Orca 5.0.2 RELEASE 1 2 3 4 5 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 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 Cl O 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 H H H H H H H H H H H H H H H H H H H H H H 1 2 2 2 2 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 389.7033999999997 AuxInfo=1/0/N:29,28,25,27,26,14,18,19,20,21,17,7,8,24,23,13,9,12,22,16,15,10,11,1,6,4,3,5,2/E:(7,8)(9,10)/CRV:1.2,2.2,4.2,5.2,6.3,7.3,8.3,9.3,10.3,11.3,16.3,17.3,18.3,19.3,20.3,21.3,23.3,26.1/rA:51nClOOO1ONCCC3CC3C3C3C3C3C3C3C3C3C3C3C3CCCC2C2C2C2HHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;s6s7;s7;s2;s4s6s10;s10;s9;s9;s3s13;s5s15;s14s16;s12;s12;s18;s19;s1s20s21;s2;s5;s3;s23;s24;s26;s27;s7;s7;s8;s8;s10;s6;s13;s14;s17;s18;s19;s20;s21;s23;s23;s24;s24;s25;s25;s25;s28;s29;/rC:2.9398,-2.8663,1.0734;-3.2697,-1.7108,-.8799;2.0612,.8973,2.0093;-2.9507,1.0906,1.2332;3.3832,.3084,-.1074;-2.6,.9512,-.9987;-1.4825,3.1582,-.5656;-2.5792,2.3678,-1.2894;-.1709,2.4275,-.4927;-2.7572,-1.1009,.2799;-2.8004,.433,.2121;-1.3216,-1.5304,.463;.3268,2.0198,.7467;.5521,2.113,-1.6305;1.5185,1.3211,.8514;2.2406,1.006,-.313;1.7492,1.4053,-1.5437;-.4868,-1.7475,-.6291;-.807,-1.6883,1.7444;.8278,-2.147,-.4458;.5079,-2.083,1.9423;1.3125,-2.3203,.8407;-4.6675,-1.8967,-.8823;4.1259,-.1261,-1.2218;1.3675,1.1665,3.2089;-5.4313,-.6494,-.8815;4.8483,.962,-1.878;-6.0637,.372,-.8632;5.4559,1.8512,-2.4101;-1.8109,3.4167,.4404;-1.3639,4.1047,-1.0997;-3.5524,2.8153,-1.0681;-2.4368,2.4481,-2.3656;-3.333,-1.3955,1.1664;-2.5327,.3189,-1.7796;-.2417,2.2585,1.6362;.1957,2.4168,-2.6076;2.2831,1.182,-2.4578;-.8484,-1.6205,-1.6412;-1.4406,-1.5202,2.6066;1.4624,-2.3268,-1.3033;.891,-2.2129,2.9456;-4.9011,-2.4677,-1.7826;-4.9789,-2.5045,-.0243;4.839,-.8579,-.8402;3.4952,-.6456,-1.9516;.3628,.7351,3.2137;1.9455,.7083,4.0091;1.2906,2.2399,3.4053;-6.6216,1.2819,-.8484;6.0013,2.6459,-2.869; 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 1665 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 216 Dim 1218 ENuc 3031.7754605096 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 4.651e-06 Time for diagonalization 0.526 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.250 sec Total time needed 0.783 sec 17 8 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 389.7033999999997 AuxInfo=1/0/N:29,28,25,27,26,14,18,19,20,21,17,7,8,24,23,13,9,12,22,16,15,10,11,1,6,4,3,5,2/E:(7,8)(9,10)/CRV:1.2,2.2,4.2,5.2,6.3,7.3,8.3,9.3,10.3,11.3,16.3,17.3,18.3,19.3,20.3,21.3,23.3,26.1/rA:51nClOOO1ONCCC3CC3C3C3C3C3C3C3C3C3C3C3C3CCCC2C2C2C2HHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;s6s7;s7;s2;s4s6s10;s10;s9;s9;s3s13;s5s15;s14s16;s12;s12;s18;s19;s1s20s21;s2;s5;s3;s23;s24;s26;s27;s7;s7;s8;s8;s10;s6;s13;s14;s17;s18;s19;s20;s21;s23;s23;s24;s24;s25;s25;s25;s28;s29;/rC:2.9398,-2.8663,1.0734;-3.2697,-1.7108,-.8799;2.0612,.8973,2.0093;-2.9507,1.0906,1.2332;3.3832,.3084,-.1074;-2.6,.9512,-.9987;-1.4825,3.1582,-.5656;-2.5792,2.3678,-1.2894;-.1709,2.4275,-.4927;-2.7572,-1.1009,.2799;-2.8004,.433,.2121;-1.3216,-1.5304,.463;.3268,2.0198,.7467;.5521,2.113,-1.6305;1.5185,1.3211,.8514;2.2406,1.006,-.313;1.7492,1.4053,-1.5437;-.4868,-1.7475,-.6291;-.807,-1.6883,1.7444;.8278,-2.147,-.4458;.5079,-2.083,1.9423;1.3125,-2.3203,.8407;-4.6675,-1.8967,-.8823;4.1259,-.1261,-1.2218;1.3675,1.1665,3.2089;-5.4313,-.6494,-.8815;4.8483,.962,-1.878;-6.0637,.372,-.8632;5.4559,1.8512,-2.4101;-1.8109,3.4167,.4404;-1.3639,4.1047,-1.0997;-3.5524,2.8153,-1.0681;-2.4368,2.4481,-2.3656;-3.333,-1.3955,1.1664;-2.5327,.3189,-1.7796;-.2417,2.2585,1.6362;.1957,2.4168,-2.6076;2.2831,1.182,-2.4578;-.8484,-1.6205,-1.6412;-1.4406,-1.5202,2.6066;1.4624,-2.3268,-1.3033;.891,-2.2129,2.9456;-4.9011,-2.4677,-1.7826;-4.9789,-2.5045,-.0243;4.839,-.8579,-.8402;3.4952,-.6456,-1.9516;.3628,.7351,3.2137;1.9455,.7083,4.0091;1.2906,2.2399,3.4053;-6.6216,1.2819,-.8484;6.0013,2.6459,-2.869; 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" 389.7033999999997 AuxInfo=1/0/N:29,28,25,27,26,14,18,19,20,21,17,7,8,24,23,13,9,12,22,16,15,10,11,1,6,4,3,5,2/E:(7,8)(9,10)/CRV:1.2,2.2,4.2,5.2,6.3,7.3,8.3,9.3,10.3,11.3,16.3,17.3,18.3,19.3,20.3,21.3,23.3,26.1/rA:51nClOOO1ONCCC3CC3C3C3C3C3C3C3C3C3C3C3C3CCCC2C2C2C2HHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;s6s7;s7;s2;s4s6s10;s10;s9;s9;s3s13;s5s15;s14s16;s12;s12;s18;s19;s1s20s21;s2;s5;s3;s23;s24;s26;s27;s7;s7;s8;s8;s10;s6;s13;s14;s17;s18;s19;s20;s21;s23;s23;s24;s24;s25;s25;s25;s28;s29;/rC:2.9398,-2.8663,1.0734;-3.2697,-1.7108,-.8799;2.0612,.8973,2.0093;-2.9507,1.0906,1.2332;3.3832,.3084,-.1074;-2.6,.9512,-.9987;-1.4825,3.1582,-.5656;-2.5792,2.3678,-1.2894;-.1709,2.4275,-.4927;-2.7572,-1.1009,.2799;-2.8004,.433,.2121;-1.3216,-1.5304,.463;.3268,2.0198,.7467;.5521,2.113,-1.6305;1.5185,1.3211,.8514;2.2406,1.006,-.313;1.7492,1.4053,-1.5437;-.4868,-1.7475,-.6291;-.807,-1.6883,1.7444;.8278,-2.147,-.4458;.5079,-2.083,1.9423;1.3125,-2.3203,.8407;-4.6675,-1.8967,-.8823;4.1259,-.1261,-1.2218;1.3675,1.1665,3.2089;-5.4313,-.6494,-.8815;4.8483,.962,-1.878;-6.0637,.372,-.8632;5.4559,1.8512,-2.4101;-1.8109,3.4167,.4404;-1.3639,4.1047,-1.0997;-3.5524,2.8153,-1.0681;-2.4368,2.4481,-2.3656;-3.333,-1.3955,1.1664;-2.5327,.3189,-1.7796;-.2417,2.2585,1.6362;.1957,2.4168,-2.6076;2.2831,1.182,-2.4578;-.8484,-1.6205,-1.6412;-1.4406,-1.5202,2.6066;1.4624,-2.3268,-1.3033;.891,-2.2129,2.9456;-4.9011,-2.4677,-1.7826;-4.9789,-2.5045,-.0243;4.839,-.8579,-.8402;3.4952,-.6456,-1.9516;.3628,.7351,3.2137;1.9455,.7083,4.0091;1.2906,2.2399,3.4053;-6.6216,1.2819,-.8484;6.0013,2.6459,-2.869; Epsilon 9.8629 Refrac 1.4295 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM Cl O N C H 2.3800 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 2987 GEPOL Volume 2881.6938 GEPOL Surface-area 1574.3306 Calculating surface distance matrix done! ( 0.2s) Performing Cholesky decomposition & store done! ( 0.7s) Overall time for CPCM initialization 0.9s -1705.52398201 3031.77546051 -4737.29944252 -8363.83348366 3626.53404113 -0.04949711 -3404.96645021 1699.44246820 2.00357853 107.999719025346 107.999719025346 215.999438050692 -141.298962936353 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 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19.5846 19.6221 19.8773 19.9742 20.1370 20.1925 20.2791 20.4569 20.5718 20.8371 20.9276 21.0046 21.0441 21.2418 21.3043 21.5123 21.5429 21.6048 21.7545 21.9105 22.1187 22.1865 22.3779 22.4771 22.5386 22.7362 22.8911 22.9481 23.0051 23.0810 23.2920 23.3616 23.6807 23.7633 23.8899 24.0740 24.2324 24.3082 24.4359 24.4793 24.6429 24.7560 24.8848 25.0558 25.1888 25.4102 25.5281 25.7106 25.7874 25.8632 25.9213 25.9931 26.0561 26.2176 26.3654 26.5564 26.5981 26.8276 26.8771 26.9189 27.1986 27.2348 27.4568 27.5053 27.6278 27.7356 27.8993 28.1498 28.2400 28.2912 28.3913 28.4133 28.6431 28.8353 28.9888 29.1487 29.1937 29.2319 29.5308 29.6354 29.8603 29.9006 29.9776 30.1176 30.1925 30.3853 30.4282 30.7048 30.8620 31.0698 31.3021 31.4197 31.5523 31.6927 31.8636 31.9210 31.9933 32.1415 32.2608 32.4609 32.5019 32.7228 32.8036 32.8656 32.9913 33.1133 33.2085 33.3567 33.4682 33.5016 33.5607 33.6640 33.7931 33.8424 33.9637 34.0374 34.2420 34.3283 34.5772 34.6125 34.9729 35.0467 35.1541 35.3194 35.4425 35.5485 35.6846 35.8583 36.0514 36.1392 36.1735 36.3232 36.5920 36.6597 36.9778 37.0585 37.1120 37.3284 37.3572 37.5977 37.6753 37.7626 37.8669 38.0243 38.1850 38.2557 38.4375 38.4875 38.5607 38.7199 38.7716 38.8194 38.9674 39.1167 39.2911 39.4971 39.6233 39.6644 39.9090 39.9730 40.1321 40.2470 40.3212 40.4038 40.6375 40.7623 41.0052 41.0745 41.1442 41.2635 41.3353 41.4195 41.4860 41.7520 41.8322 41.8685 42.1370 42.2088 42.3336 42.5157 42.5993 42.6960 42.8158 43.0111 43.0457 43.1128 43.3183 43.5208 43.5934 43.7309 43.8326 43.9003 44.0309 44.1180 44.2807 44.4747 44.7424 44.9520 44.9875 45.2065 45.3244 45.3558 45.5498 45.6895 45.7634 45.9153 46.0286 46.2905 46.3366 46.5395 46.7624 46.9028 47.0066 47.2391 47.2763 47.4810 47.6460 47.8663 47.9547 48.2066 48.2303 48.4468 48.8247 48.9348 49.0055 49.1998 49.3635 49.4909 49.6774 49.7477 49.9041 50.0577 50.0843 50.4873 50.8735 50.9939 51.1996 51.3654 51.5049 51.7729 51.8023 51.9410 52.1977 52.3276 52.5525 52.6459 52.8106 52.9494 53.0096 53.2078 53.4422 53.4646 53.5539 53.9444 54.0524 54.3165 54.5023 54.7118 54.8189 55.0029 55.1962 55.3972 55.6513 55.8221 55.9011 56.0581 56.1480 56.3791 56.5602 56.7192 57.0814 57.1854 57.5158 57.6235 58.0640 58.2501 58.4430 58.6049 58.7652 59.0477 59.1992 59.3660 59.5134 59.6748 59.7984 60.0809 60.2710 60.3772 60.5789 60.7407 60.8295 61.1070 61.2809 61.3852 61.6489 61.7506 62.0820 62.2940 62.3630 62.9190 63.0427 63.2122 63.4901 63.5999 63.7904 63.9488 64.2163 64.4020 64.5030 64.7100 64.8536 64.9762 65.3638 65.4272 65.5723 65.7901 65.8704 66.0625 66.2057 66.5799 66.7289 66.8613 67.0202 67.3072 67.3956 67.5175 67.9129 68.0278 68.3647 68.4022 68.5439 68.9724 69.1509 69.4500 69.6553 69.8597 70.1657 70.4963 70.5380 70.8970 71.1299 71.4488 71.5626 71.7924 71.9325 72.2593 72.3823 72.5961 72.8172 73.0314 73.2262 73.3767 73.7196 73.7924 73.9700 74.0247 74.1663 74.4026 74.4929 74.6189 74.6802 74.8007 74.9674 75.1646 75.5442 75.7375 76.0073 76.2684 76.3390 76.4264 76.4475 76.8290 76.8357 76.9123 77.1444 77.3091 77.4231 77.6499 77.7591 77.8577 78.0941 78.2469 78.3574 78.5246 78.7246 78.8393 78.8962 79.1536 79.2004 79.3089 79.5405 79.5833 79.6966 79.8533 79.9314 80.0667 80.1727 80.2280 80.4030 80.4612 80.6899 80.8416 80.9479 81.0262 81.0881 81.2279 81.2969 81.4530 81.6016 81.6851 81.8114 81.9127 82.1385 82.2741 82.4397 82.4545 82.6920 82.7632 82.8550 83.0313 83.1840 83.2489 83.3043 83.3895 83.5577 83.5776 83.6951 83.8032 83.8428 84.0371 84.1045 84.2084 84.3863 84.4225 84.5454 84.5633 84.6999 84.7742 84.8679 84.9916 85.1088 85.2507 85.4393 85.5007 85.5689 85.6821 85.9210 85.9933 86.2592 86.3135 86.3528 86.4495 86.5536 86.7121 86.8999 87.0449 87.1262 87.2433 87.3715 87.4728 87.6304 87.6562 87.9591 88.0636 88.1333 88.3187 88.3252 88.3888 88.7042 88.7808 88.8693 89.1445 89.2357 89.3538 89.4298 89.5431 89.6396 89.6588 89.9658 90.0153 90.0777 90.1665 90.4763 90.5078 90.6791 90.7388 90.7891 90.8648 91.1027 91.2990 91.3607 91.5023 91.6356 91.7077 91.7601 91.9135 92.0941 92.3475 92.5304 92.6790 92.7825 92.8323 92.9050 93.0338 93.1441 93.2241 93.2867 93.3372 93.6795 93.7506 93.8368 93.9628 94.0634 94.1760 94.2792 94.4201 94.4513 94.6106 94.7552 94.9317 95.1283 95.1908 95.3303 95.4810 95.6689 95.7329 95.9152 96.2241 96.2457 96.3960 96.4751 96.6639 96.7109 96.8594 97.0785 97.2626 97.4063 97.4709 97.5965 97.9321 97.9667 98.1599 98.2181 98.4181 98.5218 98.6587 98.9193 99.0054 99.0459 99.1208 99.3554 99.4682 99.6197 99.7757 99.9600 100.0446 100.2242 100.3232 100.3731 100.4999 100.7432 100.7848 100.9419 101.0274 101.2654 101.4696 101.5604 101.6882 101.7478 102.0045 102.1310 102.3685 102.4551 102.5066 102.7910 102.8501 103.0397 103.1643 103.3870 103.4559 103.5924 103.7199 103.8305 104.0144 104.2418 104.3532 104.5494 104.7812 104.9182 105.1065 105.3932 105.4767 105.7198 105.8273 106.0004 106.2158 106.3804 106.4102 106.6235 106.7707 106.9821 107.2101 107.3145 107.5634 107.7103 107.8339 107.8824 108.0637 108.2357 108.3682 108.4558 108.5234 108.7978 108.9172 109.0749 109.2316 109.3124 109.6457 109.7745 109.8272 110.0561 110.1090 110.4491 110.5561 110.7003 111.0296 111.2581 111.4146 111.5163 111.6443 111.7991 111.8591 112.0920 112.3709 112.4745 112.5648 112.7811 113.0207 113.1730 113.2870 113.5120 113.5964 113.8579 114.0168 114.1711 114.3355 114.4029 114.5599 114.7477 115.0151 115.0735 115.1475 115.2781 115.3889 115.6013 115.7183 115.8535 115.9451 116.2913 116.3680 116.5975 116.7752 117.0417 117.0632 117.1973 117.4468 117.6320 117.7263 117.9100 118.0602 118.1487 118.2360 118.3633 118.5369 118.6100 118.7238 118.7581 118.9187 119.0468 119.3440 119.3877 119.4857 119.5754 119.6243 119.9616 119.9741 120.1596 120.2164 120.3760 120.5340 120.6056 120.7938 121.0217 121.0412 121.2351 121.4429 121.7742 121.8079 122.1173 122.3410 122.4607 122.6007 122.7169 122.9914 123.1097 123.6252 123.8438 124.2805 124.3989 124.5920 125.1490 125.2527 125.5735 125.7423 126.4311 126.5990 126.9362 126.9820 127.0949 127.2505 127.3213 127.6249 127.7089 128.1473 128.3356 128.4300 128.7375 128.8966 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