Orca 5.0.2 RELEASE 1 2 3 4 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s3p2d1f 5s3p2d1f 5s3p2d1f 3s2p1d 0 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 O O O N C C C C C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H H H 1 1 1 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 350.26169999999973 AuxInfo=1/0/N:13,14,8,9,28,26,27,21,19,24,25,22,10,18,17,12,16,23,20,6,15,7,11,5,4,2,3,1/E:(1,2)(3,4)(6,7)(10,11)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.2,16.3,17.3,18.3,19.3,23.3,25.1,26.1/rA:53nOO1ON1CCCCCC3C3C3CCCC3C2C3C3C3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;s5;s5s6;s5;s5;s6;s1s2s7;s10;s12;s12;s1;s15;s4s15;s16;s16;s3s18;s19;s20s21;s3;s23;s23;s24;s25;s26s27;s6;s7;s8;s8;s8;s9;s9;s9;s10;s13;s13;s13;s14;s14;s14;s15;s18;s19;s21;s22;s24;s25;s26;s27;s28;/rC:-1.1259,1.8119,.3794;-1.2312,2.4333,-1.7595;-1.2592,-3.3709,.2992;-3.3873,1.4392,2.7604;1.6341,3.0247,.5602;1.8133,1.6298,.0646;.8561,2.5649,-.6622;.9683,3.2647,1.8947;2.7085,4.044,.2578;3.0666,1.1875,-.6;-.5823,2.2831,-.7535;3.1568,.5083,-1.7465;1.9776,.0797,-2.5653;4.4897,.1169,-2.3085;-2.4784,1.3844,.3117;-2.5909,-.008,-.2617;-2.9681,1.4178,1.6914;-1.8396,-1.0337,.3015;-3.43,-.2519,-1.338;-1.9339,-2.3113,-.2295;-3.5245,-1.5397,-1.8482;-2.7761,-2.5699,-1.3047;-.0017,-3.1867,.8155;.994,-2.552,.0829;.2632,-3.7099,2.0716;2.2676,-2.446,.6224;1.5446,-3.604,2.5959;2.5484,-2.9698,1.8781;1.324,.8731,.6746;1.2275,2.9553,-1.603;.3551,2.4329,2.2319;1.7384,3.4207,2.6531;.346,4.1614,1.8755;3.4999,4.0021,1.0091;3.1697,3.8946,-.7187;2.2928,5.0534,.2751;3.9879,1.4334,-.0776;1.0206,.2411,-2.0738;1.9567,.6107,-3.5213;2.0505,-.9829,-2.8099;4.578,-.9697,-2.3911;4.6202,.513,-3.3192;5.3174,.4769,-1.6973;-3.0906,2.0841,-.2656;-1.1966,-.8402,1.1527;-4.0066,.5538,-1.7739;-4.1776,-1.7406,-2.6869;-2.8426,-3.573,-1.7068;.7852,-2.1541,-.9027;-.5236,-4.2008,2.6305;3.0459,-1.9558,.0516;1.7534,-4.0154,3.5751;3.5453,-2.8879,2.2908; Method DFT(GTOs) Exchange WB97X-D3 Correlation WB97X-D3 PostSCFGGA off Hybrid DFT is turned on ScalHFX 0.195728 ScalDFX 0.000000 ScalDFC 1.000000 ScalLDAC 1.000000 Perturbative correction 0.000000 Density functional embedding theory OFF Long-range corrected/Screened/Range-Separated Hybrid DFT is turned on Amount of maximum screened exact exchange 0.804272 Range separation parameter mu (erf(mu*r12)/r12) 0.250000 RI-approximation to the Coulomb term is turned on functions 1647 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 200 Dim 1218 ENuc 2616.5102680300 Eh CNVDIIS on DIISMaxIt 12 DIISStart 0.200000 DIISMaxEq 5 DIISBfac 1.050 DIISMaxC 10.000 CNVTRAH auto Auto Start mean grad. ratio tolernc. 1.125000 Auto Start start iteration 20 Auto Start num. interpolation iter. 10 iterations 16 iterations Maxiter - #DIIS iter Number of Davidson start vectors 2 Converg. threshold I (grad. norm) 1.000e-04 Converg. threshold II (energy diff.) 1.000e-07 Micro threshold 0.100 Minimum threshold for Micro iter. 0.010 NR start threshold (gradient norm) 0.001 Initial trust radius 0.400 Minimum AH scaling param. (alpha) 1.000 Maximum AH scaling param. (alpha) 1000.000 Orbital update algorithm Taylor David. guess on Maximum white noise 0.010 Quad. conv. algorithm NR CNVSOSCF off CNVShift on LevelShift 0.2500 ShiftErr 0.0010 CNVZerner off CNVDamp on DampFac 0.7000 DampMax 0.9800 DampMin 0.0000 DampErr 0.1000 CNVRico off MaxIter 125 SCFMode Direct Integral package SHARK and LIBINT hybrid scheme DirectResetFreq 20 Thresh 3.000e-11 Eh TCut 1.000e-12 Eh ConvCheckMode Total+1el-Energy ConvForced 0 TolE 1.000e-07 Eh 1-El. energy change 1.000e-04 Eh TolErr 1.000e-07 Smallest eigenvalue 6.797e-06 Time for diagonalization 0.640 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.588 sec Total time needed 1.240 sec 8 8 8 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 350.26169999999973 AuxInfo=1/0/N:13,14,8,9,28,26,27,21,19,24,25,22,10,18,17,12,16,23,20,6,15,7,11,5,4,2,3,1/E:(1,2)(3,4)(6,7)(10,11)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.2,16.3,17.3,18.3,19.3,23.3,25.1,26.1/rA:53nOO1ON1CCCCCC3C3C3CCCC3C2C3C3C3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;s5;s5s6;s5;s5;s6;s1s2s7;s10;s12;s12;s1;s15;s4s15;s16;s16;s3s18;s19;s20s21;s3;s23;s23;s24;s25;s26s27;s6;s7;s8;s8;s8;s9;s9;s9;s10;s13;s13;s13;s14;s14;s14;s15;s18;s19;s21;s22;s24;s25;s26;s27;s28;/rC:-1.1259,1.8119,.3794;-1.2312,2.4333,-1.7595;-1.2592,-3.3709,.2992;-3.3873,1.4392,2.7604;1.6341,3.0247,.5602;1.8133,1.6298,.0646;.8561,2.5649,-.6622;.9683,3.2647,1.8947;2.7085,4.044,.2578;3.0666,1.1875,-.6;-.5823,2.2831,-.7535;3.1568,.5083,-1.7465;1.9776,.0797,-2.5653;4.4897,.1169,-2.3085;-2.4784,1.3844,.3117;-2.5909,-.008,-.2617;-2.9681,1.4177,1.6914;-1.8396,-1.0337,.3015;-3.43,-.2519,-1.338;-1.9339,-2.3113,-.2295;-3.5245,-1.5397,-1.8482;-2.7761,-2.5699,-1.3047;-.0017,-3.1867,.8155;.994,-2.552,.0829;.2632,-3.7099,2.0716;2.2676,-2.446,.6224;1.5446,-3.604,2.5959;2.5484,-2.9698,1.8781;1.324,.8731,.6746;1.2275,2.9553,-1.603;.3551,2.4329,2.2319;1.7384,3.4207,2.6531;.346,4.1614,1.8755;3.4999,4.0021,1.0091;3.1697,3.8946,-.7187;2.2928,5.0534,.2751;3.9879,1.4334,-.0776;1.0206,.2411,-2.0738;1.9567,.6107,-3.5213;2.0505,-.9829,-2.8099;4.578,-.9697,-2.3911;4.6202,.513,-3.3192;5.3174,.4769,-1.6973;-3.0906,2.0841,-.2656;-1.1966,-.8402,1.1527;-4.0066,.5538,-1.7739;-4.1776,-1.7406,-2.6869;-2.8426,-3.573,-1.7068;.7852,-2.1541,-.9027;-.5236,-4.2008,2.6305;3.0459,-1.9558,.0516;1.7534,-4.0154,3.5751;3.5453,-2.8879,2.2908; 0 1 wb97x-d3 def2-TZVPP def2/J RIJCOSX DEFGRID2 scfconv7 smallprint printgap noloewdin NOSOSCF MaxCore 8000 %output print[P_BondOrder_M] 1 print[P_Mayer] 1 print[P_basis] 2 pal nprocs 4 cpcm smd true smdsolvent "1-OCTANOL" 350.26169999999973 AuxInfo=1/0/N:13,14,8,9,28,26,27,21,19,24,25,22,10,18,17,12,16,23,20,6,15,7,11,5,4,2,3,1/E:(1,2)(3,4)(6,7)(10,11)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,15.2,16.3,17.3,18.3,19.3,23.3,25.1,26.1/rA:53nOO1ON1CCCCCC3C3C3CCCC3C2C3C3C3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;s5;s5s6;s5;s5;s6;s1s2s7;s10;s12;s12;s1;s15;s4s15;s16;s16;s3s18;s19;s20s21;s3;s23;s23;s24;s25;s26s27;s6;s7;s8;s8;s8;s9;s9;s9;s10;s13;s13;s13;s14;s14;s14;s15;s18;s19;s21;s22;s24;s25;s26;s27;s28;/rC:-1.1259,1.8119,.3794;-1.2312,2.4333,-1.7595;-1.2592,-3.3709,.2992;-3.3873,1.4392,2.7604;1.6341,3.0247,.5602;1.8133,1.6298,.0646;.8561,2.5649,-.6622;.9683,3.2647,1.8947;2.7085,4.044,.2578;3.0666,1.1875,-.6;-.5823,2.2831,-.7535;3.1568,.5083,-1.7465;1.9776,.0797,-2.5653;4.4897,.1169,-2.3085;-2.4784,1.3844,.3117;-2.5909,-.008,-.2617;-2.9681,1.4178,1.6914;-1.8396,-1.0337,.3015;-3.43,-.2519,-1.338;-1.9339,-2.3113,-.2295;-3.5245,-1.5397,-1.8482;-2.7761,-2.5699,-1.3047;-.0017,-3.1867,.8155;.994,-2.552,.0829;.2632,-3.7099,2.0716;2.2676,-2.446,.6224;1.5446,-3.604,2.5959;2.5484,-2.9698,1.8781;1.324,.8731,.6746;1.2275,2.9553,-1.603;.3551,2.4329,2.2319;1.7384,3.4207,2.6531;.346,4.1614,1.8755;3.4999,4.0021,1.0091;3.1697,3.8946,-.7187;2.2928,5.0534,.2751;3.9879,1.4334,-.0776;1.0206,.2411,-2.0738;1.9567,.6107,-3.5213;2.0505,-.9829,-2.8099;4.578,-.9697,-2.3911;4.6202,.513,-3.3192;5.3174,.4769,-1.6973;-3.0906,2.0841,-.2656;-1.1966,-.8402,1.1527;-4.0066,.5538,-1.7739;-4.1776,-1.7406,-2.6869;-2.8426,-3.573,-1.7068;.7852,-2.1541,-.9027;-.5236,-4.2008,2.6305;3.0459,-1.9558,.0516;1.7534,-4.0154,3.5751;3.5453,-2.8879,2.2908; Epsilon 9.8629 Refrac 1.4295 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM O N C H 1.6280 1.8900 1.8500 1.2000 Solvent: 1-OCTANOL Soln 1.4295 Soln25 1.4279 Sola 0.3700 Solb 0.4800 Solg 39.0100 Solc 0.0000 Solh 0.0000 Calculating surface done! ( 0.0s) GEPOL surface points 3169 GEPOL Volume 2705.4409 GEPOL Surface-area 1568.3404 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 1.3s) Overall time for CPCM initialization 1.4s -1210.10241928 2616.51026803 -3826.61268731 -6843.90926558 3017.29657827 -0.02967094 -2414.81338211 1204.71096283 2.00447531 99.999814130776 99.999814130776 199.999628261552 -118.584058642504 0 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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 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1173 1174 1175 1176 1177 1178 1179 1180 1181 1182 1183 1184 1185 1186 1187 1188 1189 1190 1191 1192 1193 1194 1195 1196 1197 1198 1199 1200 1201 1202 1203 1204 1205 1206 1207 1208 1209 1210 1211 1212 1213 1214 1215 1216 1217 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 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7.7204 7.8244 7.8918 7.9368 8.0030 8.0575 8.1473 8.2773 8.4611 8.5223 8.5498 8.6021 8.7757 8.8540 8.9380 9.1537 9.2307 9.2750 9.3340 9.5243 9.6244 9.9148 9.9253 9.9790 10.1785 10.2144 10.2789 10.3382 10.4183 10.6406 10.8548 10.9291 10.9870 11.0456 11.0989 11.2013 11.3194 11.3513 11.4676 11.5677 11.6909 11.7608 11.7921 12.0292 12.0712 12.2162 12.3169 12.4926 12.5773 12.6625 12.7742 12.8465 12.9271 13.0158 13.1028 13.1285 13.2374 13.2388 13.4149 13.5094 13.6516 13.7299 13.8028 13.8794 13.9555 14.0550 14.1440 14.2504 14.2925 14.3601 14.4531 14.5735 14.6475 14.7239 14.7661 14.9313 14.9529 14.9959 15.1082 15.1545 15.2348 15.3665 15.4426 15.4798 15.5402 15.6704 15.7149 15.8496 15.9479 16.0604 16.1790 16.2227 16.3034 16.3378 16.5217 16.6364 16.6874 16.7099 16.8862 16.9647 17.0380 17.1701 17.1966 17.3165 17.3804 17.5067 17.6302 17.8364 17.9086 18.0330 18.1999 18.2518 18.3761 18.4975 18.7096 18.8614 19.0809 19.2207 19.3505 19.4898 19.6610 19.7260 19.8392 19.9483 20.1118 20.2015 20.4342 20.5125 20.6348 20.7079 20.8024 20.8414 20.9656 20.9836 21.1407 21.2468 21.3358 21.5093 21.6380 21.8819 21.9535 21.9966 22.1372 22.2493 22.3624 22.5853 22.6237 22.8931 23.1010 23.1914 23.4015 23.4345 23.5894 23.7721 23.9337 24.0654 24.1531 24.2990 24.3271 24.5766 24.6638 24.7084 24.8091 25.0578 25.1412 25.1888 25.3471 25.5601 25.6964 25.7525 25.8627 26.1605 26.3673 26.6300 26.7819 26.8663 26.8970 27.1231 27.1654 27.2358 27.3464 27.4100 27.6089 27.7547 27.9008 28.0415 28.1718 28.4514 28.5074 28.6347 28.7705 28.8914 28.9450 29.2231 29.2485 29.3559 29.4458 29.5309 29.6179 29.7133 29.8886 29.9330 30.0462 30.1105 30.2480 30.4962 30.5742 30.8730 31.0243 31.1432 31.3603 31.3977 31.5878 31.6202 31.7075 31.8124 32.0153 32.1230 32.2506 32.3921 32.4891 32.5433 32.6616 32.7708 32.8675 33.0442 33.1220 33.3122 33.4345 33.5075 33.6249 33.8256 33.9463 34.0730 34.1937 34.2860 34.3775 34.4722 34.5727 34.8196 34.9037 35.0862 35.3468 35.3769 35.4171 35.5622 35.7038 35.7696 35.9092 36.0528 36.2019 36.4814 36.5413 36.5553 36.7624 36.8443 37.0358 37.0768 37.1720 37.3951 37.5810 37.6819 37.7562 37.7968 37.9677 38.0209 38.2420 38.3359 38.3831 38.5030 38.5924 38.8324 38.8641 38.9943 39.0349 39.1338 39.2452 39.3480 39.5173 39.6358 39.7897 39.8724 39.9214 40.1472 40.1692 40.2647 40.5324 40.6209 40.7356 40.8459 40.8939 41.0363 41.1067 41.2951 41.5079 41.6338 41.7802 41.8236 42.0030 42.1057 42.3658 42.4250 42.6211 42.7509 42.8696 42.9059 43.1337 43.1953 43.2925 43.4407 43.5870 43.6049 43.7488 43.8612 44.0129 44.1978 44.2303 44.3644 44.4383 44.4923 44.5377 44.7908 44.8668 44.9387 45.1547 45.3077 45.4214 45.6161 45.7595 45.7805 45.9769 46.0452 46.2348 46.3390 46.4728 46.6293 46.6700 46.7980 46.9436 47.0289 47.1459 47.4237 47.5268 47.7028 47.8233 47.8877 47.9935 48.0816 48.1997 48.3505 48.6010 48.6586 48.7333 49.0266 49.1851 49.2780 49.3560 49.5932 49.7758 50.1404 50.1701 50.4334 50.6313 50.8018 50.8129 51.0130 51.5360 51.5757 51.6449 51.9268 52.1305 52.6133 52.7221 53.1213 53.1684 53.4595 53.5530 53.8050 53.9144 54.3954 54.5421 54.6079 54.8647 55.0338 55.2536 55.4090 55.6083 55.9817 56.2613 56.4644 56.6418 56.7389 56.8919 57.0183 57.2371 57.4223 57.6673 57.7822 57.8938 58.3108 58.4651 58.7024 58.8093 58.9655 59.0343 59.4374 59.6955 59.7999 60.0947 60.3312 60.3594 60.6388 60.8393 61.4855 61.5830 61.8864 62.0845 62.2696 62.6398 62.9979 63.1923 63.4483 63.5649 63.7010 63.9586 64.0234 64.3182 64.7207 65.0071 65.0823 65.3476 65.5928 65.6914 65.8537 66.2288 66.4598 66.4636 66.7618 67.2742 67.3711 67.3979 67.5754 67.8503 67.9853 68.1163 68.2676 68.4449 68.6094 68.9735 69.2452 69.5401 69.7617 69.9065 70.1071 70.8368 70.9738 71.0790 71.2620 71.3179 71.8060 71.9553 72.2348 72.2907 72.6338 72.6805 72.8134 73.1531 73.2491 73.3999 73.9196 74.0588 74.2290 74.2748 74.4240 74.7207 74.8625 75.0481 75.2611 75.4859 75.5323 75.6461 75.9449 76.0385 76.1334 76.4212 76.5038 76.7511 76.8412 76.9297 77.1650 77.4395 77.5069 77.5874 77.6777 77.9626 78.0035 78.1835 78.4233 78.5057 78.5617 78.6851 78.7816 78.9155 79.0417 79.1695 79.3228 79.4136 79.4944 79.5349 79.7150 79.8124 79.9453 80.0982 80.2233 80.3198 80.7067 80.7381 80.9595 81.0521 81.1221 81.2029 81.4843 81.5608 81.6866 81.7554 81.8210 82.0876 82.2357 82.3493 82.3968 82.6090 82.6290 82.6950 82.8950 83.0117 83.0593 83.2667 83.3058 83.5076 83.7131 83.7981 83.8522 84.0351 84.2157 84.4198 84.4762 84.5961 84.7676 84.8055 84.9136 84.9848 85.0534 85.2573 85.3486 85.3720 85.5655 85.5889 85.8109 85.9321 86.0164 86.1005 86.1478 86.1721 86.3642 86.4602 86.7425 86.7852 86.8359 86.9390 87.0105 87.2029 87.2627 87.4634 87.5427 87.5663 87.7903 87.8408 87.9341 88.0586 88.0931 88.4469 88.4773 88.6336 88.7171 88.8432 89.0983 89.1866 89.2269 89.3241 89.4464 89.4998 89.6313 89.8645 89.9831 90.1343 90.1634 90.2741 90.4031 90.4667 90.7034 90.7995 90.8244 91.1085 91.2058 91.2185 91.3838 91.7705 91.9262 92.0324 92.2459 92.3780 92.5633 92.6959 92.7584 92.8349 92.8803 93.0065 93.0399 93.1575 93.2182 93.3027 93.4220 93.5215 93.5801 93.7487 93.7761 93.9585 94.0494 94.2572 94.2746 94.4810 94.5202 94.7517 94.8334 94.8677 95.0506 95.2066 95.3418 95.4960 95.5344 95.6202 95.7362 95.8043 95.9484 96.2161 96.4066 96.5307 96.6140 96.7545 96.9634 97.0773 97.1111 97.2281 97.2938 97.4341 97.5846 97.7350 97.8631 98.0530 98.1581 98.2632 98.3141 98.5667 98.6837 98.7148 98.7980 99.0673 99.1728 99.2508 99.2701 99.3655 99.6197 99.6618 99.8328 99.9019 100.0163 100.1903 100.2249 100.4427 100.5725 100.6804 101.0179 101.2778 101.3698 101.4783 101.6939 101.8050 101.9054 102.2676 102.3901 102.5524 102.6764 102.7758 102.8848 102.9481 103.2043 103.4143 103.6980 103.8177 103.9211 104.2019 104.2736 104.5444 104.5808 104.9383 105.1044 105.2004 105.3743 105.4895 105.5943 105.6646 105.7225 105.9018 106.0523 106.2247 106.2914 106.3848 106.6241 106.7187 106.8227 106.9059 107.2359 107.2908 107.3558 107.5020 107.7467 107.9178 107.9518 108.1028 108.2012 108.4813 108.5488 108.7645 108.8826 108.9450 109.1100 109.3823 109.5225 109.5476 109.6899 109.9067 110.0864 110.1589 110.4076 110.4283 110.4522 110.5341 110.6750 110.8703 111.1561 111.2227 111.3145 111.4010 111.6825 111.8656 111.9645 112.0887 112.3186 112.5332 112.6439 112.7214 112.8946 113.1356 113.3355 113.4056 113.5844 113.8790 113.9828 114.1102 114.1222 114.3485 114.4682 114.6879 114.7967 114.9876 115.1051 115.2342 115.3151 115.5017 115.5300 115.6783 115.7818 115.9444 116.1656 116.2588 116.3576 116.4959 116.5378 116.6623 116.8492 116.9776 117.0639 117.0750 117.2115 117.3668 117.4192 117.6827 117.7843 117.9021 117.9925 118.0973 118.1726 118.3198 118.3527 118.5377 118.6295 118.7357 118.9240 118.9675 119.2335 119.2622 119.4401 119.6478 119.7963 119.9646 120.2697 120.2995 120.4525 120.5225 120.7312 120.8759 121.0313 121.2345 121.4498 121.5890 121.6519 121.8655 122.2212 122.4174 122.5770 122.7116 122.8808 123.1435 123.3055 123.4924 123.6250 123.9194 124.1409 124.3247 124.4628 124.6867 124.9021 125.2302 125.3764 125.6242 125.7522 126.0878 126.2591 126.3954 126.5485 126.7030 127.0588 127.2265 127.3994 127.8685 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