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:-.3135,1.266,1.2884;-.8678,2.637,-.3854;.0253,-3.1072,-1.272;-1.9638,-.5184,3.5222;2.2462,2.8402,-.7343;1.7731,4.0316,.0248;1.3632,2.65,.4945;1.7031,2.5858,-2.1189;3.6731,2.3779,-.5611;2.6979,4.8521,.8498;-.036,2.2243,.3823;2.4753,5.269,2.0988;1.2324,4.9573,2.8745;3.4895,6.0915,2.8337;-1.6183,.7103,1.2424;-1.7786,-.2829,.1149;-1.7961,.0347,2.5297;-.8134,-1.2675,-.0667;-2.8917,-.2293,-.709;-.9721,-2.1916,-1.0843;-3.0413,-1.1704,-1.7199;-2.0859,-2.1531,-1.9165;-.2819,-4.4395,-1.317;.5237,-5.2408,-2.1152;-1.3117,-4.9946,-.5667;.2978,-6.6084,-2.1576;-1.5304,-6.364,-.6271;-.732,-7.1767,-1.4197;.974,4.5842,-.4657;1.8777,2.2709,1.3701;1.6236,1.5162,-2.324;.7275,3.0351,-2.2897;2.3868,3.0094,-2.8575;3.7615,1.3155,-.7962;4.3385,2.9198,-1.2366;4.0404,2.523,.4549;3.6278,5.1445,.3686;.8228,5.8669,3.3205;.4474,4.503,2.2732;1.4525,4.2813,3.7057;3.793,5.5983,3.7612;4.3857,6.2709,2.2396;3.0754,7.0611,3.1221;-2.3841,1.4901,1.1722;.058,-1.325,.5754;-3.6385,.5414,-.5666;-3.9064,-1.1303,-2.3683;-2.203,-2.8767,-2.7137;1.3234,-4.7949,-2.6936;-1.9355,-4.3777,.0681;.9284,-7.2306,-2.7798;-2.3314,-6.7956,-.0407;-.9087,-8.2434,-1.4595; 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 2440.3183289648 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 6.715e-06 Time for diagonalization 0.618 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.592 sec Total time needed 1.225 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:-.3135,1.266,1.2884;-.8678,2.637,-.3854;.0253,-3.1072,-1.272;-1.9638,-.5184,3.5222;2.2462,2.8402,-.7343;1.7731,4.0316,.0248;1.3632,2.65,.4945;1.7031,2.5858,-2.1189;3.6731,2.3779,-.5611;2.6979,4.8521,.8498;-.036,2.2243,.3823;2.4753,5.269,2.0988;1.2324,4.9573,2.8745;3.4895,6.0915,2.8337;-1.6183,.7103,1.2424;-1.7786,-.2829,.1149;-1.7961,.0347,2.5297;-.8134,-1.2675,-.0667;-2.8917,-.2293,-.709;-.9721,-2.1916,-1.0843;-3.0413,-1.1704,-1.7199;-2.0859,-2.1531,-1.9165;-.2819,-4.4395,-1.317;.5237,-5.2408,-2.1152;-1.3117,-4.9946,-.5667;.2978,-6.6084,-2.1576;-1.5304,-6.364,-.6271;-.732,-7.1767,-1.4197;.974,4.5842,-.4657;1.8777,2.2709,1.3701;1.6236,1.5162,-2.324;.7275,3.0351,-2.2897;2.3868,3.0094,-2.8575;3.7615,1.3155,-.7962;4.3385,2.9198,-1.2366;4.0404,2.523,.4549;3.6278,5.1445,.3686;.8228,5.8669,3.3205;.4474,4.503,2.2732;1.4525,4.2813,3.7057;3.793,5.5983,3.7612;4.3857,6.2709,2.2396;3.0754,7.0611,3.1221;-2.3841,1.4901,1.1722;.058,-1.325,.5754;-3.6385,.5414,-.5666;-3.9064,-1.1303,-2.3683;-2.203,-2.8767,-2.7137;1.3234,-4.7949,-2.6936;-1.9355,-4.3777,.0681;.9284,-7.2306,-2.7798;-2.3314,-6.7956,-.0407;-.9087,-8.2434,-1.4595; 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:-.3135,1.266,1.2884;-.8678,2.637,-.3854;.0253,-3.1072,-1.272;-1.9638,-.5184,3.5222;2.2462,2.8402,-.7343;1.7731,4.0316,.0248;1.3632,2.65,.4945;1.7031,2.5858,-2.1189;3.6731,2.3779,-.5611;2.6979,4.8521,.8498;-.036,2.2243,.3823;2.4753,5.269,2.0988;1.2324,4.9573,2.8745;3.4895,6.0915,2.8337;-1.6183,.7103,1.2424;-1.7786,-.2829,.1149;-1.7961,.0347,2.5297;-.8134,-1.2675,-.0667;-2.8917,-.2293,-.709;-.9721,-2.1916,-1.0843;-3.0413,-1.1704,-1.7199;-2.0859,-2.1531,-1.9165;-.2819,-4.4395,-1.317;.5237,-5.2408,-2.1152;-1.3117,-4.9946,-.5667;.2978,-6.6084,-2.1576;-1.5304,-6.364,-.6271;-.732,-7.1767,-1.4197;.974,4.5842,-.4657;1.8777,2.2709,1.3701;1.6236,1.5162,-2.324;.7275,3.0351,-2.2897;2.3868,3.0094,-2.8575;3.7615,1.3155,-.7962;4.3385,2.9198,-1.2366;4.0404,2.523,.4549;3.6278,5.1445,.3686;.8228,5.8669,3.3205;.4474,4.503,2.2732;1.4525,4.2813,3.7057;3.793,5.5983,3.7612;4.3857,6.2709,2.2396;3.0754,7.0611,3.1221;-2.3841,1.4901,1.1722;.058,-1.325,.5754;-3.6385,.5414,-.5666;-3.9064,-1.1303,-2.3683;-2.203,-2.8767,-2.7137;1.3234,-4.7949,-2.6936;-1.9355,-4.3777,.0681;.9284,-7.2306,-2.7798;-2.3314,-6.7956,-.0407;-.9087,-8.2434,-1.4595; 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 3155 GEPOL Volume 2696.7964 GEPOL Surface-area 1573.2588 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.9s) Overall time for CPCM initialization 1.0s -1210.10594344 2440.31832896 -3650.42427240 -6492.10966702 2841.68539462 -0.02963675 -2414.81793597 1204.71199253 2.00447738 100.000229463823 100.000229463823 200.000458927646 -118.582433243600 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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7.6163 7.6868 7.7261 7.7693 7.8456 7.9230 7.9904 8.0548 8.1155 8.1730 8.2259 8.2761 8.4793 8.5581 8.6661 8.7109 8.7916 8.9966 9.1398 9.3214 9.3972 9.4819 9.5616 9.6599 9.8372 9.9440 10.0364 10.1311 10.2139 10.3809 10.4531 10.4846 10.5382 10.6634 10.7331 10.9457 11.0701 11.1438 11.1782 11.3026 11.3527 11.4739 11.5130 11.6211 11.6767 11.8448 11.9529 12.0498 12.2487 12.2977 12.3884 12.4816 12.5871 12.6592 12.7065 12.8150 12.9057 13.0635 13.1748 13.2330 13.3188 13.4294 13.5812 13.6842 13.8110 13.8597 13.9166 13.9845 14.0619 14.1146 14.1642 14.1688 14.3322 14.3694 14.4035 14.4648 14.5504 14.7133 14.7583 14.8318 14.8931 14.9306 15.0262 15.1121 15.2143 15.2859 15.3642 15.4733 15.5153 15.5408 15.7011 15.7905 15.8890 15.9271 15.9965 16.0592 16.1449 16.3143 16.3599 16.4383 16.5343 16.6186 16.7356 16.8672 16.9343 16.9968 17.1607 17.2775 17.3093 17.4600 17.5967 17.7442 17.8091 17.8782 17.9807 18.2781 18.4559 18.5026 18.6249 18.8647 18.9213 19.1982 19.4351 19.5056 19.6273 19.8114 19.8437 19.9290 20.0667 20.1983 20.2834 20.3465 20.4917 20.6175 20.7519 20.7769 20.9064 21.0602 21.1760 21.3086 21.4847 21.5793 21.6235 21.8481 21.9712 22.0451 22.0976 22.3892 22.5284 22.7261 22.8192 22.8865 23.0164 23.2497 23.3259 23.5075 23.6732 23.7303 23.9908 24.0571 24.1998 24.2581 24.5103 24.5675 24.6459 24.8452 25.0137 25.0784 25.2135 25.2679 25.5100 25.6528 25.8088 26.0918 26.3730 26.4050 26.5421 26.7486 26.8743 26.9437 27.0631 27.1829 27.3073 27.3454 27.5080 27.6532 27.7857 27.9314 28.0177 28.1948 28.3279 28.4253 28.5152 28.6087 28.6904 28.8482 28.9091 29.0899 29.1835 29.3867 29.5397 29.5771 29.6186 29.7301 29.7555 30.1163 30.2657 30.2876 30.3551 30.4810 30.6643 30.7700 30.8626 30.9732 31.0980 31.2821 31.4118 31.4864 31.6165 31.8442 31.9733 32.1483 32.2902 32.3735 32.4931 32.7003 32.7687 32.8287 32.9559 32.9722 33.1216 33.2356 33.3329 33.5542 33.6411 33.8042 33.8852 33.9388 34.2014 34.3252 34.5478 34.5995 34.6943 34.8815 35.0984 35.1732 35.3041 35.3616 35.4735 35.5968 35.6509 35.8652 35.9091 36.0568 36.2727 36.3855 36.4456 36.5653 36.9125 36.9561 37.0569 37.1065 37.2833 37.4142 37.5092 37.7244 37.7777 37.9392 38.0219 38.1274 38.2027 38.2802 38.3813 38.6348 38.7209 38.8486 38.9024 39.0068 39.1168 39.1725 39.2307 39.3122 39.4083 39.6565 39.7710 40.0214 40.1760 40.2738 40.4225 40.5172 40.5446 40.6240 40.6529 40.8329 40.9878 41.2143 41.2889 41.4428 41.6478 41.7788 41.8268 42.0346 42.0769 42.1699 42.3796 42.4368 42.5020 42.7247 42.8539 42.8593 43.0002 43.1242 43.1938 43.3088 43.5093 43.5843 43.6449 43.7016 43.9008 44.0312 44.1373 44.1430 44.3061 44.4166 44.5514 44.7173 44.8179 44.9257 45.0730 45.1085 45.3749 45.5262 45.6990 45.7259 45.8726 45.9772 46.0616 46.1944 46.2557 46.3709 46.6649 46.7717 46.8967 46.9567 47.1052 47.1639 47.2471 47.3927 47.7076 47.9229 48.0486 48.1526 48.2225 48.3127 48.3765 48.6658 48.7211 48.8540 49.0550 49.2636 49.4508 49.7034 49.7670 50.0532 50.1388 50.2715 50.4541 50.5792 51.1867 51.3175 51.3627 51.8292 52.1723 52.1930 52.4557 52.6816 52.8305 53.0821 53.2885 53.4012 53.6635 54.0266 54.3534 54.4717 54.5236 54.9982 55.2670 55.3068 55.5744 55.8046 55.9462 56.1562 56.3356 56.4281 56.6788 56.7798 56.9460 57.2521 57.4821 57.6190 58.0160 58.1527 58.3328 58.4967 58.6282 58.9541 59.1572 59.3156 59.4298 59.7714 59.9354 60.1663 60.3760 60.7022 60.8101 61.1715 61.8168 61.9697 62.1425 62.4314 62.5329 62.9347 63.1207 63.3219 63.3773 63.7921 64.1909 64.2830 64.4776 64.6603 64.7763 65.0158 65.1880 65.4717 65.5706 65.6799 65.9137 66.2328 66.4119 66.8244 67.1027 67.2578 67.3549 67.5117 67.6812 67.8286 68.0123 68.3485 68.4982 68.7083 69.0942 69.1470 69.7432 69.9084 70.1503 70.4599 70.6003 70.7127 71.0288 71.1894 71.3790 71.6882 72.0066 72.1095 72.4119 72.5928 72.6656 72.7419 73.2480 73.4165 73.5372 73.6422 73.8276 74.1183 74.3386 74.5613 74.6307 74.7587 74.9725 75.0495 75.2025 75.5537 75.7404 75.8776 75.9799 76.1913 76.2939 76.4311 76.7169 76.8767 77.0268 77.1930 77.2165 77.5228 77.5926 77.7194 77.9682 78.1815 78.2089 78.3249 78.4293 78.6165 78.8099 78.8536 78.9566 79.1096 79.1362 79.2618 79.3116 79.5080 79.5744 79.6474 79.7497 79.8302 79.9270 80.2526 80.3290 80.3990 80.5048 80.7159 80.7781 80.9122 81.1904 81.2732 81.4850 81.6660 81.7127 81.8169 81.9769 82.0209 82.1618 82.2576 82.3548 82.5300 82.6147 82.7745 82.8217 83.0113 83.2286 83.3319 83.3845 83.5206 83.6889 83.8368 84.1066 84.1241 84.3391 84.3685 84.4938 84.5058 84.6488 84.7645 84.8770 85.0996 85.1411 85.2232 85.3194 85.5411 85.6158 85.6411 85.7057 85.8081 85.9263 85.9374 86.0376 86.1485 86.2194 86.5310 86.5633 86.7881 86.8545 86.9033 86.9704 87.0294 87.2500 87.3652 87.5111 87.5813 87.8734 88.0307 88.1161 88.1915 88.3262 88.5026 88.6114 88.6623 88.7568 88.8860 88.9456 89.0921 89.2095 89.4141 89.4507 89.5774 89.7598 89.9239 89.9626 90.0012 90.2124 90.2770 90.4900 90.5790 90.8170 90.9657 91.0631 91.2556 91.2864 91.4822 91.6430 91.6874 91.9416 92.0762 92.1150 92.3385 92.4745 92.5633 92.6433 92.7515 92.8453 92.9556 93.0309 93.1810 93.2687 93.2833 93.4966 93.5436 93.6778 93.7377 93.8573 93.9395 94.1200 94.2355 94.3772 94.5662 94.6839 94.7228 94.8096 95.0289 95.1539 95.3135 95.3915 95.4627 95.5602 95.6575 95.8772 95.9502 96.0811 96.3055 96.5150 96.5560 96.6501 96.7656 97.0127 97.1700 97.2278 97.3737 97.4984 97.5857 97.6480 97.7195 97.8310 97.9539 97.9758 98.0280 98.2737 98.3926 98.6253 98.7808 98.8191 99.0663 99.2142 99.2957 99.4158 99.5047 99.6241 99.7252 99.8306 99.8749 100.0416 100.1399 100.2008 100.3907 100.7466 100.9041 101.1146 101.2894 101.3496 101.6835 101.7568 102.0065 102.1314 102.1729 102.6598 102.8174 102.8350 102.8714 103.1444 103.1748 103.4674 103.4937 103.7753 103.9730 104.1165 104.3384 104.6114 104.6757 104.9426 105.1879 105.2895 105.4067 105.5268 105.6771 105.8223 105.9303 105.9382 106.1095 106.1152 106.2028 106.2838 106.4777 106.6105 106.7036 106.8840 107.0609 107.1804 107.3245 107.4167 107.5188 107.6452 107.8271 107.8422 108.2640 108.3481 108.4987 108.6100 108.7962 109.0659 109.1139 109.2712 109.4254 109.4846 109.5239 109.6985 109.8642 109.9792 110.0711 110.2921 110.3559 110.3951 110.4568 110.6384 110.7922 110.9534 111.0958 111.2013 111.4160 111.6275 111.8531 111.8611 112.1748 112.3686 112.5172 112.6436 112.9287 113.0167 113.0812 113.2005 113.4070 113.5836 113.6870 113.7798 114.1141 114.4271 114.4729 114.6168 114.7052 114.8715 114.9162 114.9455 115.1737 115.2806 115.4301 115.5185 115.6875 115.7609 115.7909 115.9564 116.0589 116.2705 116.3964 116.6189 116.8312 116.9078 116.9870 117.0797 117.1554 117.3367 117.5148 117.6529 117.7121 117.7950 117.8609 117.8984 117.9731 118.1681 118.2627 118.4470 118.5172 118.5556 118.7355 118.8444 119.1161 119.2303 119.3759 119.4976 119.7164 119.8416 120.2028 120.3269 120.4022 120.5730 120.6368 120.7606 121.0264 121.0335 121.3002 121.6143 121.6456 121.7859 121.9319 122.0811 122.5141 122.6611 122.7947 123.0078 123.1525 123.3685 123.4977 123.7426 124.0431 124.0954 124.3587 124.9484 125.0586 125.2489 125.5223 125.6193 125.9474 126.1831 126.2643 126.3637 126.7084 126.8749 127.0486 127.1768 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