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:-.7618,1.7477,.9583;.6803,1.7445,-.7467;-1.0864,-3.4486,-1.9269;-3.9471,.9746,1.3544;2.6591,2.814,1.4524;2.1708,3.9705,.6377;1.1643,3.0016,1.2388;3.4015,1.7045,.748;3.1478,3.0405,2.8628;2.1863,5.3633,1.1252;.3872,2.1199,.3592;2.5596,6.4468,.4355;3.053,6.4389,-.9791;2.5025,7.8073,1.0639;-1.5883,.852,.2366;-1.0847,-.574,.2742;-2.9025,.9342,.8794;-1.2939,-1.383,-.8326;-.4737,-1.0807,1.4141;-.8872,-2.709,-.7983;-.0558,-2.403,1.4254;-.2576,-3.2252,.3274;-1.4414,-4.7677,-1.8089;-2.4599,-5.1706,-.9538;-.784,-5.686,-2.6133;-2.8113,-6.5113,-.9048;-1.1535,-7.0233,-2.5614;-2.1608,-7.4426,-1.7038;2.3142,3.8437,-.43;.6233,3.3555,2.1092;3.1585,1.6244,-.3091;4.4756,1.8878,.8194;3.2037,.7376,1.2152;2.5556,3.7735,3.409;3.1161,2.108,3.4294;4.1829,3.3881,2.8562;1.847,5.513,2.1461;4.0228,6.9384,-1.0476;3.1673,5.4437,-1.4045;2.3737,7.0003,-1.6265;1.862,8.4798,.4867;2.1209,7.7758,2.0845;3.4923,8.2712,1.0886;-1.7171,1.177,-.8015;-1.772,-.9886,-1.7216;-.3185,-.4599,2.2868;.4347,-2.8033,2.3029;.0792,-4.2538,.3527;-2.98,-4.4497,-.3349;.0063,-5.3563,-3.2761;-3.6046,-6.8264,-.2393;-.6418,-7.7403,-3.1905;-2.4412,-8.4867,-1.6607; 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 2385.4181483394 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 1 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 6.875e-06 Time for diagonalization 0.670 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.735 sec Total time needed 1.419 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:-.7618,1.7477,.9583;.6803,1.7445,-.7467;-1.0864,-3.4486,-1.9269;-3.9471,.9746,1.3544;2.6591,2.814,1.4524;2.1708,3.9705,.6377;1.1644,3.0016,1.2388;3.4016,1.7045,.748;3.1478,3.0405,2.8628;2.1863,5.3633,1.1252;.3872,2.1199,.3592;2.5596,6.4468,.4355;3.053,6.4389,-.9791;2.5025,7.8073,1.0639;-1.5883,.852,.2366;-1.0847,-.574,.2742;-2.9025,.9342,.8794;-1.2939,-1.383,-.8326;-.4737,-1.0807,1.4141;-.8872,-2.709,-.7983;-.0558,-2.403,1.4254;-.2576,-3.2252,.3274;-1.4414,-4.7677,-1.8089;-2.4599,-5.1706,-.9538;-.784,-5.686,-2.6133;-2.8113,-6.5113,-.9048;-1.1535,-7.0233,-2.5614;-2.1608,-7.4426,-1.7038;2.3142,3.8437,-.43;.6233,3.3555,2.1092;3.1585,1.6244,-.3091;4.4756,1.8878,.8194;3.2037,.7376,1.2152;2.5556,3.7735,3.409;3.1161,2.108,3.4294;4.1829,3.3881,2.8562;1.847,5.513,2.1461;4.0228,6.9384,-1.0476;3.1673,5.4437,-1.4045;2.3737,7.0003,-1.6265;1.862,8.4798,.4867;2.1209,7.7758,2.0845;3.4923,8.2712,1.0886;-1.7171,1.177,-.8015;-1.772,-.9886,-1.7216;-.3185,-.4599,2.2868;.4347,-2.8033,2.3029;.0792,-4.2538,.3527;-2.98,-4.4497,-.3349;.0063,-5.3563,-3.2761;-3.6046,-6.8264,-.2393;-.6418,-7.7403,-3.1905;-2.4412,-8.4867,-1.6607; 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:-.7618,1.7477,.9583;.6803,1.7445,-.7467;-1.0864,-3.4486,-1.9269;-3.9471,.9746,1.3544;2.6591,2.814,1.4524;2.1708,3.9705,.6377;1.1643,3.0016,1.2388;3.4015,1.7045,.748;3.1478,3.0405,2.8628;2.1863,5.3633,1.1252;.3872,2.1199,.3592;2.5596,6.4468,.4355;3.053,6.4389,-.9791;2.5025,7.8073,1.0639;-1.5883,.852,.2366;-1.0847,-.574,.2742;-2.9025,.9342,.8794;-1.2939,-1.383,-.8326;-.4737,-1.0807,1.4141;-.8872,-2.709,-.7983;-.0558,-2.403,1.4254;-.2576,-3.2252,.3274;-1.4414,-4.7677,-1.8089;-2.4599,-5.1706,-.9538;-.784,-5.686,-2.6133;-2.8113,-6.5113,-.9048;-1.1535,-7.0233,-2.5614;-2.1608,-7.4426,-1.7038;2.3142,3.8437,-.43;.6233,3.3555,2.1092;3.1585,1.6244,-.3091;4.4756,1.8878,.8194;3.2037,.7376,1.2152;2.5556,3.7735,3.409;3.1161,2.108,3.4294;4.1829,3.3881,2.8562;1.847,5.513,2.1461;4.0228,6.9384,-1.0476;3.1673,5.4437,-1.4045;2.3737,7.0003,-1.6265;1.862,8.4798,.4867;2.1209,7.7758,2.0845;3.4923,8.2712,1.0886;-1.7171,1.177,-.8015;-1.772,-.9886,-1.7216;-.3185,-.4599,2.2868;.4347,-2.8033,2.3029;.0792,-4.2538,.3527;-2.98,-4.4497,-.3349;.0063,-5.3563,-3.2761;-3.6046,-6.8264,-.2393;-.6418,-7.7403,-3.1905;-2.4412,-8.4867,-1.6607; 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 3136 GEPOL Volume 2706.0938 GEPOL Surface-area 1573.1888 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 1.0s) Overall time for CPCM initialization 1.1s -1210.10737585 2385.41814834 -3595.52552419 -6382.26207306 2786.73654888 -0.03113898 -2414.81477514 1204.70739929 2.00448240 100.000085447392 100.000085447392 200.000170894783 -118.582825157488 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 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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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19.9583 20.0915 20.1834 20.3049 20.4477 20.6117 20.6372 20.6579 20.7195 21.0207 21.1427 21.2088 21.3149 21.3911 21.5388 21.7062 21.8260 21.9787 22.0599 22.2815 22.3803 22.6254 22.8194 22.8701 23.0273 23.2794 23.3298 23.3958 23.7425 23.7628 23.8318 23.9163 24.0052 24.1342 24.2275 24.3153 24.5112 24.6590 24.7869 24.8426 24.9921 25.0814 25.2308 25.4486 25.6503 25.7957 26.1143 26.3417 26.4027 26.5302 26.6141 26.7687 26.9206 27.0903 27.1746 27.2529 27.3715 27.4999 27.6798 27.8454 27.8697 28.2764 28.3017 28.3381 28.4582 28.6776 28.7492 28.8987 29.0956 29.1180 29.2519 29.2869 29.3753 29.4594 29.4972 29.5960 29.7579 29.9088 30.0407 30.1003 30.3084 30.4648 30.4916 30.6532 30.7184 30.8582 30.9718 31.1994 31.3077 31.4602 31.6580 31.7393 31.7506 32.0097 32.1194 32.1820 32.3071 32.5491 32.6060 32.6801 32.7842 32.8953 32.9852 33.0647 33.2231 33.4652 33.5278 33.6745 33.7755 33.9908 34.0595 34.2327 34.2977 34.5020 34.6665 34.7431 34.8523 35.0425 35.2096 35.2376 35.5180 35.5782 35.7423 35.9085 35.9470 36.0483 36.1449 36.1999 36.3627 36.4621 36.5580 36.6533 36.7918 36.9809 37.2397 37.3324 37.4309 37.6186 37.7189 37.7655 37.8058 37.9911 38.0973 38.2633 38.4341 38.5596 38.5883 38.7113 38.8278 38.9618 39.0841 39.1323 39.1623 39.3206 39.4473 39.5164 39.6295 39.7768 39.9270 40.1209 40.3603 40.4366 40.4590 40.6440 40.6857 40.8043 40.9509 41.1221 41.2736 41.3924 41.5161 41.6013 41.6184 41.8629 42.0495 42.1825 42.2920 42.3686 42.4057 42.5117 42.7774 42.9068 42.9440 43.0150 43.1454 43.2834 43.3885 43.5154 43.6081 43.7183 43.7811 43.9225 44.0448 44.1465 44.3359 44.3829 44.5573 44.6815 44.7554 44.8541 45.1842 45.3260 45.4914 45.5172 45.5780 45.6486 45.7040 45.9383 46.0498 46.2383 46.2802 46.4871 46.6610 46.7526 46.8366 46.9082 47.0781 47.1784 47.2615 47.4172 47.5804 47.7314 47.8072 47.9374 48.1849 48.2325 48.4165 48.5995 48.7799 48.8966 48.9372 49.1603 49.3956 49.4954 49.7890 49.9261 49.9445 50.1708 50.5026 50.5893 51.0150 51.2968 51.5855 51.7449 51.8714 51.9964 52.2443 52.5295 52.7871 52.8222 53.0516 53.1290 53.3642 53.7579 54.1236 54.2267 54.8424 54.8840 55.0557 55.1612 55.5730 55.7790 55.8879 56.1702 56.2311 56.3264 56.4228 56.7402 56.8568 57.1431 57.1772 57.7855 57.8356 58.0506 58.2300 58.6015 58.8292 58.9190 59.2004 59.2860 59.4762 59.7940 59.8843 59.9865 60.3746 60.6318 60.6727 61.1583 61.3691 61.7418 61.9246 62.4040 62.4414 62.7008 63.0169 63.2475 63.5088 63.6178 63.8274 64.1137 64.3577 64.6486 64.8247 64.9609 65.0709 65.3425 65.5761 65.6420 65.8034 66.1757 66.2387 66.2969 67.0884 67.2273 67.3556 67.4850 67.5776 67.7000 67.9374 68.0002 68.5077 69.0889 69.1576 69.4248 69.6028 69.7677 69.9557 70.1017 70.3794 70.5819 70.9024 71.1546 71.4432 71.7293 71.9515 72.2315 72.3548 72.4652 72.5860 72.9454 73.0551 73.3131 73.5562 73.7215 73.9038 74.2091 74.3033 74.4704 74.6934 74.8608 74.9602 75.1656 75.2071 75.4580 75.5258 75.6921 76.0143 76.1437 76.4351 76.6063 76.7892 76.9490 77.0227 77.1210 77.2272 77.5175 77.5514 77.8254 77.9325 78.0512 78.0745 78.2034 78.4618 78.6140 78.7250 78.8501 78.9993 79.1398 79.1615 79.2553 79.3515 79.3928 79.5126 79.5639 79.6774 79.8649 79.9403 80.1127 80.1812 80.2471 80.4488 80.4626 80.5246 80.6825 81.0041 81.0888 81.2176 81.3568 81.4866 81.7862 81.9584 82.0337 82.1283 82.2008 82.3244 82.3871 82.4612 82.7318 82.8508 82.8938 82.9940 83.2326 83.2705 83.3134 83.4442 83.6727 83.8198 83.9511 84.1220 84.3384 84.4138 84.5054 84.6058 84.6658 84.8413 84.8706 84.9775 85.1101 85.2572 85.2982 85.4729 85.5297 85.6188 85.7174 85.7934 85.8140 85.8667 85.9468 86.0812 86.2108 86.3040 86.3542 86.5892 86.6740 86.7431 86.9521 87.1257 87.1694 87.4278 87.5661 87.7665 87.9206 88.0060 88.1660 88.2065 88.4693 88.6694 88.7475 88.7966 88.8554 88.9409 89.0443 89.1760 89.2316 89.3924 89.4744 89.5639 89.6011 89.7607 89.8180 90.0615 90.1445 90.2830 90.4856 90.6901 90.7488 90.9219 91.0999 91.1833 91.4269 91.5136 91.5753 91.7696 92.0750 92.2839 92.3370 92.4594 92.5024 92.6053 92.7880 92.8600 92.9246 93.0342 93.1463 93.2487 93.3109 93.4083 93.4301 93.5019 93.5942 93.6821 93.8363 94.0082 94.0976 94.1492 94.4080 94.5400 94.5996 94.7931 94.9244 95.0069 95.1374 95.2370 95.2861 95.4482 95.5483 95.7873 95.8773 96.0045 96.1398 96.3374 96.4561 96.7357 96.7685 96.8852 96.9667 97.0993 97.2288 97.4556 97.5168 97.5299 97.7335 97.8406 98.0473 98.0910 98.1561 98.2316 98.4108 98.4722 98.6487 98.6964 98.7752 98.9026 99.1492 99.2585 99.3000 99.6200 99.6949 99.8004 99.9335 100.0889 100.2008 100.4181 100.5023 100.6373 100.8378 101.2305 101.3500 101.6149 101.7095 101.8806 101.9134 102.2359 102.2709 102.4819 102.5542 102.7157 102.9256 103.1632 103.2016 103.4203 103.5783 103.7237 104.2173 104.2855 104.4880 104.6434 104.8146 105.0447 105.1128 105.1620 105.4470 105.5315 105.5915 105.6471 105.7244 105.9213 105.9941 106.0593 106.2208 106.3486 106.4578 106.5651 106.7139 106.7562 106.9121 107.0968 107.1209 107.4006 107.4397 107.6297 107.8367 107.9647 108.1171 108.2449 108.4236 108.5801 108.7271 108.8473 109.0848 109.2616 109.3594 109.4605 109.5124 109.6550 109.7489 109.8960 109.9441 109.9965 110.1390 110.3775 110.5454 110.6394 110.7241 110.9466 110.9973 111.1194 111.3784 111.4472 111.6147 111.7750 111.9806 112.1412 112.3982 112.5291 112.6091 112.7783 112.9634 113.2047 113.3596 113.4842 113.5123 113.7840 114.0145 114.0685 114.2671 114.3540 114.5818 114.6036 114.7543 114.9230 114.9320 115.0537 115.2170 115.3477 115.6335 115.7118 115.7438 115.8833 116.1647 116.3074 116.5525 116.6271 116.7885 116.8442 116.8912 117.0142 117.1411 117.3645 117.4809 117.5933 117.6549 117.7716 117.8453 117.9050 118.1674 118.3054 118.3776 118.4645 118.4984 118.5447 118.7108 119.0045 119.2000 119.2383 119.3646 119.4955 119.6391 119.7106 120.0206 120.2496 120.3767 120.4829 120.6247 120.6437 120.6913 120.9297 121.2941 121.4451 121.5900 121.6832 121.7842 122.0841 122.4823 122.6553 122.7257 123.0202 123.0989 123.3298 123.4192 123.6019 123.8869 124.0092 124.5883 124.8964 125.0398 125.3416 125.5549 125.6430 126.0412 126.2613 126.3945 126.5691 126.7463 126.9695 127.0514 127.2107 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