0.57660 0.57952 0.58180 0.58884 0.59510 0.59753 0.60277 0.60809 0.61207 0.61372 0.61405 0.62313 0.63195 0.63603 0.63922 0.64420 0.64490 0.64988 0.65816 0.68828 0.69819 0.70475 0.71783 0.73308 0.74389 0.75271 0.77670 0.78991 0.79906 0.80549 0.80772 0.83071 0.83649 0.84053 0.84210 0.85553 0.85761 0.86257 0.86744 0.87786 0.88508 0.89842 0.90553 0.90989 0.91630 0.91768 0.91919 0.94940 0.95840 0.97307 0.97899 0.98301 0.99919 1.00149 1.00977 1.02219 1.03278 1.06239 1.07794 1.08533 1.10313 1.11404 1.13752 1.13977 1.17588 1.18726 1.19207 1.20151 1.20716 1.22674 1.24189 1.25053 1.26484 1.27435 1.32847 1.33507 1.34485 1.36363 1.39179 1.40252 1.42720 1.43795 1.44597 1.44817 1.45276 1.45330 1.47211 1.47453 1.47733 1.48777 1.49348 1.49961 1.49994 1.52029 1.57242 1.57462 1.59788 1.61407 1.66481 1.69009 1.75680 1.77112 1.77264 1.78292 1.79975 1.80106 1.83116 1.83933 1.85366 1.85796 1.88278 1.90244 1.90798 1.91451 1.91682 1.92543 1.92948 1.95144 1.97827 1.98213 1.98643 1.99379 2.00580 2.03442 2.03990 2.07208 2.09070 2.09855 2.10960 2.13002 2.13583 2.14834 2.15959 2.17954 2.19459 2.20724 2.21161 2.23098 2.24284 2.24841 2.25724 2.27111 2.27502 2.29211 2.29679 2.31925 2.32509 2.34216 2.35456 2.38052 2.40845 2.41112 2.44160 2.44616 2.50957 2.53682 2.54254 2.59634 2.60969 2.63861 2.63934 2.64555 2.65929 2.67367 2.67483 2.68778 2.69773 2.71151 2.74528 2.75886 2.78446 2.79199 2.81480 2.84867 2.87087 2.87124 2.93919 2.94823 2.98396 3.00369 3.14722 3.17909 3.32084 3.35076 3.42955 3.50918 4.07169 4.08588 4.08982 4.09638 4.10045 4.12023 4.13462 4.14441 4.16740 4.20414 4.25302 4.30601 4.33635 4.35119 4.40030 4.43753 4.49655 4.67413 4.81756 4.81913 1.13624988e-02 1.68051968e-02 6.10027454e-01 1.10506569e+02 -1.44195701e+01 3.97761915e+02 4.22501942e-01 1.00987168e+00 4.48674619e+02 -6.6217 -5.8401 -0.0005 -0.0003 0.0005 1.0765 50.8175 55.3300 69.6107 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 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 50.7867 55.2893 69.5989 73.6676 111.5171 145.9599 162.1696 195.8858 234.6988 286.7019 296.2695 316.6429 368.0122 418.5751 419.8905 433.0439 447.0367 457.5725 512.2200 520.1740 573.4163 576.8986 623.0398 628.2473 634.2488 659.6339 701.9526 734.8207 742.3730 760.6598 765.6947 786.3888 790.8187 811.7942 842.3440 861.5711 884.4363 893.1598 929.7972 947.9580 948.7298 952.3306 979.1034 980.2818 987.0331 987.9033 1012.1309 1025.5856 1037.1328 1052.1135 1060.3282 1070.1165 1122.5811 1127.4256 1161.3052 1186.3130 1187.2215 1200.5730 1228.9279 1237.0432 1240.2283 1246.9321 1310.2524 1334.9367 1341.0860 1349.4375 1358.2639 1399.1888 1405.7456 1437.5108 1453.4285 1483.6987 1484.2029 1504.8143 1508.7343 1511.4189 1519.2322 1556.0451 1597.4327 1613.1493 1615.6366 1629.2076 1640.8863 1656.2429 3039.0606 3097.4524 3126.8059 3181.6951 3183.0096 3183.9051 3185.3198 3192.4844 3193.5157 3205.6608 3206.2466 3211.6078 3212.7199 3217.7708 3218.9071 3.7655 1.0678 4.0373 3.7841 4.6141 3.8016 4.2460 4.9367 4.4418 4.7304 5.4242 4.4524 2.9750 3.4136 3.4397 4.8602 4.1096 3.4414 3.4739 4.2746 3.6136 5.5185 4.6928 6.3400 6.0385 6.6561 5.7397 3.9086 1.6953 1.4625 5.3610 2.1595 2.9456 5.1716 1.5414 1.2479 1.3379 1.4548 5.4458 1.3761 1.4050 6.3551 1.3063 1.2883 1.2916 1.2674 7.0442 1.4252 2.8525 2.2953 1.8460 1.5333 2.3570 1.9611 1.3761 1.8029 1.1927 1.4037 1.3230 2.3427 2.2738 2.5557 2.5178 1.7828 3.3117 4.1235 1.3967 5.5968 3.1680 1.2360 2.4656 2.6694 2.1620 1.6183 1.3600 1.1441 3.1109 2.5333 4.7689 5.4382 4.9121 6.0109 5.6375 5.4766 1.0410 1.0954 1.1034 1.0889 1.0889 1.0868 1.0864 1.0891 1.0895 1.0929 1.0930 1.0942 1.0947 1.0933 1.0937 0.0057 0.0019 0.0115 0.0121 0.0338 0.0477 0.0658 0.1116 0.1442 0.2291 0.2805 0.2630 0.2374 0.3524 0.3573 0.5370 0.4839 0.4245 0.5370 0.6815 0.7001 1.0821 1.0733 1.4744 1.4312 1.7064 1.6663 1.2435 0.5505 0.4986 1.8519 0.7868 1.0854 2.0080 0.6444 0.5458 0.6166 0.6838 2.7739 0.7286 0.7451 3.3958 0.7378 0.7294 0.7414 0.7288 4.2516 0.8832 1.8078 1.4970 1.2228 1.0345 1.7500 1.4687 1.0935 1.4949 0.9905 1.1921 1.1772 2.1122 2.0607 2.3413 2.5467 1.8719 3.5092 4.4241 1.5182 6.4557 3.6885 1.5048 3.0688 3.4623 2.8060 2.1592 1.8240 1.5399 4.2304 3.6139 7.1699 8.3378 7.5544 9.4004 8.9433 8.8513 5.6649 6.1923 6.3558 6.4947 6.5000 6.4914 6.4945 6.5402 6.5468 6.6168 6.6201 6.6496 6.6575 6.6699 6.6768 0.6576 0.4584 0.1313 0.0675 1.6523 0.0093 0.3290 0.1934 0.4660 0.1143 0.0339 0.9847 0.5416 3.8838 1.1278 2.2607 0.6281 0.0035 7.0473 1.7976 0.5184 13.4677 7.8536 1.7029 6.9744 0.0686 4.7305 0.9331 94.5364 0.2900 1.3500 36.7722 0.0058 1.0006 47.0021 4.6831 0.0199 0.0526 2.5263 4.5931 0.3853 4.3653 1.8683 0.4726 1.8438 0.9842 2.4269 1.2380 3.3349 2.1171 6.9812 29.9288 0.0586 6.0597 10.7332 0.9399 0.1868 0.1681 16.4440 9.1889 0.9850 0.4914 11.7462 1.1151 5.1181 5.7136 3.7770 66.3222 47.5324 5.9295 1.2727 6.6603 65.8763 3.7845 10.9678 16.9268 1.7509 8.3932 2.7950 21.2486 0.5783 7.0076 36.4833 24.8825 53.1352 30.3793 26.8145 28.3729 46.2043 0.4749 3.0679 18.2518 18.2430 29.1743 81.2905 22.9590 5.6091 91.9184 3.7777 0.14 0.04 0.00 0.09 0.02 0.02 -0.02 0.01 0.01 0.10 0.03 0.04 -0.12 -0.01 0.03 0.01 0.01 0.06 0.18 0.04 0.05 -0.11 0.00 0.05 -0.21 -0.02 0.02 0.02 0.02 0.08 0.13 0.04 0.00 0.10 0.03 -0.02 0.10 0.03 0.02 0.00 -0.02 -0.02 0.13 0.05 -0.04 0.00 -0.02 0.02 0.14 0.05 0.03 -0.07 -0.06 0.00 -0.04 -0.04 -0.03 -0.04 -0.04 0.03 0.09 0.02 -0.02 0.10 0.03 -0.04 -0.02 0.01 -0.01 0.01 0.01 -0.06 0.18 0.04 -0.05 -0.12 -0.01 -0.03 -0.10 0.00 -0.05 -0.20 -0.02 -0.02 0.02 0.02 -0.08 -0.23 -0.14 0.00 -0.41 0.00 0.12 -0.33 -0.36 -0.08 -0.07 -0.11 -0.03 -0.17 -0.01 -0.07 -0.18 -0.01 0.06 0.01 0.01 0.00 0.01 0.01 0.01 0.00 0.00 0.00 0.01 0.01 0.01 0.00 0.00 0.01 0.01 0.00 0.02 0.01 0.01 0.01 0.00 0.00 0.01 0.00 -0.01 0.01 0.01 0.00 0.02 0.01 0.01 0.00 0.01 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.02 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 -0.02 -0.02 0.00 0.00 0.01 -0.01 0.00 0.01 -0.01 0.00 0.00 0.00 -0.01 0.00 -0.02 0.00 0.01 -0.01 -0.01 0.00 -0.01 -0.02 0.00 -0.02 -0.02 -0.01 -0.01 -0.01 0.01 -0.02 -0.01 -0.04 0.00 0.39 -0.47 0.01 0.17 0.49 0.01 -0.55 -0.18 -0.01 -0.02 -0.01 -0.02 0.00 -0.01 0.02 -0.08 0.09 0.00 -0.06 0.06 0.04 0.03 0.01 0.02 -0.11 0.07 0.09 0.10 -0.03 0.06 -0.06 0.03 0.12 -0.20 0.12 0.10 0.05 -0.02 0.11 0.18 -0.08 0.04 -0.11 0.04 0.16 -0.03 0.07 0.00 -0.01 0.03 0.07 0.02 0.05 -0.07 0.02 -0.06 0.07 -0.03 0.06 0.12 0.05 -0.03 -0.07 0.02 0.10 -0.13 0.03 -0.10 0.00 0.02 -0.10 0.13 0.07 -0.06 -0.13 -0.06 0.06 -0.04 -0.11 0.07 -0.08 0.04 0.01 -0.02 -0.05 0.03 -0.12 -0.20 0.11 -0.09 0.11 -0.03 -0.05 0.07 -0.02 -0.10 0.19 -0.07 -0.04 -0.09 0.04 -0.15 0.03 -0.22 0.00 -0.09 -0.13 0.06 -0.02 -0.41 0.02 0.19 -0.22 -0.08 0.12 -0.05 -0.13 0.10 -0.05 0.13 -0.01 0.00 0.01 0.00 0.00 0.01 0.02 0.00 0.01 0.00 -0.01 -0.01 0.07 0.01 0.00 0.05 0.00 -0.02 -0.05 -0.02 -0.02 0.10 0.01 -0.02 0.10 0.02 0.00 0.06 0.00 -0.03 0.00 0.00 0.01 0.18 0.14 0.02 -0.18 -0.13 0.01 0.19 0.14 0.02 0.29 0.24 0.04 -0.18 -0.14 0.01 -0.29 -0.23 0.02 0.01 -0.01 0.02 0.34 0.26 0.03 -0.33 -0.26 0.01 -0.01 0.01 0.00 -0.01 0.01 -0.02 -0.01 0.00 0.01 -0.06 0.00 -0.03 0.02 0.04 -0.03 -0.06 -0.01 -0.01 -0.09 -0.01 -0.03 -0.07 -0.03 0.00 -0.07 0.01 -0.04 0.00 -0.01 0.02 -0.07 0.06 0.03 -0.03 -0.10 0.02 0.09 0.01 0.02 -0.13 -0.01 -0.04 0.15 0.01 -0.02 0.12 -0.02 0.00 0.11 -0.01 -0.01 0.19 -0.01 -0.01 -0.10 0.00 -0.01 0.10 0.00 -0.01 -0.24 0.01 -0.02 -0.18 0.01 -0.01 -0.13 0.01 -0.02 0.16 0.01 -0.01 -0.44 0.03 -0.03 0.06 -0.03 0.00 0.04 -0.03 -0.03 0.04 -0.03 0.03 0.00 0.00 -0.03 0.04 -0.05 -0.06 0.00 0.00 0.03 0.04 -0.05 0.05 0.00 0.02 0.00 -0.01 0.00 -0.06 -0.01 0.00 0.06 0.11 -0.02 0.01 -0.10 0.00 0.01 0.19 -0.01 0.01 -0.24 0.01 0.02 -0.18 0.01 0.01 0.10 0.00 0.01 -0.13 0.01 0.02 0.16 0.01 0.01 -0.44 0.03 0.03 -0.02 0.07 0.00 -0.01 0.07 -0.02 -0.02 0.10 -0.02 -0.05 0.08 0.04 -0.24 0.03 0.02 -0.24 0.03 -0.02 0.00 0.00 0.01 0.09 -0.01 0.00 -0.01 0.00 0.01 0.20 -0.02 -0.02 -0.18 0.03 -0.01 0.08 0.00 -0.04 0.34 -0.06 -0.03 -0.16 0.03 -0.03 -0.34 0.06 0.00 0.15 -0.01 -0.05 0.00 0.00 0.01 0.03 0.02 0.02 -0.03 -0.02 0.02 0.04 0.03 0.02 0.04 0.03 0.03 -0.04 -0.03 0.02 -0.03 -0.03 0.03 0.00 0.00 0.03 0.07 0.05 0.02 -0.06 -0.05 0.02 -0.09 0.01 0.00 -0.20 0.02 -0.02 0.01 0.00 0.01 -0.09 0.00 -0.04 -0.34 0.06 -0.03 0.19 -0.03 -0.01 0.16 -0.03 -0.03 0.34 -0.06 0.00 -0.15 0.01 -0.05 0.00 0.00 0.03 0.00 0.00 0.03 0.00 0.00 0.02 0.00 0.00 0.03 0.31 -0.05 -0.04 -0.31 0.05 -0.04 -0.08 -0.06 0.00 -0.10 -0.05 -0.02 -0.05 -0.02 -0.01 -0.10 -0.06 -0.05 0.04 0.00 -0.04 -0.03 -0.04 -0.08 -0.13 -0.07 -0.06 0.06 -0.01 -0.07 0.11 0.02 -0.03 -0.03 -0.04 -0.11 0.06 0.02 0.00 0.12 0.08 -0.01 0.13 0.08 0.01 0.14 0.12 -0.02 0.10 0.05 -0.02 0.14 0.13 0.02 0.11 0.06 0.02 0.07 0.09 0.00 0.13 0.13 -0.03 0.14 0.13 0.03 -0.10 -0.05 0.01 -0.09 -0.06 0.05 -0.05 -0.02 0.01 -0.03 -0.04 0.08 -0.12 -0.07 0.06 0.04 0.00 0.03 0.05 -0.01 0.07 0.11 0.02 0.03 -0.02 -0.04 0.10 -0.22 -0.08 0.01 -0.26 -0.18 0.27 -0.29 -0.08 -0.16 -0.37 -0.15 -0.07 0.13 0.00 0.08 0.13 0.00 -0.09 0.00 0.00 -0.06 0.02 0.01 -0.02 0.00 -0.02 -0.03 0.04 0.04 0.10 -0.05 -0.12 0.05 0.03 -0.04 0.19 0.05 0.13 0.13 -0.02 -0.11 0.16 -0.10 -0.23 0.02 0.06 -0.03 0.26 0.00 0.00 -0.09 0.03 0.03 -0.12 -0.02 -0.03 -0.12 0.05 0.05 -0.13 0.04 0.03 -0.13 -0.05 -0.05 -0.13 -0.03 -0.03 -0.12 0.00 0.00 -0.14 0.09 0.07 -0.12 -0.09 -0.07 -0.12 -0.03 -0.01 -0.02 -0.05 -0.04 0.10 0.00 0.02 -0.03 -0.04 0.04 0.19 -0.06 -0.13 0.13 0.05 0.12 0.05 0.03 0.11 0.17 0.10 0.23 0.02 -0.06 0.03 0.26 0.00 0.00 -0.15 -0.01 0.00 -0.15 0.00 0.00 -0.15 0.00 0.00 -0.15 0.06 0.16 0.21 -0.05 -0.16 0.21 -0.05 0.00 0.00 0.08 -0.04 0.01 0.11 -0.05 0.00 0.11 -0.06 -0.03 0.00 -0.02 -0.01 0.01 -0.04 -0.05 0.15 -0.10 -0.04 -0.10 -0.02 -0.05 -0.05 0.01 0.00 -0.01 -0.04 -0.06 -0.18 0.11 0.00 -0.12 0.13 0.05 -0.12 0.13 -0.06 0.00 0.12 0.07 -0.14 0.15 0.11 -0.01 0.12 -0.07 -0.14 0.16 -0.11 0.02 0.08 0.00 0.04 0.12 0.12 0.04 0.11 -0.13 0.08 -0.05 -0.01 0.11 -0.06 0.03 0.11 -0.04 -0.01 0.01 -0.04 0.06 0.15 -0.10 0.04 0.00 -0.02 0.01 -0.10 -0.02 0.05 -0.05 0.02 0.00 -0.01 -0.04 0.07 0.07 -0.19 0.00 0.05 -0.24 0.14 0.06 -0.31 0.10 0.11 -0.27 -0.21 -0.23 0.00 0.06 -0.23 0.00 -0.06 0.00 0.00 0.02 0.21 -0.01 0.03 0.15 0.00 0.04 0.13 -0.01 0.01 0.20 0.02 0.02 -0.17 0.03 0.00 0.13 -0.03 0.01 -0.07 0.03 0.00 0.26 0.04 0.03 -0.43 0.04 -0.02 0.00 0.00 -0.01 0.00 0.01 -0.02 0.01 0.00 -0.02 0.01 0.01 -0.03 -0.01 0.00 -0.03 -0.01 -0.01 -0.03 0.01 0.01 -0.03 0.00 0.00 -0.04 0.02 0.02 -0.02 -0.02 -0.02 -0.02 -0.21 0.01 0.03 -0.13 0.01 0.01 -0.15 0.00 0.04 0.17 -0.03 0.00 -0.13 0.03 0.01 -0.20 -0.02 0.02 0.07 -0.04 0.00 -0.26 -0.04 0.03 0.43 -0.04 -0.02 0.00 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 -0.05 0.00 0.00 -0.05 0.23 -0.05 -0.01 -0.23 0.05 -0.01 0.00 0.00 0.08 -0.05 -0.03 0.14 -0.04 0.02 0.19 -0.04 -0.05 0.05 -0.04 0.16 0.10 0.04 0.05 -0.05 -0.05 -0.16 0.02 0.03 0.14 -0.02 -0.05 0.28 0.14 0.10 0.02 -0.14 0.01 0.02 0.00 -0.01 0.05 -0.10 0.03 -0.02 -0.10 -0.03 0.02 -0.12 0.01 0.03 -0.15 0.02 -0.02 -0.13 0.01 0.02 -0.16 -0.01 -0.01 -0.18 -0.03 -0.01 -0.08 0.01 0.00 -0.09 0.05 0.02 0.14 0.04 0.04 0.06 0.03 -0.03 0.18 -0.05 -0.05 -0.03 0.05 0.14 0.03 0.04 -0.16 0.10 -0.03 -0.15 -0.01 0.06 -0.27 0.14 -0.11 -0.03 -0.13 0.01 0.00 -0.21 0.01 0.00 -0.23 0.01 0.00 -0.19 0.02 0.00 -0.20 -0.07 -0.20 -0.06 0.08 0.20 -0.07 -0.09 -0.02 0.00 0.02 0.03 -0.01 0.06 0.04 0.00 0.05 0.05 0.04 -0.01 0.03 0.02 0.04 0.04 0.06 0.03 0.08 0.04 -0.05 0.04 0.06 -0.05 0.00 0.01 0.05 0.04 0.07 -0.18 -0.19 0.00 -0.11 -0.15 -0.01 -0.10 -0.16 -0.01 0.14 0.02 -0.02 -0.15 -0.19 -0.01 0.15 0.02 0.00 -0.15 -0.19 -0.02 0.20 0.08 -0.01 0.20 0.05 -0.01 0.20 0.05 -0.01 0.02 0.04 0.03 0.05 0.05 -0.03 0.06 0.04 0.02 0.03 0.03 -0.06 0.04 0.09 -0.04 -0.01 0.01 -0.01 -0.05 0.02 -0.06 -0.05 -0.04 0.01 0.05 0.03 -0.08 -0.14 0.02 0.00 -0.23 -0.03 0.28 -0.26 0.04 -0.29 -0.33 -0.01 0.02 -0.12 0.00 -0.08 -0.12 0.03 0.07 0.11 -0.03 0.00 0.03 0.01 -0.02 -0.04 0.02 -0.01 -0.04 0.02 0.01 -0.03 0.01 0.00 -0.01 0.01 0.02 -0.09 0.05 0.02 0.06 0.01 0.02 -0.05 -0.01 -0.01 -0.03 0.02 0.02 0.04 -0.10 0.00 -0.03 -0.09 -0.09 -0.02 -0.08 0.08 -0.04 0.11 -0.07 -0.04 -0.17 -0.19 -0.06 0.10 0.07 -0.02 -0.15 0.18 -0.02 0.17 0.00 -0.08 0.15 -0.17 -0.11 0.13 0.16 0.03 0.01 0.02 -0.04 0.02 -0.01 -0.04 0.02 0.01 -0.01 0.01 -0.02 -0.09 0.05 -0.01 -0.03 0.01 0.00 0.05 0.00 -0.02 -0.06 -0.01 0.01 -0.03 0.01 -0.03 0.10 -0.17 0.00 0.12 -0.26 0.15 0.13 -0.35 0.22 0.19 -0.29 -0.34 0.12 -0.01 -0.03 0.12 0.00 0.03 -0.15 -0.02 -0.01 -0.13 0.02 -0.02 -0.05 0.03 -0.02 0.13 0.02 0.02 0.14 0.02 -0.01 -0.02 0.04 0.03 0.35 0.03 0.04 -0.10 0.04 0.02 0.34 -0.01 -0.02 -0.01 0.04 0.02 0.03 -0.07 0.00 0.00 -0.08 -0.04 0.13 0.03 0.04 0.04 0.07 -0.03 0.00 -0.12 -0.09 -0.08 -0.02 0.04 0.25 0.08 0.09 -0.08 0.00 0.00 0.12 0.17 -0.09 -0.14 -0.03 0.09 -0.12 0.00 0.01 0.14 -0.03 -0.01 -0.04 0.01 0.00 -0.03 -0.02 -0.01 0.34 -0.04 -0.01 0.14 -0.01 -0.01 -0.10 0.00 -0.02 0.33 -0.04 -0.01 -0.02 -0.02 -0.01 0.03 -0.03 0.00 0.07 -0.03 -0.06 0.08 -0.06 0.13 0.10 -0.04 -0.06 -0.20 0.01 -0.01 -0.19 0.03 0.04 -0.06 -0.01 0.01 -0.04 -0.03 0.01 -0.01 -0.01 0.02 0.06 -0.07 -0.02 0.05 -0.04 0.03 -0.02 -0.08 -0.01 0.12 -0.10 -0.03 -0.05 -0.05 0.00 0.13 -0.05 0.03 -0.02 -0.08 -0.01 0.01 -0.03 0.00 0.18 0.11 -0.02 -0.13 -0.14 0.02 -0.16 -0.10 -0.02 0.35 0.24 -0.04 0.14 0.12 0.01 -0.27 -0.26 0.04 -0.03 0.01 -0.01 -0.32 -0.20 -0.05 0.30 0.27 0.04 -0.06 0.04 0.02 0.05 0.07 -0.03 -0.03 0.03 0.03 -0.01 0.09 -0.03 0.15 0.10 -0.04 0.05 0.05 0.03 -0.03 0.07 -0.02 0.14 0.03 0.04 0.00 0.09 -0.02 0.02 -0.02 -0.01 0.03 -0.03 -0.03 0.04 -0.04 0.04 0.05 -0.03 -0.05 -0.06 0.04 -0.05 -0.09 -0.02 -0.03 0.00 0.00 -0.03 0.10 0.09 -0.05 0.05 0.04 -0.07 -0.03 0.18 0.06 -0.05 0.09 -0.08 0.02 0.20 0.07 -0.18 0.24 0.07 0.05 0.13 0.04 -0.20 0.08 -0.08 -0.02 0.21 0.08 0.00 0.00 -0.03 0.10 0.06 0.00 -0.10 -0.07 0.00 -0.07 -0.07 0.00 0.18 0.14 0.02 0.07 0.07 0.00 -0.18 -0.15 0.02 0.00 0.00 0.02 -0.17 -0.13 -0.02 0.16 0.13 -0.01 -0.11 -0.08 -0.05 0.04 -0.18 0.06 -0.06 -0.04 -0.07 -0.03 -0.20 0.07 0.21 -0.24 0.07 0.06 -0.09 -0.08 -0.05 -0.13 0.04 0.22 -0.08 -0.08 0.01 -0.20 0.07 0.00 0.00 0.03 0.00 0.00 0.03 0.00 0.00 0.03 0.00 0.00 0.02 -0.04 -0.05 0.12 0.04 0.05 0.12 -0.18 -0.03 0.00 -0.05 0.00 -0.02 0.22 0.00 -0.01 -0.12 0.01 0.01 -0.08 0.02 -0.01 0.16 -0.01 0.01 -0.30 0.06 0.01 -0.07 0.02 0.01 -0.26 0.01 -0.01 0.30 -0.02 0.01 0.02 -0.07 0.00 0.10 0.01 -0.02 0.10 0.00 0.03 -0.02 0.02 -0.03 0.17 0.03 -0.07 -0.01 0.02 0.03 0.15 0.01 0.07 -0.12 -0.03 0.00 0.01 0.08 -0.08 0.02 0.09 0.09 -0.06 0.00 0.02 -0.11 0.01 -0.01 0.21 0.00 0.01 0.16 -0.01 -0.01 -0.28 0.05 -0.01 -0.07 0.02 0.00 -0.07 0.02 -0.01 -0.24 0.01 0.01 0.30 -0.02 0.00 0.03 -0.02 0.00 0.08 0.00 -0.14 0.09 -0.02 0.14 0.11 -0.01 -0.03 -0.21 0.02 -0.02 -0.20 0.02 0.02 0.00 0.00 0.02 0.20 -0.04 0.02 0.11 -0.02 0.02 -0.11 -0.04 -0.03 -0.13 -0.02 0.03 -0.01 -0.07 -0.03 -0.39 -0.03 -0.04 0.10 -0.05 -0.02 -0.43 0.00 0.03 -0.11 -0.06 -0.03 0.00 0.00 0.01 -0.04 -0.03 0.00 0.04 0.03 0.00 0.02 0.02 0.00 -0.06 -0.05 -0.01 -0.02 -0.02 0.00 0.06 0.05 -0.01 0.00 0.00 0.00 0.06 0.05 0.01 -0.06 -0.05 0.01 -0.20 0.04 0.01 0.11 0.04 -0.03 -0.11 0.02 0.02 0.01 0.07 -0.03 0.39 0.03 -0.03 0.13 0.02 0.03 -0.10 0.05 -0.02 0.43 0.00 0.04 0.11 0.06 -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 -0.12 0.02 -0.05 0.13 -0.03 -0.05 -0.01 0.01 0.00 -0.06 -0.05 0.11 0.03 0.00 0.10 -0.03 -0.09 0.06 0.03 0.07 0.09 0.05 -0.02 -0.01 -0.02 -0.17 0.03 -0.05 0.08 0.02 0.05 0.15 0.11 0.11 -0.05 -0.11 0.16 0.12 -0.01 -0.03 -0.04 -0.01 -0.03 -0.03 0.00 -0.05 -0.05 -0.01 -0.23 -0.20 -0.02 -0.06 -0.04 0.00 -0.22 -0.19 0.01 0.16 0.12 0.00 -0.28 -0.22 -0.02 -0.28 -0.22 0.00 -0.06 -0.04 -0.11 -0.03 -0.09 -0.06 0.03 0.00 -0.09 0.05 -0.02 0.01 -0.02 -0.17 -0.03 0.03 0.07 -0.08 -0.05 0.07 -0.01 0.05 0.14 -0.11 0.12 -0.04 0.10 0.00 0.00 0.01 -0.06 -0.05 0.24 -0.07 -0.06 -0.10 -0.07 -0.06 -0.08 -0.10 0.13 0.03 -0.10 0.13 -0.03 0.00 0.10 0.00 -0.06 0.09 -0.08 0.02 -0.04 -0.08 -0.01 0.12 -0.09 0.02 -0.12 -0.09 0.05 0.02 -0.02 0.00 0.14 -0.09 -0.07 -0.13 -0.07 0.06 -0.16 -0.11 0.12 0.05 0.13 0.15 0.10 -0.01 -0.02 -0.02 0.00 -0.02 -0.02 -0.01 -0.05 -0.04 0.00 -0.18 -0.17 -0.01 -0.06 -0.03 -0.01 -0.18 -0.16 0.00 0.13 0.11 0.00 -0.26 -0.19 -0.01 -0.26 -0.19 -0.01 -0.06 0.10 0.08 -0.01 0.12 0.10 0.02 -0.04 0.09 0.05 0.03 0.02 0.00 0.14 0.09 0.02 -0.13 0.10 -0.07 -0.13 0.07 0.06 -0.17 0.11 0.12 0.05 -0.13 0.00 0.00 0.01 -0.05 -0.04 0.20 -0.06 -0.04 -0.09 -0.06 -0.04 -0.06 -0.13 -0.19 0.01 -0.13 -0.18 -0.02 0.00 0.00 0.02 -0.02 0.01 0.01 0.16 -0.01 0.00 -0.12 0.02 -0.01 0.11 -0.02 0.00 0.19 -0.01 0.00 -0.29 0.03 -0.01 -0.16 0.00 -0.01 0.00 -0.01 0.00 0.29 -0.02 0.01 0.00 0.00 0.04 -0.02 0.01 0.02 0.02 -0.01 0.02 -0.01 0.02 0.02 -0.01 0.00 0.00 0.01 -0.02 0.02 -0.01 -0.01 0.00 0.00 0.00 -0.02 0.00 0.01 0.04 -0.01 -0.01 0.04 0.02 -0.01 0.00 0.12 -0.02 -0.01 -0.16 0.01 -0.01 -0.18 0.01 0.00 0.29 -0.03 -0.01 -0.11 0.01 0.00 0.16 0.00 -0.01 0.00 0.01 0.00 -0.29 0.02 0.01 0.00 0.00 -0.05 0.00 0.00 -0.04 0.00 0.00 -0.05 0.00 0.00 -0.05 0.45 -0.01 -0.01 -0.46 0.01 -0.01 0.01 0.01 0.16 0.00 0.08 0.02 -0.04 0.00 -0.04 0.03 0.09 -0.06 -0.02 -0.06 -0.03 -0.03 0.05 -0.02 0.07 0.07 -0.06 0.03 -0.08 -0.05 0.01 -0.06 -0.03 -0.05 0.07 0.08 0.01 0.01 0.24 -0.07 0.08 0.14 0.06 -0.09 0.14 -0.08 0.10 0.10 -0.05 0.02 0.03 0.08 -0.09 0.10 -0.02 -0.09 0.04 0.02 0.02 -0.16 -0.04 0.00 0.28 -0.01 -0.03 0.28 -0.01 -0.07 0.01 -0.04 -0.09 -0.06 0.04 0.00 -0.04 0.04 -0.05 -0.02 -0.07 -0.08 -0.06 0.03 0.06 -0.03 -0.04 0.07 -0.04 0.01 0.07 -0.04 0.07 -0.07 0.08 -0.01 -0.01 -0.32 -0.01 -0.01 -0.31 -0.01 -0.01 -0.33 -0.01 -0.01 -0.32 -0.10 0.11 -0.01 0.09 -0.11 -0.02 0.29 0.07 0.00 -0.06 0.00 0.09 -0.05 -0.12 0.04 -0.10 0.01 0.08 0.08 -0.02 -0.05 0.11 0.11 -0.03 -0.01 -0.11 0.04 -0.12 0.01 -0.07 0.23 0.09 -0.01 0.30 0.09 -0.04 -0.07 -0.03 0.00 -0.07 -0.02 -0.04 -0.08 -0.01 0.03 0.07 0.02 -0.03 0.06 0.11 -0.01 0.07 0.02 0.03 0.05 0.11 0.01 -0.07 -0.08 0.00 0.27 0.17 -0.01 0.28 0.17 0.01 -0.06 0.01 -0.10 -0.10 0.02 -0.08 -0.05 -0.12 -0.04 0.11 0.11 0.03 0.00 -0.10 -0.04 0.08 -0.02 0.05 -0.12 0.00 0.08 0.23 0.09 0.02 0.31 0.09 0.04 -0.01 -0.01 0.00 0.02 0.01 -0.10 0.03 0.01 0.06 0.03 0.01 0.04 -0.15 -0.06 0.01 -0.15 -0.06 -0.01 0.23 -0.08 0.00 -0.04 0.01 -0.13 -0.03 0.20 -0.04 -0.08 -0.01 -0.15 0.07 0.02 0.13 0.08 -0.21 0.02 0.00 0.15 -0.09 -0.10 -0.01 0.11 0.19 -0.15 0.07 0.22 -0.22 0.06 -0.05 0.04 0.00 -0.07 0.08 -0.06 -0.07 0.08 0.06 0.04 -0.04 -0.05 -0.07 0.13 0.01 0.04 -0.03 0.05 -0.07 0.13 -0.01 0.02 -0.05 0.00 0.09 -0.04 0.01 0.09 -0.04 -0.02 -0.04 0.01 0.13 -0.08 -0.02 0.15 -0.03 0.20 0.04 0.08 -0.21 -0.03 0.00 0.15 0.09 0.07 0.03 -0.13 -0.10 -0.01 -0.11 0.19 -0.15 -0.07 0.22 -0.22 -0.06 0.01 -0.01 0.00 0.01 0.00 -0.02 0.01 0.00 -0.01 0.01 0.00 0.02 -0.12 0.14 0.02 -0.12 0.14 -0.02 0.00 0.18 0.00 0.01 0.11 0.10 0.00 0.03 0.14 0.00 0.04 -0.13 0.00 -0.04 0.23 -0.01 -0.07 -0.09 0.00 -0.05 -0.17 0.00 -0.10 -0.07 0.00 0.08 0.27 -0.01 -0.04 0.06 0.03 -0.08 0.00 0.04 -0.15 0.10 0.04 -0.14 -0.11 -0.01 0.10 0.10 0.13 -0.13 0.03 -0.01 0.11 -0.10 0.13 -0.13 -0.03 -0.11 0.00 0.00 0.11 0.25 0.01 0.11 0.25 -0.02 0.01 0.12 -0.10 0.00 0.04 0.14 0.00 0.03 -0.14 -0.01 -0.07 0.09 0.00 -0.05 0.17 0.00 -0.05 -0.23 -0.01 -0.11 0.07 0.01 0.08 -0.27 -0.01 -0.04 -0.06 -0.02 0.01 0.00 0.01 0.03 -0.09 0.01 0.04 0.06 0.01 0.03 0.03 0.00 0.03 0.19 0.00 0.04 -0.19 -0.15 0.10 0.00 0.00 0.07 0.08 0.04 -0.03 0.09 0.05 0.05 -0.05 -0.05 -0.04 0.11 -0.05 0.03 -0.05 0.04 -0.03 -0.08 0.05 -0.07 -0.07 -0.11 0.08 0.14 -0.11 0.05 0.04 -0.05 0.05 0.00 -0.08 0.11 -0.24 -0.08 0.10 0.24 0.11 -0.13 -0.26 -0.11 0.12 -0.18 0.11 -0.13 0.26 -0.12 0.12 0.18 0.03 -0.07 0.00 0.13 -0.15 -0.20 0.13 -0.15 0.20 0.00 0.07 -0.08 0.05 0.04 0.05 0.04 -0.03 -0.09 -0.05 0.02 0.05 0.04 -0.03 0.07 -0.05 -0.03 -0.11 0.05 -0.07 0.07 -0.11 0.08 -0.14 -0.11 0.05 -0.04 0.03 -0.04 0.00 0.06 -0.06 -0.02 0.05 -0.08 0.09 0.08 -0.06 -0.07 0.07 -0.03 0.11 0.07 -0.03 -0.11 0.00 0.00 0.10 0.01 0.15 0.06 -0.02 0.01 0.10 0.01 0.20 -0.16 0.00 -0.08 0.19 0.01 0.08 -0.06 0.02 0.15 -0.18 -0.02 -0.14 -0.09 0.06 0.05 0.23 0.04 0.14 0.22 -0.01 -0.01 -0.01 0.01 0.00 -0.09 0.01 0.01 -0.09 0.01 -0.03 -0.09 0.03 0.00 -0.11 -0.03 0.02 -0.09 0.04 0.06 -0.12 0.00 0.00 0.03 0.00 0.01 -0.15 0.01 0.00 -0.15 -0.01 -0.14 0.06 -0.01 -0.20 -0.16 0.02 -0.01 0.10 -0.01 -0.08 -0.06 -0.02 -0.15 -0.18 0.00 0.08 0.18 0.02 0.14 -0.09 -0.05 -0.05 0.22 -0.03 -0.14 0.22 0.01 0.01 0.15 0.00 0.00 0.18 0.00 0.00 0.14 0.00 0.00 0.14 -0.01 0.08 -0.14 0.01 -0.08 -0.14 -0.01 0.00 0.00 -0.06 -0.01 -0.03 0.05 0.02 -0.03 0.04 -0.01 0.00 -0.03 0.01 -0.03 -0.04 -0.02 0.01 0.07 0.00 0.00 0.03 0.01 0.03 -0.04 -0.04 -0.04 -0.01 -0.03 0.00 0.22 0.18 -0.01 -0.13 -0.09 0.00 -0.14 -0.07 0.00 0.14 0.09 0.00 -0.38 -0.29 0.00 0.13 0.11 0.00 -0.39 -0.29 0.01 -0.16 -0.13 0.01 0.16 0.11 0.01 0.15 0.11 -0.03 -0.06 -0.02 0.02 0.04 -0.03 -0.02 0.06 0.01 0.04 -0.04 -0.02 -0.02 0.07 -0.02 -0.02 -0.03 0.01 0.05 0.03 0.02 -0.03 -0.05 -0.05 0.07 -0.02 -0.03 0.02 -0.03 -0.02 0.00 0.06 0.05 -0.31 0.07 0.07 0.15 0.08 0.06 0.12 0.07 0.00 -0.04 0.08 0.01 0.03 -0.07 0.00 0.00 0.08 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.08 0.00 0.00 -0.38 0.04 -0.01 0.00 0.00 0.00 -0.13 0.01 0.01 -0.34 0.03 0.00 0.03 0.02 0.00 0.00 0.00 -0.01 -0.01 0.00 0.01 0.02 0.01 -0.01 -0.10 -0.08 0.00 0.02 0.01 0.01 -0.10 -0.08 0.01 -0.02 -0.02 0.00 -0.02 -0.02 -0.01 -0.02 -0.02 0.01 0.08 -0.01 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 -0.38 0.03 0.00 0.07 0.00 0.00 0.00 0.00 0.00 -0.14 0.01 0.00 -0.34 0.03 0.01 0.00 0.00 0.00 0.01 0.01 -0.06 0.02 0.01 0.03 0.02 0.01 0.02 -0.41 0.02 0.00 -0.41 0.03 0.00 0.00 0.00 0.01 0.10 -0.01 0.01 -0.03 0.00 0.00 -0.06 0.00 0.01 -0.01 0.00 -0.01 -0.01 0.01 0.00 0.16 -0.03 0.01 -0.08 0.00 -0.01 0.33 -0.02 -0.02 0.43 -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 -0.01 -0.01 0.00 0.00 0.00 0.00 0.01 0.01 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.01 0.00 -0.10 0.01 0.01 0.06 0.00 0.01 0.03 0.00 0.00 0.01 -0.01 0.00 -0.16 0.03 0.01 0.01 0.00 -0.01 0.08 0.00 -0.01 -0.33 0.02 -0.02 -0.43 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 -0.40 0.04 0.01 0.40 -0.04 0.01 0.00 0.00 0.08 -0.02 -0.04 0.15 0.01 -0.10 0.00 0.01 -0.06 0.20 0.00 -0.10 -0.17 0.01 0.17 -0.02 -0.05 -0.28 0.13 0.01 -0.11 -0.15 -0.09 0.00 -0.14 -0.09 0.17 -0.04 0.01 0.01 0.03 -0.02 0.03 -0.06 0.01 -0.03 -0.06 0.00 0.01 -0.05 -0.03 -0.01 -0.11 0.01 -0.01 -0.05 0.02 0.01 -0.11 -0.01 -0.01 0.00 0.00 0.03 -0.07 0.04 0.01 -0.07 0.01 0.04 0.15 0.00 0.05 0.20 0.00 0.10 0.00 -0.01 -0.17 -0.02 0.04 0.28 0.13 0.00 0.10 -0.16 -0.01 0.12 -0.16 0.06 0.00 -0.14 0.05 -0.17 -0.04 0.00 0.00 0.10 0.00 0.00 0.10 0.00 0.00 0.11 0.00 0.00 0.10 0.09 0.31 0.03 -0.12 -0.31 0.03 0.14 0.01 0.00 -0.16 0.01 0.00 0.06 0.00 -0.01 0.05 -0.01 0.00 -0.01 0.00 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 -0.34 0.01 0.00 -0.37 0.01 -0.01 -0.02 -0.02 0.00 -0.01 0.00 0.00 -0.01 0.00 -0.01 -0.03 -0.01 0.01 0.12 0.12 0.01 -0.02 -0.02 -0.01 0.13 0.11 -0.02 0.02 0.02 0.00 0.08 0.07 0.02 0.09 0.07 -0.01 -0.16 0.01 0.00 0.05 -0.01 -0.01 0.06 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.09 -0.01 0.00 -0.34 0.01 0.00 -0.37 0.02 0.01 0.01 0.01 0.00 -0.02 -0.01 0.08 -0.02 -0.02 -0.04 -0.03 -0.01 -0.02 -0.39 0.02 0.00 -0.38 0.03 0.00 0.00 0.00 0.00 0.13 -0.01 0.00 -0.24 0.01 0.00 -0.01 -0.01 0.00 0.04 0.00 -0.01 0.10 -0.01 0.00 -0.43 0.04 0.00 -0.03 0.01 0.00 0.22 -0.02 -0.01 -0.34 0.01 -0.01 0.00 0.00 0.00 -0.02 0.01 0.00 0.02 -0.01 0.00 -0.01 0.01 0.00 0.02 0.03 -0.01 0.01 -0.01 0.00 -0.02 -0.03 -0.01 0.00 0.00 0.00 0.02 0.02 0.01 -0.01 -0.02 0.01 -0.13 0.01 0.00 0.01 0.01 0.00 0.24 -0.01 0.00 -0.10 0.01 0.00 0.43 -0.04 0.00 -0.04 0.00 -0.01 0.03 -0.01 0.00 -0.22 0.01 -0.01 0.34 -0.01 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.25 -0.02 0.00 -0.25 0.02 0.00 -0.02 0.00 0.07 0.00 0.00 -0.03 0.02 0.03 -0.05 0.01 -0.02 -0.04 0.00 0.03 -0.04 -0.01 -0.07 0.02 0.01 0.04 -0.02 0.00 0.06 0.07 0.01 -0.06 -0.07 0.05 -0.09 -0.03 0.03 0.02 0.13 -0.16 0.20 -0.10 0.14 -0.22 -0.10 -0.13 0.16 -0.05 -0.08 0.11 -0.32 0.12 -0.17 -0.05 0.13 -0.07 -0.32 -0.01 -0.01 -0.06 -0.03 0.17 0.08 0.19 -0.05 0.08 0.03 -0.01 -0.03 -0.01 0.01 -0.04 -0.03 -0.03 -0.04 0.02 0.06 0.02 -0.03 -0.04 -0.02 0.01 -0.03 -0.03 -0.01 -0.05 0.06 0.03 0.05 -0.05 -0.02 0.08 -0.02 0.01 0.01 0.25 0.00 -0.01 0.31 0.00 -0.02 0.27 -0.02 0.00 0.25 -0.03 -0.08 0.04 0.07 0.08 0.04 -0.06 0.04 0.00 0.03 0.00 0.00 -0.01 0.01 -0.01 -0.01 -0.01 0.00 0.00 0.00 -0.02 0.00 -0.03 0.00 -0.01 0.01 0.01 -0.01 0.00 0.00 0.02 -0.02 -0.03 0.01 -0.03 -0.02 0.09 0.07 0.00 -0.05 -0.06 0.00 -0.06 -0.03 0.01 -0.04 -0.06 -0.01 0.30 0.24 0.02 -0.06 -0.04 0.01 0.29 0.25 0.02 0.03 0.03 0.00 0.43 0.32 -0.01 0.42 0.33 0.01 0.03 0.00 0.00 -0.01 -0.01 0.00 -0.01 0.01 0.01 0.00 -0.03 0.00 -0.02 0.01 -0.01 0.00 0.01 0.02 -0.01 0.01 -0.01 0.02 -0.02 0.03 0.01 -0.03 0.02 0.02 0.02 -0.02 -0.04 -0.04 0.19 -0.05 -0.06 -0.12 -0.07 -0.04 -0.11 0.02 0.01 0.00 0.02 0.01 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.02 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 -0.06 -0.01 -0.01 -0.01 0.00 0.00 0.04 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.01 -0.05 -0.04 0.00 0.05 0.04 0.00 -0.06 -0.05 0.00 0.37 0.30 -0.01 0.06 0.04 0.00 -0.37 -0.30 -0.01 0.00 0.00 0.00 0.39 0.31 0.00 -0.40 -0.31 0.00 0.01 0.00 0.00 -0.02 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.07 0.01 -0.01 0.01 0.00 0.00 0.01 0.00 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.01 0.01 -0.01 0.01 0.00 -0.01 0.01 0.01 0.00 0.00 -0.07 0.01 0.00 0.07 -0.01 0.00 0.03 0.00 0.00 -0.03 0.00 0.00 0.02 0.00 0.00 0.07 -0.01 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 -0.38 0.05 0.00 -0.04 0.00 0.00 0.42 -0.01 0.00 -0.31 0.02 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.03 0.02 0.00 0.03 0.02 0.00 -0.03 0.00 0.00 0.07 -0.01 0.00 0.02 0.00 0.00 0.05 0.00 0.00 -0.38 0.05 0.00 -0.07 0.00 0.00 -0.04 0.00 0.00 0.42 -0.01 0.00 -0.31 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 -0.01 -0.01 0.00 0.00 0.25 -0.01 0.01 0.25 -0.01 -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 0.07 -0.01 0.00 -0.07 0.00 0.00 0.04 0.00 0.00 -0.39 0.05 0.00 -0.05 0.00 -0.01 0.37 -0.01 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.01 0.00 -0.04 -0.04 0.00 -0.02 -0.01 0.00 0.04 0.04 0.00 0.00 0.00 0.00 -0.09 -0.07 0.00 0.09 0.07 0.00 0.04 0.00 0.00 -0.07 0.01 0.00 -0.07 0.00 0.00 -0.04 0.00 0.00 0.39 -0.05 0.00 0.07 0.00 0.00 0.05 0.00 -0.01 -0.38 0.01 0.00 0.26 -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 -0.32 0.02 -0.01 0.32 -0.02 -0.01 0.00 0.38 0.00 0.02 0.11 0.10 0.00 0.01 -0.05 -0.01 -0.08 0.03 0.00 0.04 -0.18 -0.01 -0.22 0.02 -0.02 -0.12 0.03 0.00 0.04 0.03 -0.01 -0.09 -0.23 -0.04 -0.26 -0.14 -0.10 -0.04 0.00 0.04 -0.03 -0.01 0.03 -0.04 0.01 0.05 0.00 -0.04 0.08 0.01 0.00 0.05 0.00 0.04 0.09 0.01 0.00 -0.02 0.02 0.00 -0.24 -0.18 -0.11 -0.24 -0.18 0.10 0.02 0.11 -0.10 -0.01 -0.08 -0.03 0.00 0.01 0.04 -0.01 -0.22 -0.02 -0.02 -0.12 -0.03 0.00 0.04 0.18 0.00 0.04 -0.03 -0.01 -0.09 0.23 -0.04 -0.26 0.14 -0.02 0.00 0.00 0.05 -0.02 -0.08 0.04 -0.01 0.15 0.06 0.00 -0.07 0.03 0.07 0.00 0.03 0.07 0.00 -0.02 0.00 0.00 0.03 0.00 0.00 0.01 0.00 0.00 -0.07 0.00 0.00 -0.08 0.00 0.00 0.04 0.00 0.00 0.39 -0.05 0.00 0.06 0.00 0.00 0.43 -0.03 -0.01 -0.22 0.02 0.00 0.01 0.00 0.00 -0.01 -0.01 0.00 -0.01 -0.01 0.00 0.01 0.01 0.00 0.04 0.03 0.00 0.01 0.01 0.00 0.05 0.03 0.00 0.00 0.00 0.00 -0.05 -0.04 0.00 -0.05 -0.04 0.00 0.03 0.00 0.00 -0.07 0.00 0.00 0.01 0.00 0.00 0.04 0.00 0.00 0.38 -0.05 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 0.42 -0.03 0.01 -0.21 0.02 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.01 0.01 0.01 0.00 0.01 -0.31 0.02 -0.01 -0.31 0.02 0.01 0.00 0.00 0.02 0.01 0.00 0.01 0.04 0.00 0.00 -0.06 0.00 -0.01 -0.08 0.00 -0.01 0.04 -0.01 0.00 0.37 -0.05 -0.01 0.05 0.00 0.01 0.43 -0.04 -0.02 -0.23 0.01 0.00 0.00 0.00 0.01 0.01 0.00 0.00 -0.01 0.00 0.00 -0.01 -0.02 -0.01 -0.03 -0.03 0.00 0.01 0.02 -0.01 0.03 0.03 0.00 0.00 0.00 0.00 0.07 0.05 -0.01 -0.07 -0.05 -0.02 -0.01 0.00 0.01 0.07 0.00 -0.01 -0.04 0.00 0.00 -0.04 0.01 0.00 -0.38 0.05 -0.01 0.08 0.00 -0.01 -0.05 0.00 0.01 -0.44 0.04 -0.02 0.23 -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 0.29 -0.02 0.01 -0.28 0.02 0.01 0.00 0.00 0.35 0.00 0.08 0.11 -0.01 0.03 -0.07 0.02 0.01 -0.08 0.02 0.04 -0.17 -0.01 -0.14 0.02 -0.08 0.02 -0.07 -0.01 0.05 0.08 -0.12 -0.14 -0.23 0.01 -0.15 0.00 0.00 0.00 0.23 0.05 -0.07 -0.02 -0.05 0.07 -0.02 0.13 -0.15 -0.13 0.07 -0.11 -0.07 -0.12 0.15 -0.14 -0.09 0.10 -0.07 -0.01 0.00 0.02 0.07 -0.12 -0.27 -0.08 0.11 -0.27 0.00 -0.08 0.11 -0.02 -0.01 -0.08 0.01 -0.03 -0.07 0.01 0.14 0.03 0.09 -0.03 -0.07 -0.02 -0.04 -0.17 0.01 -0.05 0.08 0.14 0.14 -0.23 -0.01 0.15 0.00 0.00 0.01 0.01 0.00 0.00 0.01 -0.01 0.00 0.00 0.00 -0.01 -0.03 -0.10 -0.01 0.10 0.09 0.01 0.10 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 -0.04 0.00 0.00 -0.06 0.00 0.00 -0.21 0.00 -0.01 0.06 0.00 0.00 0.25 -0.02 -0.01 0.37 -0.03 0.00 -0.01 0.00 0.00 -0.03 -0.03 0.00 0.06 0.04 0.00 0.04 0.02 0.00 0.17 0.14 0.00 -0.05 -0.04 0.00 -0.32 -0.27 0.00 0.00 0.00 0.00 -0.18 -0.14 -0.01 0.30 0.24 -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.04 -0.01 0.00 0.15 -0.01 -0.01 0.03 0.00 0.00 -0.04 0.00 0.00 -0.16 0.01 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 -0.01 0.00 0.02 -0.01 -0.01 -0.01 -0.01 0.00 -0.01 0.24 -0.01 0.00 -0.36 0.02 0.00 0.01 0.02 0.00 0.00 0.01 0.01 0.00 0.00 0.00 0.02 0.00 0.00 -0.02 0.00 -0.01 -0.03 -0.01 0.00 -0.11 -0.01 -0.01 0.03 0.00 0.00 0.14 -0.01 -0.01 0.20 -0.03 0.00 -0.02 -0.01 0.00 0.05 0.04 0.00 0.04 0.03 0.00 -0.04 -0.04 0.00 -0.33 -0.28 -0.01 -0.03 -0.02 0.00 -0.24 -0.20 0.01 -0.01 0.00 0.00 0.28 0.21 0.01 0.18 0.14 0.00 0.00 0.01 -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 -0.06 -0.01 0.00 -0.22 0.00 0.01 -0.04 0.00 0.01 0.06 0.00 0.00 0.25 -0.02 0.02 0.38 -0.04 0.00 0.01 0.01 0.00 -0.01 -0.01 0.08 -0.02 -0.03 -0.04 -0.03 -0.02 -0.04 -0.36 0.03 0.00 -0.20 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 0.00 0.01 -0.03 0.01 0.00 -0.06 0.00 0.00 -0.35 0.09 0.02 0.05 -0.01 -0.01 0.19 0.01 0.00 0.40 -0.04 0.00 0.01 0.00 0.00 0.03 0.03 0.00 -0.06 -0.05 0.00 -0.03 -0.03 0.00 -0.20 -0.16 0.00 0.05 0.04 0.00 0.37 0.30 -0.01 0.00 0.00 0.00 0.18 0.14 0.01 -0.31 -0.23 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.03 0.01 0.00 0.15 -0.04 0.01 0.01 0.00 0.00 -0.02 0.00 0.00 -0.07 -0.01 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 0.01 0.00 -0.03 0.01 0.01 0.01 0.01 0.00 0.00 0.11 -0.01 -0.01 -0.29 0.02 -0.02 0.00 -0.02 0.00 0.00 -0.01 -0.01 0.00 0.01 0.00 0.03 0.00 0.01 -0.01 0.00 0.01 -0.03 0.01 0.00 -0.18 0.05 0.01 0.02 -0.01 -0.01 0.11 0.01 0.01 0.21 -0.01 0.00 0.02 0.01 0.00 -0.06 -0.05 0.00 -0.03 -0.02 0.00 0.04 0.04 0.00 0.38 0.33 0.01 0.02 0.01 0.00 0.17 0.15 -0.01 0.01 0.00 0.00 -0.30 -0.23 -0.01 -0.12 -0.09 0.00 0.00 -0.01 0.01 0.05 0.00 -0.01 0.00 0.01 0.00 -0.06 0.00 0.00 -0.34 0.09 -0.03 -0.02 0.00 -0.01 0.04 -0.01 0.02 0.18 0.02 -0.01 0.38 -0.03 0.00 -0.01 -0.01 0.00 0.01 0.01 -0.07 0.02 0.02 0.04 0.03 0.01 0.03 -0.28 0.02 0.02 -0.16 0.01 -0.01 0.00 -0.04 0.00 0.01 0.03 0.03 0.02 0.30 -0.08 -0.02 -0.09 0.26 0.00 0.02 0.01 0.01 0.00 0.01 0.05 -0.19 0.24 -0.01 -0.22 -0.22 -0.01 0.02 -0.01 -0.04 0.01 0.10 0.00 -0.01 0.00 0.01 0.01 0.00 0.01 0.01 0.00 -0.01 0.00 0.00 -0.06 -0.06 -0.02 -0.01 0.00 -0.01 -0.06 -0.06 0.02 0.00 -0.01 0.00 0.03 0.03 0.01 0.03 0.03 -0.01 0.01 0.03 -0.03 -0.02 -0.09 -0.26 0.02 0.30 0.08 0.01 0.00 -0.01 0.05 -0.18 -0.24 0.00 0.02 -0.01 -0.02 -0.22 0.22 -0.01 0.02 0.01 -0.04 0.01 -0.10 0.01 -0.01 0.00 -0.02 0.02 0.01 -0.01 0.01 -0.05 -0.02 0.01 0.04 0.01 -0.22 0.24 0.01 -0.22 -0.24 0.01 -0.01 0.00 0.00 -0.01 -0.01 0.00 0.01 0.00 0.00 0.00 0.00 0.00 -0.01 0.01 0.00 0.02 -0.01 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 -0.03 0.01 0.00 0.02 -0.01 -0.02 0.03 0.00 0.01 -0.01 0.03 0.01 -0.02 -0.03 0.04 -0.05 0.00 -0.04 0.04 0.15 0.03 -0.04 0.00 -0.02 0.02 -0.13 -0.04 0.04 0.00 0.04 -0.08 0.03 0.05 -0.04 -0.01 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.02 0.00 0.00 -0.03 0.01 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 0.02 0.01 -0.09 0.12 0.00 0.18 -0.21 0.07 0.06 -0.19 0.58 0.14 -0.10 -0.64 0.00 -0.01 -0.01 0.00 -0.01 0.01 0.00 0.00 -0.02 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.01 0.02 0.00 0.01 0.00 0.01 0.01 0.02 0.00 0.00 -0.01 0.00 0.01 0.02 -0.01 0.01 -0.02 0.00 0.00 0.00 -0.13 0.16 -0.02 0.13 -0.16 -0.02 0.12 -0.15 -0.02 -0.22 0.30 0.26 -0.12 0.16 -0.02 0.24 -0.30 0.29 -0.01 -0.01 0.04 0.19 -0.29 0.26 -0.23 0.27 0.25 0.00 0.01 -0.02 0.00 0.01 0.01 0.00 0.00 0.00 0.00 -0.02 -0.01 -0.01 0.00 0.01 0.00 0.01 0.02 0.00 0.00 0.00 0.00 0.00 0.02 0.01 -0.02 -0.02 0.01 0.00 -0.03 -0.02 0.01 0.00 -0.02 0.00 -0.11 -0.03 0.00 -0.01 0.00 0.00 -0.01 0.00 0.01 -0.01 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 0.00 0.03 0.00 0.05 0.06 0.00 0.10 -0.06 0.00 -0.12 0.07 0.09 0.32 0.17 0.00 -0.06 -0.12 0.03 0.42 0.04 -0.03 -0.09 0.27 0.00 0.00 -0.02 -0.01 0.00 0.00 0.01 0.00 0.00 0.00 0.01 0.00 0.03 0.07 0.03 0.00 -0.01 0.00 -0.03 -0.07 0.03 0.00 0.00 0.00 -0.02 -0.01 0.01 0.02 0.02 0.01 0.00 -0.02 0.00 0.00 -0.05 0.06 0.00 0.00 0.03 0.00 0.12 0.07 -0.09 -0.32 0.16 0.00 -0.09 -0.06 0.00 0.07 -0.11 -0.03 -0.41 0.04 0.03 0.09 0.27 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.02 -0.20 0.00 0.02 -0.20 0.00 -0.04 0.00 0.00 -0.01 -0.02 0.00 -0.06 0.04 0.00 0.06 0.01 0.00 0.08 -0.04 0.00 -0.09 0.06 0.08 0.35 0.12 0.00 -0.03 -0.07 0.02 0.47 0.09 -0.03 -0.06 0.24 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.01 -0.03 -0.03 -0.01 0.00 -0.01 -0.01 -0.03 -0.02 0.01 0.00 0.00 0.00 0.02 -0.01 0.04 0.03 -0.01 -0.04 0.00 -0.01 0.02 0.00 0.06 -0.01 0.00 -0.06 -0.04 0.00 -0.10 -0.07 0.08 0.35 -0.11 0.00 0.08 0.04 0.00 -0.03 0.07 0.02 0.47 -0.08 -0.03 -0.06 -0.24 -0.01 0.02 0.00 0.02 -0.03 0.02 0.00 -0.03 0.07 0.01 -0.01 -0.08 0.00 0.04 0.14 0.00 0.04 -0.14 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 0.00 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 0.01 -0.01 0.01 -0.01 0.01 0.01 0.03 0.03 0.00 0.01 -0.02 -0.01 0.04 0.02 0.00 -0.01 0.01 -0.01 -0.11 -0.09 -0.01 -0.13 -0.09 -0.01 -0.13 -0.11 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 -0.01 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.01 0.00 0.00 0.00 0.12 0.09 -0.01 -0.10 -0.06 0.71 -0.15 -0.23 -0.39 -0.28 -0.12 -0.27 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.02 -0.06 0.00 0.06 -0.09 0.00 0.00 0.14 0.00 -0.05 0.11 0.00 -0.01 -0.04 0.04 0.18 0.21 0.00 0.01 -0.06 -0.01 -0.18 0.07 -0.01 -0.07 -0.31 0.00 0.00 0.11 0.01 -0.02 0.01 -0.01 0.02 0.01 0.01 -0.02 -0.03 0.07 -0.04 -0.07 -0.01 0.02 -0.04 -0.06 0.04 -0.07 0.00 0.00 -0.02 0.00 0.00 -0.08 0.01 0.01 -0.08 0.00 -0.02 -0.06 0.00 0.00 0.13 0.00 -0.05 -0.09 0.00 0.01 -0.04 -0.04 -0.18 0.20 0.00 0.05 0.11 0.00 -0.01 -0.06 0.01 0.18 0.07 0.01 0.07 -0.31 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.01 0.02 0.01 0.00 0.03 -0.02 -0.31 -0.33 0.02 0.31 -0.33 0.00 0.09 0.00 0.00 -0.01 -0.11 0.00 -0.04 -0.01 0.00 0.01 0.10 0.00 -0.06 0.07 0.00 -0.01 -0.04 0.05 0.32 0.21 0.00 0.05 -0.04 -0.01 -0.13 0.06 -0.01 -0.08 -0.38 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 -0.03 -0.04 -0.02 0.00 0.00 0.00 -0.03 -0.04 0.02 0.00 0.00 0.00 0.01 0.01 -0.01 0.01 0.01 0.01 0.00 -0.01 0.11 0.00 0.01 -0.10 0.00 -0.04 0.01 0.00 -0.01 0.04 0.05 0.32 -0.21 0.00 -0.06 -0.07 0.00 0.05 0.04 -0.01 -0.14 -0.06 -0.02 -0.09 0.38 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 -0.01 0.00 0.00 0.00 0.02 0.28 0.24 0.02 0.28 -0.24 -0.01 -0.01 0.00 0.00 0.02 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.01 0.00 -0.01 0.00 -0.01 0.00 0.00 0.00 0.01 0.00 0.00 -0.08 -0.03 0.00 -0.01 -0.03 0.03 -0.05 0.00 -0.02 0.03 -0.07 -0.02 0.03 0.07 -0.01 0.02 0.07 0.12 -0.10 -0.41 -0.01 0.02 -0.07 0.11 -0.10 0.41 0.03 -0.03 0.00 0.11 -0.17 0.48 0.11 -0.16 -0.47 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 0.00 -0.01 0.01 0.00 0.01 0.00 0.00 -0.08 0.03 0.00 -0.01 0.03 -0.02 0.03 0.00 0.04 -0.05 0.01 0.00 -0.04 0.11 0.03 -0.01 -0.12 0.00 0.04 0.03 0.00 0.03 -0.02 0.00 0.00 0.01 0.00 -0.06 -0.11 0.00 -0.02 0.01 0.00 -0.02 -0.01 0.00 0.03 0.03 0.00 0.04 -0.01 0.02 0.15 0.05 0.00 -0.04 0.02 0.03 0.40 0.15 0.00 0.01 -0.19 0.00 0.00 0.15 0.01 -0.01 0.02 -0.01 0.01 0.02 0.02 -0.03 -0.04 0.07 -0.08 -0.13 -0.02 0.03 -0.04 -0.07 0.08 -0.13 0.00 0.00 -0.04 0.02 -0.03 -0.04 -0.02 0.04 -0.03 0.00 0.06 -0.10 0.00 0.02 -0.01 0.00 0.02 0.01 0.00 -0.04 -0.01 -0.02 -0.14 0.04 0.00 -0.03 0.03 0.00 0.03 0.02 -0.03 -0.38 0.14 0.00 -0.01 -0.17 0.00 0.00 0.02 0.00 0.00 0.01 0.00 0.00 0.03 0.00 0.01 0.04 0.02 0.33 0.29 -0.02 -0.35 0.31 0.00 0.04 0.00 0.00 -0.01 -0.03 0.00 0.01 0.00 0.00 0.00 0.01 0.00 0.03 0.01 0.00 0.00 -0.04 0.01 0.10 0.04 0.00 -0.04 0.04 0.02 0.27 0.09 -0.01 -0.06 -0.36 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.01 -0.02 -0.05 0.00 0.00 0.00 0.01 -0.03 0.05 0.00 0.00 0.00 0.01 -0.01 0.04 0.01 -0.01 -0.03 0.00 -0.02 0.03 0.00 0.00 -0.01 0.00 0.01 0.00 0.00 0.01 0.04 0.01 0.11 -0.04 0.00 0.03 -0.01 0.00 -0.04 -0.04 0.02 0.29 -0.09 -0.01 -0.06 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.02 -0.38 -0.34 -0.02 -0.36 0.33 0.00 0.00 -0.01 0.00 -0.04 -0.05 0.00 0.02 -0.02 0.00 -0.04 -0.02 0.00 0.01 0.02 0.00 0.04 0.05 -0.04 -0.28 -0.10 0.00 0.01 -0.03 0.00 -0.01 0.01 0.01 0.13 0.51 0.00 0.00 0.09 0.01 -0.01 0.00 -0.01 0.01 0.00 0.02 -0.02 -0.01 0.05 -0.10 -0.16 -0.02 0.02 -0.01 -0.05 0.10 -0.16 0.00 0.00 -0.03 0.04 -0.06 0.06 -0.05 0.06 0.07 0.00 0.04 -0.05 0.00 0.04 -0.02 0.00 -0.02 -0.02 0.00 -0.04 0.05 0.04 0.28 -0.10 0.00 -0.01 0.02 0.00 -0.01 -0.03 0.00 0.01 0.01 -0.01 -0.13 0.51 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.02 0.00 0.00 0.03 -0.01 -0.18 -0.18 0.01 0.18 -0.18 0.00 0.00 -0.02 0.00 0.04 0.04 0.00 0.03 -0.03 0.00 0.01 0.02 0.00 0.02 0.01 0.00 -0.02 -0.02 0.00 -0.09 -0.01 0.00 -0.02 0.01 0.00 0.05 0.01 0.00 -0.04 -0.11 0.00 0.00 -0.03 0.02 -0.02 -0.04 -0.02 0.02 -0.04 0.01 -0.01 0.05 0.13 -0.14 -0.33 -0.01 0.01 0.05 -0.13 0.15 -0.33 0.00 0.00 -0.04 0.15 -0.22 0.49 -0.16 0.21 0.49 0.00 -0.04 0.04 0.00 -0.01 0.02 0.00 -0.03 -0.03 0.00 0.02 -0.02 0.00 0.08 -0.01 0.00 -0.02 0.00 0.00 0.02 0.01 0.00 -0.04 0.01 0.00 0.04 -0.11 0.00 0.00 0.01 0.00 0.00 0.02 0.00 -0.02 0.04 -0.02 0.01 0.04 0.00 0.06 0.05 0.00 -0.06 0.05 0.00 -0.01 0.00 0.00 0.06 0.03 0.00 0.11 -0.12 0.00 -0.01 0.04 0.00 0.07 0.05 0.00 -0.01 -0.02 -0.05 -0.42 -0.09 0.00 -0.07 0.02 0.02 0.25 0.10 0.00 0.00 0.01 0.00 0.00 -0.01 -0.02 0.03 -0.02 0.02 -0.03 -0.02 -0.01 0.01 0.01 -0.05 0.04 0.01 0.01 -0.01 0.01 0.05 -0.04 0.01 0.00 0.00 0.15 -0.10 0.15 -0.26 0.11 -0.14 -0.26 -0.01 -0.05 0.02 0.00 0.02 0.04 0.00 -0.11 -0.12 0.00 0.00 -0.02 0.05 0.44 -0.10 0.00 -0.07 0.05 0.00 0.07 0.02 -0.02 -0.28 0.11 0.00 -0.01 0.04 0.00 0.00 -0.06 0.00 0.00 -0.08 -0.01 0.01 -0.11 0.01 -0.02 -0.12 0.01 0.16 0.11 -0.01 -0.17 0.11 0.00 0.18 0.00 0.00 -0.03 -0.16 0.00 -0.01 -0.01 0.00 -0.09 -0.01 0.00 -0.01 0.03 0.00 0.05 0.06 -0.06 -0.40 -0.12 0.00 0.01 -0.01 0.02 0.33 0.14 0.01 0.11 0.35 -0.02 0.01 0.00 0.01 0.00 -0.02 0.01 0.00 0.02 0.00 0.00 0.01 0.05 -0.03 -0.10 0.00 0.00 -0.01 0.06 -0.04 0.13 0.00 0.00 0.00 0.01 -0.03 0.06 0.02 -0.04 -0.09 0.00 -0.04 0.16 0.00 -0.09 0.01 0.00 -0.02 0.00 0.00 0.05 -0.06 -0.05 -0.37 0.11 0.00 -0.02 -0.03 0.00 0.02 0.01 0.02 0.31 -0.13 0.01 0.11 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.03 -0.03 0.00 -0.05 0.05 0.00 0.00 -0.01 0.00 -0.03 -0.02 0.00 0.01 0.02 0.03 0.20 0.05 0.00 0.03 -0.01 -0.01 -0.07 -0.03 0.00 0.00 -0.02 0.00 0.00 0.04 -0.03 0.03 -0.09 0.03 -0.03 -0.09 0.01 -0.01 0.06 0.15 -0.13 -0.52 -0.01 0.01 0.06 -0.14 0.13 -0.50 0.00 0.00 0.28 -0.04 0.06 -0.06 0.06 -0.06 -0.08 0.00 0.03 -0.03 0.00 -0.01 -0.01 0.00 0.05 0.06 0.00 -0.01 0.01 -0.04 -0.22 0.06 0.00 0.03 -0.02 0.00 -0.03 -0.01 0.01 0.08 -0.03 0.00 0.00 -0.03 0.00 0.00 -0.11 0.01 0.01 -0.16 -0.03 0.01 -0.20 0.01 -0.03 -0.22 0.00 -0.06 -0.04 0.00 0.06 -0.04 0.01 0.08 0.00 -0.01 -0.14 0.02 0.00 0.03 0.02 0.00 0.01 -0.02 0.00 0.05 0.01 0.00 0.02 -0.05 0.02 0.31 0.08 0.00 -0.02 0.00 -0.01 -0.28 -0.10 0.00 0.09 0.28 -0.13 0.16 0.00 0.04 -0.05 -0.05 0.04 -0.05 0.05 0.03 -0.04 0.06 0.12 -0.17 -0.29 0.03 -0.04 -0.06 0.12 -0.16 0.28 -0.05 0.06 0.00 -0.03 0.03 -0.11 -0.03 0.03 0.11 -0.01 -0.14 -0.02 0.00 0.01 0.02 0.00 0.03 -0.02 0.00 0.02 0.05 0.02 0.31 -0.08 0.00 0.05 0.00 0.00 -0.02 0.00 -0.01 -0.28 0.10 0.00 0.09 -0.28 0.01 -0.01 0.00 -0.04 0.04 -0.01 0.00 0.03 -0.06 -0.02 0.01 0.06 -0.01 -0.06 -0.04 -0.01 -0.06 0.04 0.00 0.00 -0.01 0.00 0.08 -0.02 -0.01 -0.13 -0.02 0.00 0.02 0.00 0.00 -0.08 -0.02 0.00 -0.01 0.05 -0.03 -0.29 -0.11 0.00 0.04 0.03 0.03 0.46 0.16 0.00 -0.07 -0.22 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.01 0.00 0.00 0.00 0.01 0.00 0.01 0.00 0.00 -0.01 0.00 0.01 -0.01 0.00 -0.01 -0.02 0.00 -0.08 -0.02 0.00 -0.02 0.00 0.01 0.13 -0.01 0.00 0.01 0.05 0.03 0.29 -0.10 0.00 0.08 -0.02 0.00 -0.04 0.03 -0.03 -0.46 0.16 0.00 0.07 -0.21 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 -0.24 -0.15 0.02 0.24 -0.15 0.01 -0.12 0.00 0.00 0.09 0.01 0.00 -0.03 -0.07 0.00 0.04 0.02 0.00 -0.04 0.00 0.00 -0.02 0.02 -0.03 -0.32 -0.10 0.00 -0.01 0.03 0.02 0.31 0.12 0.00 -0.08 -0.26 -0.10 0.16 0.00 0.05 -0.07 -0.12 0.05 -0.07 0.11 0.05 -0.06 0.11 0.01 0.02 0.06 0.05 -0.06 -0.11 0.01 0.03 -0.07 -0.12 0.16 0.00 0.02 -0.04 0.04 0.03 -0.05 -0.05 0.00 0.09 -0.01 0.00 0.04 -0.02 0.00 -0.03 0.07 0.00 -0.02 -0.02 -0.03 -0.32 0.10 0.00 -0.04 0.00 0.00 -0.01 -0.03 0.02 0.32 -0.12 0.00 -0.08 0.27 0.03 -0.04 0.00 -0.12 0.12 -0.01 0.01 0.09 -0.13 -0.06 0.00 0.13 0.01 0.18 0.14 0.01 0.17 -0.13 0.00 -0.06 0.00 0.00 0.10 -0.04 0.00 0.05 0.18 -0.01 -0.14 -0.07 -0.01 -0.10 -0.05 0.00 0.02 0.13 0.03 0.35 0.10 0.01 0.11 -0.13 -0.02 -0.17 -0.07 0.01 -0.04 -0.12 -0.03 0.05 0.00 0.01 -0.02 -0.04 0.02 -0.02 0.03 0.02 -0.02 0.04 -0.01 0.00 0.03 0.02 -0.02 -0.04 -0.01 0.01 -0.03 -0.04 0.05 0.00 0.00 -0.01 0.00 0.01 -0.01 0.00 0.00 0.10 0.04 -0.01 -0.14 0.07 0.00 0.05 -0.18 0.00 0.02 -0.13 0.03 0.35 -0.10 -0.01 -0.10 0.05 0.01 0.11 0.13 -0.02 -0.17 0.07 0.01 -0.04 0.12 0.01 -0.01 0.00 -0.04 0.04 0.00 0.01 0.03 -0.04 -0.02 0.00 0.04 -0.02 -0.32 -0.25 -0.02 -0.32 0.25 -0.01 0.05 0.00 0.00 -0.04 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 -0.02 0.02 0.08 0.03 0.00 -0.01 0.00 -0.01 -0.10 -0.04 0.00 0.03 0.10 0.04 -0.06 0.00 0.01 -0.02 -0.04 0.01 -0.02 0.04 0.00 0.00 -0.02 -0.16 0.17 0.41 0.00 0.00 0.02 -0.16 0.18 -0.41 -0.07 0.09 0.00 0.14 -0.18 0.39 0.14 -0.19 -0.40 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.02 0.01 0.08 -0.03 0.00 0.02 0.00 0.00 -0.01 0.00 -0.01 -0.10 0.04 0.00 0.03 -0.10 0.02 -0.03 0.00 -0.08 0.09 -0.01 0.02 0.07 -0.08 -0.05 -0.01 0.08 0.00 -0.04 -0.03 0.00 -0.04 0.03 0.00 0.00 0.22 0.00 0.16 -0.16 0.01 0.16 0.11 -0.01 -0.14 -0.01 0.00 -0.09 -0.01 0.00 0.01 0.17 -0.02 -0.16 -0.01 0.01 0.09 -0.16 -0.01 -0.08 -0.01 0.00 -0.07 -0.21 0.00 0.00 -0.13 0.01 -0.02 -0.03 -0.01 0.02 -0.04 -0.02 0.02 0.02 -0.04 0.05 0.12 0.02 -0.02 0.02 0.04 -0.06 0.13 0.00 0.00 0.01 0.03 -0.04 0.16 -0.03 0.03 0.16 0.00 -0.15 -0.16 0.01 0.14 -0.01 -0.01 -0.16 0.11 0.00 -0.01 0.17 0.02 0.16 -0.01 0.00 0.09 -0.01 0.00 -0.09 -0.16 0.01 0.08 -0.01 0.00 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.01 -0.01 0.00 -0.01 0.02 0.34 0.22 -0.02 -0.34 0.22 0.00 0.00 0.29 -0.01 -0.11 0.00 0.00 -0.02 -0.11 0.00 -0.04 -0.02 0.00 -0.04 0.02 0.00 0.04 -0.03 0.02 0.29 0.09 0.00 0.01 0.05 0.02 0.34 0.15 0.00 0.10 0.22 0.00 0.00 -0.17 0.02 -0.03 -0.05 -0.02 0.03 -0.06 -0.03 0.03 0.02 -0.04 0.08 0.15 0.03 -0.03 0.02 0.04 -0.09 0.16 0.00 0.00 0.03 0.04 -0.05 0.22 -0.04 0.05 0.22 0.01 0.11 0.00 0.00 0.04 -0.02 0.00 0.02 -0.11 0.00 -0.04 -0.04 -0.02 -0.29 0.09 0.00 0.04 0.02 0.00 -0.01 0.04 -0.02 -0.34 0.15 0.00 -0.11 0.22 0.00 0.00 -0.02 -0.01 -0.01 0.02 0.01 0.00 0.01 0.00 0.01 0.01 -0.01 -0.15 -0.07 0.01 0.15 -0.07 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 0.00 0.00 0.01 0.00 0.00 0.00 0.00 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 0.01 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 -0.02 0.00 -0.01 0.02 -0.01 0.01 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 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.01 0.01 0.01 0.14 0.20 0.15 -0.58 -0.27 -0.10 -0.47 -0.10 -0.25 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.03 0.00 0.00 0.01 -0.03 0.00 -0.02 0.02 0.00 0.01 0.02 0.00 0.03 0.01 0.00 -0.02 -0.03 0.00 -0.06 0.00 0.00 0.00 -0.01 -0.01 -0.12 -0.04 0.00 0.00 0.09 0.06 -0.08 0.00 -0.01 0.02 -0.15 -0.01 0.02 0.15 0.00 0.00 0.16 -0.17 0.21 0.25 0.00 0.00 -0.16 -0.17 0.21 -0.25 0.05 -0.07 0.00 -0.19 0.23 -0.33 -0.18 0.23 0.33 0.00 0.01 0.03 0.00 0.01 -0.02 0.00 -0.02 -0.02 0.00 -0.02 0.03 0.00 -0.06 0.00 0.00 0.04 -0.01 0.00 0.00 0.01 -0.01 -0.13 0.04 0.00 0.00 -0.08 -0.03 0.04 0.00 0.19 -0.21 0.01 -0.08 -0.14 0.00 0.12 0.08 0.02 0.00 -0.08 -0.07 0.00 -0.08 0.07 0.00 0.00 -0.13 0.01 0.08 0.12 0.00 0.00 -0.08 -0.01 -0.10 -0.02 -0.01 -0.10 0.04 0.00 -0.02 -0.03 0.04 0.38 0.15 0.01 0.13 -0.04 0.01 0.19 0.14 0.00 0.06 0.34 0.00 0.00 0.04 -0.01 0.01 0.01 0.01 -0.01 0.02 0.01 -0.01 0.00 0.02 -0.01 -0.05 -0.01 0.01 0.00 -0.02 0.02 -0.06 0.00 0.00 -0.02 -0.02 0.02 -0.07 0.02 -0.02 -0.07 -0.01 -0.08 0.10 0.01 0.09 -0.02 0.00 0.00 -0.07 0.00 0.02 -0.03 -0.03 -0.33 0.14 0.00 0.09 0.04 -0.01 -0.13 -0.05 -0.01 -0.14 0.12 0.00 -0.06 0.34 0.00 0.00 0.00 0.00 -0.01 0.02 0.01 0.00 0.01 0.01 0.01 0.02 0.01 0.20 0.26 -0.01 -0.18 0.25 0.00 -0.05 -0.01 0.00 0.04 -0.09 0.00 -0.06 0.08 0.01 0.08 0.06 0.01 0.10 0.02 0.00 -0.06 -0.01 -0.04 -0.39 -0.10 0.00 0.00 -0.05 -0.02 -0.38 -0.13 -0.01 -0.07 -0.02 -0.01 0.03 0.00 0.00 0.00 0.04 0.00 0.00 -0.03 0.01 -0.01 -0.02 0.06 -0.05 -0.10 0.01 -0.01 0.02 0.06 -0.05 0.09 -0.02 0.03 0.00 0.02 -0.03 0.01 0.02 -0.03 -0.02 0.00 0.03 0.10 0.01 0.09 -0.06 0.00 -0.05 -0.09 0.00 -0.06 0.00 -0.04 -0.42 0.11 0.01 0.11 -0.02 0.00 -0.01 0.04 -0.02 -0.39 0.14 -0.01 -0.08 0.06 0.01 -0.02 0.00 -0.12 0.13 -0.01 0.06 0.09 0.04 -0.08 -0.06 -0.05 -0.01 -0.19 -0.11 -0.01 -0.20 0.13 0.00 -0.03 0.00 0.00 0.06 0.01 0.00 -0.03 -0.07 0.00 -0.04 0.03 0.00 -0.02 0.04 0.00 -0.03 -0.08 0.01 0.11 0.09 0.00 0.06 -0.01 0.00 0.04 0.07 0.00 0.05 0.31 0.02 -0.02 0.00 -0.01 0.02 0.01 -0.01 0.02 -0.01 0.01 -0.01 0.02 0.00 0.00 -0.04 0.01 -0.01 -0.02 0.00 0.00 0.04 0.00 0.01 0.00 -0.02 0.03 -0.08 -0.02 0.03 0.08 0.00 0.06 -0.01 0.00 -0.04 -0.03 0.00 -0.03 0.07 0.00 -0.03 0.08 0.01 0.11 -0.09 0.00 -0.02 -0.04 0.00 0.06 0.01 0.00 0.04 -0.07 0.00 0.05 -0.31 0.03 -0.02 0.00 -0.34 0.41 -0.05 0.18 0.13 0.26 -0.34 -0.18 -0.19 -0.01 -0.12 -0.18 -0.01 -0.13 0.17 0.00 0.03 0.00 0.00 -0.05 0.00 0.00 0.02 0.04 0.00 0.01 -0.03 0.00 0.01 -0.03 0.00 0.03 0.05 0.00 -0.02 -0.05 0.00 -0.05 0.01 0.00 0.01 -0.04 0.00 -0.02 -0.20 0.02 -0.03 0.00 -0.01 0.01 -0.02 -0.01 0.01 0.01 0.00 -0.01 0.03 -0.02 0.03 0.01 0.00 0.00 -0.02 -0.02 0.02 -0.01 0.02 -0.01 0.00 -0.03 0.05 -0.08 -0.03 0.03 0.05 0.00 -0.05 0.00 0.00 0.01 0.03 0.00 0.02 -0.04 0.00 0.03 -0.05 0.00 -0.02 0.05 0.00 0.01 0.03 0.00 -0.05 -0.01 0.00 0.01 0.04 0.00 -0.02 0.20 0.04 0.00 -0.02 -0.23 0.37 -0.18 0.12 -0.21 0.38 -0.60 -0.15 -0.02 0.01 0.11 0.14 0.01 0.11 -0.14 0.00 0.02 0.00 0.00 -0.02 0.00 0.00 0.01 0.02 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.01 0.02 0.00 0.00 -0.02 0.00 -0.02 0.01 0.00 0.01 -0.01 0.00 -0.01 -0.09 0.02 -0.03 0.00 -0.01 0.01 0.00 -0.01 0.01 0.01 0.00 0.00 0.02 -0.01 0.01 -0.01 0.01 -0.01 -0.03 -0.02 0.02 0.00 0.00 -0.02 -0.01 -0.02 0.02 -0.04 -0.04 0.04 0.09 0.00 -0.02 0.00 0.00 0.00 0.01 0.00 0.01 -0.02 0.00 0.01 -0.02 0.00 0.00 0.02 0.00 0.00 0.01 0.00 -0.02 -0.01 0.00 0.01 0.01 0.00 -0.01 0.08 -0.02 -0.05 0.03 -0.30 0.19 0.21 0.16 0.66 -0.09 0.36 -0.12 -0.41 0.00 0.05 0.06 0.00 0.06 -0.07 0.00 0.00 -0.09 0.00 -0.06 0.11 0.01 0.15 -0.01 0.00 -0.06 -0.11 0.00 -0.04 -0.05 0.00 0.09 0.14 0.02 0.24 -0.02 0.00 -0.07 0.01 0.01 0.22 0.02 0.01 0.00 -0.39 0.00 0.00 0.01 -0.01 0.02 0.02 0.01 -0.02 0.02 0.01 -0.02 0.01 0.03 -0.03 -0.09 -0.01 0.02 0.01 -0.03 0.03 -0.09 0.00 0.00 -0.02 -0.02 0.02 -0.09 0.02 -0.02 -0.09 0.00 0.06 0.11 0.00 0.06 -0.11 -0.01 -0.15 -0.02 0.00 -0.09 0.14 -0.02 -0.25 -0.02 0.00 0.04 -0.05 0.00 0.07 0.01 -0.01 -0.22 0.02 0.00 0.01 -0.39 0.00 0.00 0.00 0.00 0.00 0.01 0.00 -0.01 0.01 -0.01 0.00 0.02 -0.01 -0.23 -0.27 0.01 0.23 -0.27 0.00 0.00 -0.09 0.00 0.01 0.02 0.00 0.00 0.00 0.00 -0.01 -0.02 0.00 0.01 0.00 0.00 0.01 0.02 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 -0.01 -0.01 0.00 0.00 -0.05 0.00 0.00 0.19 0.06 -0.07 -0.12 -0.06 0.07 -0.11 -0.06 0.07 -0.07 -0.15 0.16 0.46 0.05 -0.07 -0.07 0.14 -0.16 0.45 0.00 0.00 0.14 0.09 -0.12 0.39 -0.09 0.12 0.38 0.00 -0.01 0.02 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 -0.01 0.02 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 -0.01 0.00 0.00 -0.05 0.00 0.00 -0.03 0.00 0.00 -0.03 0.00 -0.01 -0.03 -0.01 0.00 -0.04 0.00 -0.01 -0.02 0.00 0.01 -0.02 -0.01 0.01 0.00 0.00 0.05 -0.03 0.00 -0.01 0.05 -0.01 -0.07 0.00 0.00 0.03 -0.03 0.00 0.04 -0.04 0.01 0.11 0.06 0.00 -0.07 0.07 0.00 0.00 -0.05 0.00 0.06 0.04 0.14 -0.19 0.01 -0.10 0.12 0.09 -0.10 0.13 -0.11 0.11 -0.14 0.06 0.04 -0.04 -0.30 0.11 -0.14 -0.06 0.05 -0.05 0.32 -0.19 0.25 0.00 0.01 -0.02 -0.25 0.01 -0.02 0.25 0.00 0.05 0.03 0.00 -0.06 0.00 0.00 -0.01 -0.05 0.00 0.03 0.04 0.01 0.11 -0.06 0.00 0.03 0.03 0.00 -0.06 -0.07 0.00 0.01 0.04 0.00 0.06 -0.04 0.01 -0.02 0.00 0.16 -0.16 -0.03 -0.12 -0.12 -0.24 0.08 0.11 0.27 0.01 0.13 0.11 0.01 0.13 -0.11 0.00 -0.08 0.00 0.01 0.18 -0.10 0.00 -0.05 0.12 -0.01 -0.16 0.02 0.01 0.10 -0.07 0.01 0.08 -0.12 0.02 0.23 0.17 -0.01 -0.16 0.16 0.00 -0.05 -0.12 0.01 0.14 0.13 -0.07 0.11 0.00 0.04 -0.06 -0.03 0.04 -0.06 0.03 -0.04 0.06 -0.03 0.00 0.00 0.11 -0.04 0.06 0.03 -0.01 0.00 -0.12 0.07 -0.09 0.00 0.01 0.00 0.11 0.00 0.00 -0.11 0.01 0.18 0.10 -0.01 -0.16 -0.02 0.00 -0.05 -0.12 0.01 0.08 0.12 0.02 0.23 -0.16 0.00 0.10 0.07 -0.01 -0.16 -0.16 0.00 -0.05 0.12 0.01 0.14 -0.13 -0.01 0.01 0.00 -0.05 0.05 0.01 0.04 0.03 0.08 -0.03 -0.04 -0.09 0.02 0.27 0.23 0.02 0.27 -0.23 0.00 0.00 0.01 -0.01 -0.21 0.08 0.00 -0.01 -0.10 0.01 0.19 -0.03 0.00 -0.04 0.08 -0.01 -0.08 0.13 -0.03 -0.28 -0.20 0.01 0.14 -0.16 0.00 -0.08 0.08 -0.01 -0.16 -0.19 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 -0.02 0.00 -0.01 -0.01 0.00 -0.01 -0.02 0.00 0.01 0.00 0.00 0.00 0.02 0.01 -0.01 0.03 -0.01 0.01 0.03 0.01 0.21 0.08 -0.01 -0.19 -0.03 0.00 0.01 -0.10 0.01 0.07 0.13 0.03 0.28 -0.20 0.00 0.04 0.08 -0.01 -0.13 -0.16 0.00 0.08 0.08 0.01 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 0.02 0.29 0.21 -0.02 -0.29 0.21 0.00 0.03 0.00 0.00 0.07 0.04 -0.01 -0.15 -0.22 -0.01 -0.14 -0.10 0.01 0.22 0.15 0.00 0.08 0.18 0.02 0.21 0.01 0.00 -0.06 -0.09 -0.01 -0.36 -0.02 0.01 -0.01 -0.28 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 -0.01 0.00 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 0.00 0.00 0.07 -0.04 -0.01 -0.14 0.10 -0.01 -0.15 0.22 0.00 0.08 -0.18 0.02 0.21 -0.01 0.01 0.22 -0.15 0.00 -0.07 0.09 -0.01 -0.36 0.02 0.00 -0.01 0.28 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 -0.14 0.04 -0.01 -0.14 -0.04 0.00 0.00 0.04 0.01 0.08 0.03 -0.01 -0.22 -0.13 -0.01 -0.12 -0.08 0.01 0.20 0.12 0.00 0.06 0.15 0.01 0.17 0.01 0.00 -0.05 -0.07 -0.02 -0.39 -0.07 0.00 -0.01 -0.22 0.00 0.00 0.01 0.01 -0.01 -0.08 -0.01 0.00 -0.08 0.02 -0.03 0.11 -0.04 0.06 0.05 -0.02 0.03 0.11 0.04 -0.06 0.04 0.00 0.00 -0.09 -0.07 0.09 -0.15 0.07 -0.09 -0.15 -0.01 -0.08 0.03 0.01 0.12 -0.08 0.01 0.23 -0.13 0.00 -0.07 0.15 -0.01 -0.17 0.01 -0.01 -0.20 0.12 0.00 0.05 -0.07 0.02 0.39 -0.06 0.00 0.01 -0.22 0.00 0.00 0.01 -0.01 0.00 0.02 0.00 0.02 0.01 0.02 0.00 0.00 0.01 0.09 -0.05 -0.01 -0.09 -0.05 0.00 0.00 -0.01 0.00 -0.05 -0.02 0.00 0.08 0.04 0.00 0.06 0.03 0.00 -0.07 -0.04 0.00 -0.03 -0.04 -0.01 -0.08 -0.02 0.00 0.03 0.02 0.01 0.13 0.03 0.00 -0.01 0.06 0.00 0.00 0.15 0.03 -0.04 -0.25 -0.03 0.04 -0.24 0.05 -0.06 0.28 -0.15 0.17 0.22 -0.05 0.07 0.28 0.14 -0.17 0.22 0.00 -0.01 -0.21 -0.17 0.20 -0.31 0.16 -0.20 -0.32 0.00 0.05 -0.02 0.00 -0.06 0.03 0.00 -0.08 0.04 0.00 0.03 -0.04 0.01 0.08 -0.02 0.00 0.07 -0.04 0.00 -0.03 0.01 -0.01 -0.13 0.02 0.00 0.01 0.06 0.00 0.00 0.03 -0.02 0.00 0.05 0.01 0.05 0.01 0.04 0.00 0.00 0.00 -0.02 0.03 0.00 0.02 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 0.00 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 0.00 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 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 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 0.00 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 -0.02 -0.02 -0.05 0.54 0.50 0.25 -0.40 0.12 0.16 0.09 -0.39 0.15 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 0.00 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 0.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 -0.01 0.00 0.01 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.05 -0.02 -0.41 -0.39 -0.20 -0.55 0.20 0.23 0.12 -0.43 0.18 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 0.00 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 0.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.01 0.01 -0.01 0.01 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.07 0.00 -0.05 -0.02 -0.02 0.56 -0.17 -0.23 0.16 -0.69 0.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 -0.01 0.01 -0.01 0.00 0.00 0.00 0.04 -0.05 -0.04 0.14 -0.17 0.12 0.01 -0.02 0.01 0.04 -0.04 -0.03 0.00 0.00 0.00 -0.49 0.62 0.45 -0.17 0.21 -0.15 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 0.02 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.03 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.01 0.01 0.00 0.01 0.00 0.00 0.02 -0.02 0.00 0.01 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.01 0.00 0.00 0.02 -0.06 0.00 0.00 0.00 0.00 0.02 -0.07 -0.01 -0.07 0.01 0.00 0.00 0.00 0.01 -0.01 0.00 -0.01 0.02 0.01 -0.01 0.02 0.01 -0.06 0.08 -0.06 0.04 -0.05 0.04 0.15 -0.19 -0.13 0.00 0.00 0.00 0.16 -0.20 -0.14 -0.48 0.61 -0.44 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 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.02 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 -0.01 0.00 -0.01 0.01 0.00 0.04 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.01 -0.04 0.00 -0.02 0.00 0.00 -0.02 0.07 0.00 0.02 0.02 0.00 -0.16 0.51 0.02 0.23 -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 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 -0.01 0.00 0.00 0.00 -0.02 0.02 0.02 -0.04 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 -0.03 -0.07 0.00 0.01 0.04 0.00 0.02 -0.02 0.00 -0.16 -0.52 0.02 0.24 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 -0.26 0.28 -0.01 -0.25 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.01 -0.04 0.00 -0.02 0.00 0.00 -0.03 0.09 0.00 0.02 0.03 0.00 -0.14 0.46 0.02 0.29 -0.06 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 -0.01 0.00 -0.01 0.00 0.01 -0.01 -0.01 0.00 0.00 0.00 0.04 -0.05 -0.03 -0.05 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.03 0.09 0.00 -0.01 -0.04 0.00 -0.02 0.03 0.00 0.14 0.45 -0.02 -0.29 -0.06 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 0.27 -0.30 -0.02 -0.27 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.02 0.00 -0.01 0.03 0.00 -0.04 0.01 -0.01 -0.07 0.20 0.00 0.01 0.01 0.00 0.11 -0.35 0.04 0.51 -0.10 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 0.03 -0.02 0.00 0.00 0.00 -0.02 0.02 0.02 0.00 0.00 0.00 -0.02 0.02 0.02 -0.02 0.03 -0.02 0.00 0.00 0.00 0.00 0.01 0.02 0.00 0.00 0.00 0.00 -0.05 -0.01 -0.01 -0.07 -0.22 0.00 -0.01 -0.03 0.00 0.01 -0.01 0.00 0.12 0.37 0.04 0.52 0.11 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 -0.11 0.11 -0.01 -0.11 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.02 0.00 -0.01 0.04 0.00 -0.04 0.01 -0.01 -0.07 0.20 0.00 0.01 0.00 0.00 0.13 -0.42 0.04 0.51 -0.10 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 -0.02 0.02 0.00 0.00 0.00 -0.02 0.02 0.02 0.00 0.00 0.00 0.02 -0.03 -0.02 -0.02 0.03 -0.02 0.00 0.00 0.00 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 0.04 0.01 0.01 0.07 0.20 0.00 0.01 0.04 0.00 -0.01 0.00 0.00 -0.13 -0.40 -0.03 -0.48 -0.10 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 0.05 -0.05 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.03 0.00 -0.01 0.02 0.00 0.01 0.00 0.02 0.11 -0.32 0.00 0.03 0.03 0.00 0.06 -0.18 -0.01 -0.10 0.02 0.00 0.00 0.00 -0.01 0.01 -0.01 -0.01 0.01 0.01 0.00 0.01 0.00 0.13 -0.16 0.12 0.00 0.00 0.00 0.10 -0.13 -0.09 0.00 0.00 0.00 0.05 -0.06 -0.04 0.03 -0.04 0.03 0.00 0.00 0.00 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 0.01 0.00 0.02 0.14 0.42 0.00 -0.01 -0.02 0.00 0.03 -0.03 0.00 0.08 0.24 -0.01 -0.12 -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 -0.02 -0.36 0.39 -0.02 -0.28 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.04 0.00 -0.01 0.02 0.00 0.01 0.00 0.02 0.14 -0.42 0.00 0.03 0.03 0.00 0.09 -0.26 -0.01 -0.12 0.03 0.00 0.00 0.00 0.01 -0.01 0.01 -0.01 0.01 0.01 0.00 0.00 0.00 -0.08 0.10 -0.07 0.00 0.01 0.00 0.11 -0.13 -0.09 0.00 0.00 0.00 -0.04 0.05 0.04 0.05 -0.06 0.04 0.00 0.00 0.00 0.00 0.01 0.03 0.00 0.00 0.00 0.00 -0.01 0.00 -0.02 -0.11 -0.34 0.00 0.01 0.02 0.00 -0.02 0.03 0.00 -0.07 -0.21 0.01 0.08 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 0.02 0.28 -0.30 -0.02 -0.36 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 0.02 0.00 -0.01 -0.05 0.15 0.00 0.01 0.02 0.00 0.03 -0.09 -0.02 -0.24 0.05 0.00 0.00 0.00 0.03 -0.03 0.03 0.02 -0.03 -0.02 0.01 -0.01 -0.01 -0.32 0.39 -0.29 0.01 -0.01 0.01 -0.26 0.31 0.23 0.00 0.00 0.00 -0.08 0.11 0.08 -0.06 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.03 0.01 -0.01 -0.06 -0.17 0.00 0.00 -0.01 0.00 0.02 -0.02 0.00 0.04 0.12 -0.02 -0.30 -0.06 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 -0.21 0.23 -0.01 -0.16 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.02 0.00 0.00 0.01 0.00 0.03 -0.01 -0.01 -0.07 0.22 0.00 0.02 0.02 0.00 0.04 -0.12 -0.02 -0.30 0.06 0.00 0.00 0.00 -0.02 0.03 -0.02 0.03 -0.03 -0.02 -0.01 0.01 0.01 0.25 -0.31 0.22 0.01 -0.01 0.01 -0.31 0.38 0.28 0.00 0.00 0.00 0.08 -0.10 -0.08 -0.10 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 -0.02 0.00 0.01 0.06 0.17 0.00 0.00 0.01 0.00 -0.01 0.02 0.00 -0.03 -0.10 0.02 0.23 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 0.01 0.16 -0.18 -0.01 -0.20 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 -0.02 0.00 0.02 0.13 -0.40 0.00 -0.01 -0.01 0.00 -0.01 0.04 0.01 0.21 -0.04 0.00 0.00 0.00 0.02 -0.02 0.02 0.01 -0.02 -0.01 0.00 -0.01 -0.01 -0.24 0.29 -0.21 0.00 0.00 0.00 -0.17 0.21 0.15 0.00 0.00 0.00 -0.05 0.06 0.05 -0.03 0.04 -0.03 0.00 0.00 0.00 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 -0.03 0.00 0.03 0.18 0.55 0.00 0.00 0.01 0.00 -0.01 0.01 0.00 -0.02 -0.06 0.02 0.30 0.06 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 0.12 -0.13 0.00 0.08 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 -0.05 0.00 0.00 0.01 0.00 0.03 0.00 -0.03 -0.18 0.54 0.00 0.01 0.01 0.00 0.02 -0.07 -0.02 -0.28 0.06 0.00 0.00 0.00 0.02 -0.02 0.01 -0.02 0.03 0.02 0.00 -0.01 -0.01 -0.18 0.22 -0.16 -0.01 0.01 -0.01 0.25 -0.31 -0.22 0.00 0.00 0.00 -0.05 0.06 0.05 0.07 -0.08 0.06 0.00 0.00 0.00 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 -0.02 0.00 0.02 0.12 0.37 0.00 0.00 0.01 0.00 -0.01 0.01 0.00 -0.02 -0.06 0.01 0.20 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 0.01 0.09 -0.10 -0.01 -0.11 -0.13 6 6 6 6 6 6 1 6 1 1 6 6 6 6 1 6 1 6 1 1 6 6 6 6 1 6 6 1 1 6 1 1 1 1 1 298.150 1.00000 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 6 6 6 6 6 6 1 6 1 1 6 6 6 6 1 6 1 6 1 1 6 6 6 6 1 6 6 1 1 6 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 1.00783 12.00000 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 1.00783 1.00783 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 255.11738 -6.0E-5 0.00432 0.99999 -1.4E-4 0.99999 -0.00432 1.0 1.4E-4 6.0E-5 asymmetric 1 0.02545 0.01205 0.00839 0.53040 0.25110 0.17478 748401.9 73.07 79.55 100.14 105.99 160.45 210.00 233.33 281.84 337.68 412.50 426.27 455.58 529.49 602.24 604.13 623.05 643.19 658.34 736.97 748.41 825.02 830.03 896.41 903.91 912.54 949.06 1009.95 1057.24 1068.11 1094.42 1101.66 1131.44 1137.81 1167.99 1211.94 1239.61 1272.51 1285.06 1337.77 1363.90 1365.01 1370.19 1408.71 1410.41 1420.12 1421.37 1456.23 1475.59 1492.20 1513.75 1525.57 1539.66 1615.14 1622.11 1670.86 1706.84 1708.14 1727.35 1768.15 1779.83 1784.41 1794.05 1885.16 1920.67 1929.52 1941.54 1954.24 2013.12 2022.55 2068.25 2091.16 2134.71 2135.43 2165.09 2170.73 2174.59 2185.83 2238.80 2298.35 2320.96 2324.54 2344.06 2360.87 2382.96 4372.52 4456.54 4498.77 4577.74 4579.64 4580.92 4582.96 4593.27 4594.75 4612.23 4613.07 4620.78 4622.38 4629.65 4631.28 0.285051 0.300304 0.301248 0.241426 -770.918884 -770.903631 -770.902687 -770.962510 188.444 62.369 125.907 0.000 0.000 1.377 0.889 2.981 42.510 0.889 2.981 33.890 186.666 56.408 48.130 1 0.595 1.977 4.787 2 0.596 1.975 4.619 3 0.598 1.969 4.165 4 0.599 1.966 4.053 5 0.607 1.940 3.242 6 0.617 1.907 2.724 7 0.622 1.889 2.524 8 0.636 1.846 2.171 9 0.655 1.788 1.843 10 0.684 1.698 1.493 11 0.690 1.681 1.438 12 0.704 1.642 1.327 13 0.741 1.538 1.088 14 0.781 1.430 0.897 15 0.783 1.427 0.892 16 0.794 1.398 0.849 17 0.806 1.367 0.805 18 0.816 1.344 0.773 19 0.867 1.223 0.628 20 0.875 1.205 0.610 21 0.930 1.089 0.498 22 0.933 1.081 0.491 0.116503e+21 20.066335 46.204445 0.639363e+05 4.805747 11.065642 0.200000e+01 0.301030 0.693147 0.160164e+09 8.204565 18.891710 0.568843e+07 6.754993 15.553946 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 0.0289 0.0427 1.5505 1.5514 -119.2447 -102.2320 -92.5856 -2.4536 0.1415 0.2314 -14.5573 2.4555 12.1018 -2.4536 0.1415 0.2314 -0.3416 -0.3704 24.4190 0.4233 0.5026 15.3648 0.9118 1.2119 -11.1695 -11.9086 -237.9702 -2350.9006 -4856.6556 -12.8083 -2.0827 13.5500 -2.5431 3.8498 6.3463 -508.7738 -989.5370 -1243.1253 2.9926 2.3151 -26.4812 0 -771.2039353 0.772944 0. 0.750499 1.938E-9 1.31E-5 0.2850512 0.3003039 C01 [X(C20H15)] 0.0113625 0.0168052 0.6100275 -0.0355937 0.0625204 0.0016075 0.038156 0.5689104 0.000112 0.0007901 0.0009957 0.8798093 -0.0038076 -0.0015232 0.0573258 -0.0200729 -0.4601253 0.1650957 0.0161066 0.275318 -0.095458 0.0018593 -0.0137978 0.0350291 0.0099546 0.2657973 0.3728869 -0.0098647 -0.1779416 -0.0687078 -0.12623 0.0210437 -0.038107 0.0287473 0.1512663 -0.0830675 -0.028062 -0.1440376 0.0893437 -0.1362438 -0.0000259 -0.0202705 -0.0107504 -0.2629905 -0.4095341 0.0053073 -0.02014 0.1078647 -0.1477535 0.0044078 0.0097722 0.016985 0.0733488 0.0334127 -0.0013492 -0.0997616 0.042166 0.1246978 0.0106914 0.0141361 -0.0075196 0.0953985 0.068289 0.0146856 0.1122602 -0.0802028 -0.1344292 0.0043578 0.0133754 0.0125843 0.0500898 0.2412499 -0.0009033 0.0245693 -0.1425285 0.1313721 0.0007467 0.0007206 -0.0020314 0.0815841 0.106716 0.000994 0.030147 -0.1391628 0.1338083 -0.022601 0.001499 -0.0209308 -0.1883082 0.0146503 0.0045213 0.0542014 0.0783979 -0.007111 -0.0037123 -0.0162113 0.0267043 -0.1256651 0.0036496 -0.0035639 -0.0029307 -0.1864132 -0.0423574 -0.1017507 0.0433922 -0.1024445 -0.0327886 0.1880759 0.0366206 -0.0359194 0.1117024 -0.0483237 -0.1010779 -0.0563059 -0.0982638 -0.0247386 -0.2059398 -0.0340178 0.0397141 0.1249644 -0.0450471 -0.1223506 -0.2692995 -0.133067 0.0314724 0.2797086 -0.0674856 0.0656705 -0.3395136 0.0583869 0.083306 -0.0821343 0.088306 0.0142567 0.0481831 -0.0719033 0.0783826 0.0587157 -0.0397266 -0.1256505 0.2606416 -0.130012 0.0230006 -0.2911853 0.0628018 -0.0685407 -0.3456005 0.0609773 0.0802319 0.0914901 0.0895028 0.0118789 -0.0412021 0.0719428 -0.077878 0.0594883 -0.0216376 0.0342076 0.1137157 0.0272542 -0.0401406 0.1241381 0.0175472 0.0210898 0.5759422 0.0422583 0.1044357 0.080717 0.0992895 0.000091 -0.1154342 0.0702149 -0.0868128 -0.026841 0.0462463 0.1018248 -0.0703866 0.1003727 -0.0029185 0.120857 -0.0664895 0.0904467 -0.0260691 -0.0041074 -0.0010644 -0.0558129 -0.0207814 -0.4588491 -0.1670733 -0.0157199 -0.2769024 -0.0990737 -0.1264777 0.0204974 0.0375049 0.0286755 0.1505388 0.0841234 0.0270727 0.1437128 0.0905721 0.001614 -0.0140016 -0.0349701 0.009716 0.2653587 -0.3707833 0.0099714 0.1795995 -0.0692431 -0.147709 0.0040303 -0.0097837 0.0165253 0.0726153 -0.0336485 0.001671 0.1006052 0.0424788 0.124783 0.010983 -0.013907 -0.0072838 0.0962943 -0.0677292 -0.014045 -0.1109803 -0.0812819 -0.1361541 -0.0001772 0.0194239 -0.010538 -0.2637788 0.4076578 -0.0063013 0.0178138 0.1100232 -0.1345082 0.0044724 -0.0132478 0.0125461 0.0507912 -0.2402346 -0.0000349 -0.0247654 -0.1442426 0.1314366 0.0008711 -0.0000064 -0.0017357 0.0823009 -0.1054877 -0.0004333 -0.0291243 -0.1400533 0.1338504 -0.0222927 -0.0014583 -0.0205488 -0.187705 -0.0161429 -0.0044629 -0.0557938 0.0780389 0.122934 -0.0186753 -0.1639225 -0.0113449 0.1244734 -0.1914369 -0.0019487 -0.0065472 -0.0013611 -0.0145505 -0.1090697 -0.068212 -0.1105074 0.0007226 -0.0537634 -0.0441262 -0.0411452 -0.1896003 -0.1003389 0.0660017 0.1318854 0.0712819 0.0623696 -0.0017363 0.0358907 -0.0073415 -0.0855947 0.0710161 0.0565219 0.0014514 0.052635 -0.113787 0.1355741 -0.0057776 0.0320567 -0.0661055 0.1334139 -0.0068929 0.0082859 -0.0108281 -0.0560905 0.128083 0.0074483 0.1476789 -0.0604871 0.1334528 -0.006488 -0.0079379 -0.0105761 -0.054674 -0.1280639 -0.0070968 -0.1476999 -0.0619672 110.5065695|-14.4195701|397.7619148|0.4225019|1.0098717|448.6746195 0.000002597 0.000001009 -0.000006743 0.000005351 -0.000008546 0.000034780 0.000001658 -0.000000148 0.000014326 0.000004840 0.000044078 -0.000015487 0.000003723 -0.000000854 -0.000035872 -0.000001175 -0.000044287 0.000004622 -0.000000534 -0.000013614 0.000002412 0.000004514 0.000017915 0.000012498 -0.000000605 -0.000006171 0.000008596 0.000005362 0.000009735 -0.000006652 0.000002319 -0.000002118 -0.000028005 -0.000003201 0.000013413 0.000011568 -0.000000527 -0.000012382 0.000005563 0.000000637 0.000005475 -0.000010455 -0.000002294 -0.000004771 0.000004862 -0.000004951 -0.000003356 -0.000005278 0.000003188 0.000005638 0.000005803 0.000009237 -0.000002425 0.000004429 -0.000002295 -0.000000158 0.000001118 0.000002197 0.000000442 0.000000812 -0.000008518 0.000008740 0.000032293 -0.000004669 -0.000044058 -0.000015900 -0.000002022 -0.000000669 0.000015176 0.000000957 0.000044057 0.000006112 0.000000024 0.000013086 0.000003167 -0.000002807 0.000001947 -0.000035805 -0.000004502 -0.000018842 0.000011697 -0.000000093 0.000006143 0.000008381 -0.000005072 -0.000009727 -0.000007067 -0.000000236 -0.000005411 -0.000002680 -0.000004171 0.000006714 -0.000002108 -0.000002930 -0.000003271 -0.000000254 0.000004202 0.000002495 -0.000002337 -0.000003414 0.000006673 -0.000006843 0.000003210 -0.000006751 -0.000006731 240.21399999999988 AuxInfo=1/0/N:30,8,27,6,24,5,26,4,22,14,16,12,13,18,11,3,23,2,21,1/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/CRV:2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3/rA:35nC3C3C3C3C3C3HC3HHC3C3C3C3HC3HC3HHC3C3C3C3HC3C3HHCHHHHH/rB:s1;s2;s2;s3;s4;s4;s5s6;s5;s6;s1;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s1;s21;s3s21;s22;s22;s23;s24s26;s26;s24;s18;s30;s30;s30;s27;s8;/rC:-.0013,-.0019,-.0944;-.0369,-1.1644,-.96;-.0257,-.727,-2.3211;-.1424,-2.535,-.6742;-.0819,-1.6439,-3.3637;-.1942,-3.4483,-1.73;-.1983,-2.8856,.3513;-.1581,-3.0116,-3.0622;-.0743,-1.3096,-4.3981;-.2708,-4.5106,-1.5153;-.0023,-.005,1.3605;-.7376,.9516,2.0954;.7286,-.9657,2.0929;-.7403,.9414,3.486;-1.3438,1.6791,1.565;.7259,-.9626,3.4844;1.3308,-1.6957,1.5615;-.0059,-.0108,4.21;-1.3308,1.6806,4.0226;1.3081,-1.7092,4.0194;.0361,1.1651,-.9537;.1402,2.5342,-.6603;.0285,.735,-2.3172;.1944,3.4532,-1.7111;.1928,2.8794,.3672;.0872,1.6574,-3.3547;.1621,3.0235,-3.0457;.0825,1.3287,-4.3909;.2698,4.5144,-1.4904;.0158,.0084,5.7189;.7727,.7119,6.091;-.9489,.3258,6.1291;.2568,-.9775,6.1296;.2067,3.7545,-3.8481;-.2008,-3.7382,-3.8687;