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Method DFT(GTOs) Exchange WB97X-V Correlation WB97X-V PostSCFGGA off Hybrid DFT is turned on ScalHFX 0.167000 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 0.833000 Range separation parameter mu (erf(mu*r12)/r12) 0.300000 RI-approximation to the Coulomb term is turned on functions 11343 RIJ-COSX (HFX calculated with COS-X)) on IntName Cu_LOYMAN-solv_SP HFTyp RHF Charge 1 Mult 1 NEL 1360 Dim 6943 ENuc 60705.5966028357 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) 2.000e-06 Converg. threshold II (energy diff.) 1.000e-09 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 1.000e-12 Eh TCut 1.000e-14 Eh ConvCheckMode Total+1el-Energy ConvForced 0 TolE 1.000e-09 Eh 1-El. energy change 1.000e-06 Eh TolErr 1.000e-08 Smallest eigenvalue 1.937e-06 Time for diagonalization 5.796 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 5.850 sec Total time needed 11.798 sec 1 1 wB97X-D4 def2-TZVP def2-TZVP/C VeryTightSCF pal nproc 68 end %maxcore 7500 2269.2816000000007 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35.7037 35.7360 35.7554 35.7866 35.8076 35.8455 35.8741 35.8980 35.9033 35.9438 35.9797 35.9897 36.0058 36.0162 36.0525 36.1010 36.1109 36.1372 36.1576 36.1855 36.1976 36.2116 36.2373 36.2696 36.2886 36.3243 36.3547 36.3618 36.3998 36.4179 36.4496 36.4806 36.5104 36.5241 36.5423 36.5627 36.6305 36.6359 36.6667 36.6726 36.7040 36.7379 36.7454 36.8009 36.8304 36.8477 36.8750 36.8919 36.9466 36.9546 36.9652 36.9853 37.0314 37.0637 37.1039 37.1224 37.1570 37.1778 37.2105 37.2274 37.2518 37.2581 37.3076 37.3298 37.3402 37.3691 37.4118 37.4282 37.4816 37.5098 37.5440 37.5648 37.5933 37.6014 37.6404 37.6526 37.6738 37.6962 37.7058 37.7485 37.7820 37.8196 37.8660 37.8849 37.9222 37.9473 37.9655 37.9724 37.9792 38.0344 38.0559 38.0791 38.1166 38.1288 38.1302 38.1669 38.2019 38.2199 38.2647 38.3229 38.3397 38.3671 38.3695 38.3850 38.4181 38.4287 38.4644 38.5111 38.5454 38.5520 38.5779 38.6191 38.6372 38.6518 38.6811 38.7253 38.7368 38.7688 38.8091 38.8185 38.8353 38.8581 38.8841 38.9123 38.9252 38.9705 38.9781 38.9866 39.0262 39.0427 39.0772 39.0859 39.1200 39.1738 39.2076 39.2219 39.2363 39.2598 39.2891 39.3310 39.3419 39.3724 39.3962 39.4159 39.4664 39.4754 39.4857 39.5322 39.5483 39.5962 39.6220 39.6419 39.6881 39.7225 39.7300 39.7566 39.7664 39.7898 39.8126 39.8587 39.8666 39.9114 39.9427 39.9506 39.9903 40.0121 40.0239 40.0605 40.0809 40.1187 40.1457 40.1690 40.1862 40.2293 40.2736 40.2891 40.3167 40.3284 40.3479 40.3902 40.4138 40.4456 40.4584 40.4834 40.5283 40.5501 40.5734 40.6005 40.6124 40.6532 40.6712 40.7080 40.7366 40.7438 40.8124 40.8170 40.8378 40.8859 40.9025 40.9224 40.9461 40.9614 40.9820 40.9913 41.0225 41.0399 41.0521 41.1204 41.1438 41.1575 41.1721 41.1802 41.2293 41.2608 41.2708 41.2909 41.3268 41.3561 41.3743 41.4099 41.4504 41.4675 41.4887 41.5284 41.5566 41.5781 41.5952 41.6059 41.6264 41.6480 41.6841 41.6996 41.7227 41.7794 41.8128 41.8313 41.8341 41.8654 41.8941 41.9181 41.9301 42.0046 42.0345 42.0477 42.0983 42.1069 42.1307 42.1672 42.1981 42.2205 42.2559 42.2763 42.2915 42.3454 42.3517 42.3636 42.4207 42.4240 42.4733 42.4818 42.4909 42.5254 42.5463 42.5736 42.5962 42.6265 42.6548 42.6783 42.7264 42.7308 42.7499 42.7647 42.8177 42.8281 42.8467 42.8639 42.8892 42.9145 42.9235 42.9486 42.9657 42.9729 42.9888 42.9970 43.0427 43.0456 43.0817 43.0976 43.1123 43.1390 43.1732 43.2028 43.2090 43.2290 43.2412 43.2801 43.3060 43.3498 43.3802 43.3875 43.3987 43.4230 43.4461 43.4675 43.4890 43.5169 43.5227 43.5385 43.5857 43.6072 43.6548 43.6651 43.6777 43.6810 43.7254 43.7484 43.7705 43.7884 43.8155 43.8413 43.8735 43.8902 43.8931 43.9118 43.9451 43.9537 43.9831 44.0119 44.0386 44.0525 44.0676 44.0904 44.1188 44.1364 44.1521 44.1678 44.1733 44.1896 44.2145 44.2530 44.2615 44.2913 44.2968 44.3304 44.3552 44.3811 44.3946 44.4275 44.4418 44.4659 44.4869 44.4910 44.5434 44.5551 44.5916 44.5984 44.6139 44.6477 44.6573 44.6651 44.7160 44.7231 44.7527 44.7652 44.7802 44.7859 44.7982 44.8303 44.8405 44.8634 44.8830 44.9102 44.9240 44.9408 44.9529 44.9984 45.0140 45.0348 45.0468 45.0599 45.0803 45.1118 45.1253 45.1601 45.1651 45.1873 45.2120 45.2233 45.2535 45.2675 45.2882 45.2964 45.3176 45.3316 45.3514 45.3574 45.3680 45.3935 45.4119 45.4383 45.4466 45.4578 45.4886 45.5109 45.5344 45.5518 45.5734 45.5882 45.6315 45.6515 45.6599 45.6862 45.6929 45.7201 45.7294 45.7499 45.7674 45.7937 45.8154 45.8410 45.8510 45.8739 45.9092 45.9240 45.9655 45.9714 45.9873 46.0108 46.0332 46.0359 46.0623 46.0681 46.0925 46.1053 46.1319 46.1551 46.1602 46.1836 46.1988 46.2206 46.2601 46.2723 46.2969 46.3370 46.3444 46.3594 46.3886 46.4076 46.4265 46.4362 46.4545 46.4695 46.4825 46.4916 46.5424 46.5575 46.5674 46.5888 46.6280 46.6368 46.6550 46.6574 46.6704 46.6792 46.7475 46.7612 46.7735 46.7882 46.8003 46.8356 46.8650 46.8809 46.8998 46.9086 46.9227 46.9537 46.9685 46.9901 47.0073 47.0332 47.0561 47.0623 47.0815 47.1069 47.1170 47.1396 47.1703 47.1947 47.2117 47.2341 47.2603 47.2942 47.2968 47.3193 47.3278 47.3697 47.3969 47.4074 47.4414 47.4539 47.4770 47.4827 47.5145 47.5284 47.5375 47.5482 47.5779 47.5990 47.6185 47.6298 47.6621 47.6679 47.6976 47.7235 47.7422 47.7691 47.7918 47.8039 47.8321 47.8464 47.8871 47.9027 47.9175 47.9371 47.9869 47.9968 48.0099 48.0420 48.0637 48.0733 48.1160 48.1367 48.1466 48.1732 48.1963 48.2049 48.2142 48.2429 48.2523 48.2817 48.2979 48.3170 48.3408 48.3751 48.3897 48.4245 48.4425 48.4455 48.4813 48.5059 48.5111 48.5387 48.5537 48.6067 48.6079 48.6219 48.6269 48.6496 48.6718 48.6836 48.7183 48.7297 48.7431 48.7867 48.8138 48.8172 48.8350 48.8940 48.9248 48.9506 48.9692 49.0147 49.0205 49.0405 49.0533 49.0899 49.1200 49.1400 49.1492 49.1928 49.2000 49.2122 49.2227 49.2825 49.3249 49.3393 49.3536 49.3624 49.3953 49.4266 49.4412 49.4639 49.4973 49.5239 49.5546 49.6112 49.6172 49.6303 49.6722 49.7152 49.7280 49.7658 49.7785 49.8061 49.8278 49.8635 49.8763 49.9055 49.9315 49.9628 50.0094 50.0418 50.0818 50.0942 50.1388 50.1475 50.1659 50.1992 50.2111 50.2674 50.2739 50.3095 50.3258 50.3644 50.4006 50.4208 50.4232 50.4955 50.5163 50.5539 50.5760 50.5910 50.6382 50.6590 50.6894 50.7449 50.7526 50.7762 50.7808 50.8138 50.8542 50.8829 50.9041 50.9301 50.9333 50.9791 51.0011 51.0466 51.0835 51.0891 51.1159 51.1515 51.1768 51.1925 51.2193 51.2370 51.2782 51.3419 51.3491 51.3741 51.4110 51.4268 51.4494 51.4818 51.5093 51.5521 51.5586 51.6055 51.6262 51.6428 51.6715 51.7356 51.7524 51.7800 51.7887 51.8103 51.8536 51.8692 51.8922 51.8982 51.9026 51.9538 52.0045 52.0124 52.0347 52.0671 52.0759 52.1117 52.1437 52.1762 52.1850 52.1969 52.2481 52.2520 52.2698 52.3105 52.3264 52.3520 52.3735 52.4151 52.4428 52.4466 52.4687 52.4725 52.5141 52.5242 52.5433 52.5777 52.5849 52.6180 52.6481 52.6677 52.6772 52.7038 52.7270 52.7310 52.7929 52.8155 52.8357 52.8613 52.8801 52.8942 52.9204 52.9229 52.9857 52.9892 53.0197 53.0424 53.0749 53.0877 53.0975 53.1184 53.1428 53.1628 53.1782 53.1990 53.2388 53.2756 53.3035 53.3121 53.3417 53.3710 53.4004 53.4093 53.4366 53.4779 53.5008 53.5015 53.5302 53.5753 53.5826 53.5869 53.6079 53.6424 53.6797 53.6937 53.7253 53.7598 53.7861 53.7957 53.8157 53.8352 53.8730 53.9101 53.9290 53.9419 53.9519 53.9943 54.0062 54.0229 54.0615 54.0843 54.0944 54.1137 54.1475 54.1658 54.2217 54.2412 54.2567 54.2746 54.2984 54.3183 54.3427 54.3645 54.4079 54.4171 54.4463 54.4683 54.4823 54.5150 54.5455 54.5947 54.6009 54.6189 54.6701 54.6755 54.6842 54.7241 54.7351 54.7827 54.8126 54.8247 54.8323 54.8620 54.9016 54.9250 54.9372 54.9737 54.9852 55.0150 55.0434 55.0963 55.1212 55.1375 55.1425 55.1689 55.2047 55.2110 55.2412 55.2669 55.2758 55.3152 55.3313 55.3528 55.3768 55.4145 55.4489 55.4549 55.4805 55.5005 55.5104 55.5414 55.5542 55.5825 55.6110 55.6205 55.6508 55.6645 55.6865 55.6981 55.7114 55.7427 55.7571 55.8029 55.8358 55.8504 55.8567 55.9018 55.9231 55.9578 55.9778 56.0221 56.0529 56.0660 56.1014 56.1143 56.1206 56.1481 56.1506 56.1750 56.2101 56.2406 56.2653 56.2976 56.3265 56.3552 56.3631 56.3692 56.3948 56.4137 56.4568 56.4973 56.5167 56.5352 56.5737 56.5799 56.5862 56.6199 56.6367 56.6773 56.6973 56.7204 56.7415 56.7745 56.8156 56.8312 56.8506 56.8657 56.8785 56.8962 56.9320 56.9525 57.0011 57.0096 57.0125 57.0503 57.0814 57.1021 57.1084 57.1451 57.1753 57.1916 57.2322 57.2575 57.2878 57.3015 57.3336 57.3647 57.3731 57.3858 57.4007 57.4201 57.4690 57.4906 57.5450 57.5482 57.5815 57.6157 57.6600 57.6750 57.6935 57.7284 57.7308 57.7869 57.7979 57.8028 57.8449 57.8693 57.9125 57.9292 57.9639 58.0043 58.0139 58.0311 58.0462 58.0905 58.1546 58.1914 58.2206 58.2478 58.2601 58.2759 58.3045 58.3442 58.3512 58.3725 58.4106 58.4547 58.4596 58.4799 58.5131 58.5430 58.5795 58.5931 58.6066 58.6499 58.6794 58.6999 58.7508 58.7707 58.7905 58.8170 58.8343 58.8596 58.9294 58.9333 58.9589 58.9644 59.0158 59.0418 59.0661 59.1028 59.1307 59.1636 59.1749 59.2147 59.2607 59.2754 59.2805 59.3234 59.3466 59.3605 59.4295 59.4479 59.4688 59.4879 59.5025 59.5238 59.5734 59.5801 59.6354 59.6705 59.6960 59.7550 59.7750 59.8129 59.8288 59.8628 59.9023 59.9079 59.9389 59.9860 60.0629 60.0948 60.1381 60.1436 60.1614 60.1717 60.2103 60.2204 60.2615 60.3360 60.3525 60.4092 60.4395 60.4642 60.4684 60.5001 60.5330 60.5954 60.6251 60.6320 60.6691 60.6760 60.6974 60.7247 60.7453 60.8057 60.8392 60.8620 60.8854 60.9014 60.9452 60.9819 60.9921 61.0022 61.0323 61.0693 61.0972 61.1252 61.1832 61.1913 61.2010 61.2274 61.2483 61.3045 61.3086 61.3170 61.3311 61.3492 61.3945 61.4225 61.4863 61.4992 61.5245 61.5472 61.5945 61.6179 61.6589 61.6899 61.7049 61.7367 61.7442 61.8021 61.8152 61.8347 61.8387 61.8626 61.8716 61.9401 61.9508 61.9706 61.9905 62.0247 62.0380 62.0491 62.0577 62.1008 62.1285 62.1657 62.1794 62.2048 62.2273 62.2739 62.2946 62.3320 62.3397 62.3628 62.4030 62.4208 62.4452 62.4824 62.5082 62.5423 62.5757 62.5941 62.6199 62.6449 62.6947 62.7189 62.7720 62.7892 62.8082 62.8199 62.8546 62.8709 62.8851 62.9393 62.9951 63.0109 63.0317 63.0812 63.1006 63.1215 63.1494 63.1691 63.2242 63.2346 63.2497 63.2744 63.3071 63.3111 63.3455 63.3631 63.4331 63.4373 63.4968 63.5218 63.5278 63.5451 63.5736 63.5809 63.6128 63.6288 63.6630 63.6906 63.7056 63.7321 63.7405 63.7895 63.7956 63.8233 63.8755 63.8831 63.9317 63.9612 63.9740 63.9892 64.0006 64.0269 64.0457 64.0797 64.0918 64.1060 64.1476 64.1670 64.1975 64.2024 64.2436 64.2622 64.2749 64.2896 64.3178 64.3572 64.4011 64.4069 64.4548 64.4655 64.4990 64.5199 64.5349 64.5614 64.5826 64.6255 64.6343 64.6520 64.6641 64.6711 64.7216 64.7751 64.8090 64.8209 64.8518 64.8637 64.8862 64.9101 64.9508 64.9659 64.9890 65.0188 65.0431 65.0555 65.0704 65.0883 65.1240 65.1344 65.1420 65.1576 65.1654 65.1958 65.2185 65.2369 65.2642 65.2854 65.3248 65.3329 65.3629 65.3713 65.3781 65.3926 65.4475 65.4569 65.4734 65.4756 65.5169 65.5438 65.5639 65.5876 65.6183 65.6342 65.6577 65.6913 65.7003 65.7098 65.7514 65.7728 65.7759 65.7861 65.8223 65.8379 65.8482 65.8835 65.9180 65.9246 65.9273 65.9472 65.9557 65.9853 65.9899 66.0086 66.0554 66.0730 66.0944 66.1059 66.1255 66.1651 66.1672 66.1903 66.2171 66.2340 66.2490 66.2962 66.3054 66.3297 66.3422 66.3656 66.3889 66.3996 66.4127 66.4243 66.4505 66.4655 66.4911 66.5001 66.5370 66.5440 66.5768 66.5969 66.6186 66.6357 66.6433 66.6713 66.6883 66.7031 66.7126 66.7245 66.7487 66.7577 66.7933 66.8094 66.8345 66.8561 66.9003 66.9111 66.9298 66.9454 66.9684 66.9975 67.0101 67.0133 67.0382 67.0694 67.0780 67.0897 67.1180 67.1238 67.1286 67.1538 67.1716 67.1871 67.2212 67.2439 67.2500 67.2804 67.3021 67.3189 67.3318 67.3761 67.3968 67.4024 67.4379 67.4437 67.4683 67.5015 67.5064 67.5418 67.5605 67.5743 67.5916 67.6088 67.6134 67.6492 67.6556 67.6698 67.6768 67.6917 67.7265 67.7648 67.7883 67.8048 67.8311 67.8493 67.8773 67.8846 67.9129 67.9412 67.9585 67.9602 67.9737 67.9802 67.9984 68.0459 68.0696 68.0803 68.1094 68.1288 68.1510 68.1718 68.1927 68.2193 68.2300 68.2783 68.2910 68.3005 68.3251 68.3397 68.3568 68.3759 68.3974 68.4119 68.4462 68.4676 68.4890 68.5081 68.5365 68.5616 68.5748 68.5873 68.6090 68.6378 68.6533 68.6828 68.7044 68.7221 68.7332 68.7400 68.7498 68.7761 68.7957 68.8119 68.8195 68.8508 68.8655 68.8820 68.8872 68.9019 68.9287 68.9586 68.9738 68.9943 69.0208 69.0376 69.0514 69.0718 69.0871 69.1119 69.1223 69.1421 69.1724 69.1786 69.2006 69.2267 69.2357 69.2504 69.2644 69.2766 69.2978 69.3042 69.3338 69.3509 69.3836 69.3891 69.4390 69.4457 69.4488 69.4638 69.5253 69.5403 69.5554 69.5665 69.6002 69.6166 69.6438 69.6742 69.7088 69.7321 69.7497 69.7745 69.7978 69.8120 69.8422 69.8497 69.9029 69.9144 69.9670 69.9859 70.0021 70.0150 70.0270 70.0321 70.0509 70.0805 70.1036 70.1287 70.1390 70.1696 70.1754 70.1962 70.2135 70.2393 70.2475 70.2669 70.3088 70.3278 70.3494 70.3571 70.3746 70.3966 70.4069 70.4226 70.4573 70.4677 70.5003 70.5096 70.5230 70.5576 70.5809 70.6129 70.6185 70.6488 70.6718 70.6923 70.7222 70.7408 70.7459 70.7792 70.7905 70.8164 70.8462 70.8689 70.9036 70.9103 70.9515 70.9758 70.9826 71.0120 71.0268 71.0516 71.0621 71.0816 71.1281 71.1366 71.1691 71.1970 71.2137 71.2411 71.2735 71.2816 71.3153 71.3514 71.3584 71.3801 71.4181 71.4460 71.4545 71.4723 71.4973 71.5028 71.5147 71.5556 71.5896 71.6169 71.6748 71.6863 71.7133 71.7272 71.7328 71.7609 71.7775 71.7922 71.8054 71.8205 71.8441 71.8632 71.8923 71.9056 71.9335 71.9593 71.9631 71.9961 72.0000 72.0050 72.0314 72.0459 72.0907 72.1093 72.1615 72.1971 72.2127 72.2207 72.2391 72.2443 72.2816 72.2930 72.3228 72.3384 72.3741 72.3815 72.4025 72.4350 72.4545 72.4662 72.4740 72.4925 72.5181 72.5226 72.5361 72.5621 72.5790 72.6126 72.6281 72.6653 72.6699 72.7003 72.7074 72.7239 72.7479 72.7582 72.7792 72.8082 72.8530 72.8785 72.9064 72.9191 72.9457 72.9678 72.9951 73.0023 73.0261 73.0631 73.0724 73.1090 73.1369 73.1681 73.1827 73.2003 73.2074 73.2418 73.2721 73.2756 73.2867 73.3064 73.3564 73.3665 73.3921 73.4099 73.4255 73.4460 73.4646 73.4766 73.4943 73.5414 73.5576 73.5749 73.5975 73.6073 73.6551 73.6734 73.6748 73.6887 73.7162 73.7403 73.7589 73.7902 73.8180 73.8415 73.8606 73.8673 73.8883 73.9254 73.9279 73.9528 73.9612 73.9712 73.9771 74.0060 74.0343 74.0545 74.0723 74.0954 74.1006 74.1250 74.1567 74.1624 74.1760 74.2028 74.2381 74.2837 74.2901 74.3296 74.3403 74.3561 74.3702 74.3773 74.3796 74.4030 74.4198 74.4472 74.4613 74.4693 74.4840 74.5085 74.5306 74.5486 74.5740 74.5938 74.5957 74.6426 74.6497 74.6594 74.6852 74.7058 74.7250 74.7505 74.7892 74.8225 74.8247 74.8379 74.8424 74.8926 74.9308 74.9402 74.9740 74.9967 75.0015 75.0293 75.0468 75.0706 75.0919 75.1124 75.1294 75.1562 75.1697 75.1786 75.2014 75.2464 75.2561 75.2850 75.2977 75.3039 75.3268 75.3439 75.3799 75.4001 75.4350 75.4474 75.4616 75.4983 75.5152 75.5373 75.5627 75.5936 75.6069 75.6185 75.6205 75.6541 75.6688 75.6834 75.7166 75.7403 75.7527 75.7682 75.7876 75.8096 75.8360 75.8707 75.8772 75.8883 75.9124 75.9296 75.9549 75.9643 75.9820 76.0078 76.0237 76.0609 76.0808 76.1080 76.1185 76.1558 76.1705 76.2015 76.2289 76.2475 76.2858 76.2951 76.3052 76.3358 76.3511 76.3782 76.3917 76.4037 76.4327 76.4399 76.5017 76.5088 76.5153 76.5354 76.5638 76.5990 76.6171 76.6580 76.6658 76.6871 76.7172 76.7238 76.7591 76.8271 76.8273 76.8451 76.8967 76.9091 76.9392 76.9510 76.9835 77.0028 77.0323 77.0577 77.0749 77.0963 77.1411 77.1785 77.1846 77.2415 77.2629 77.2767 77.3171 77.3215 77.3454 77.3573 77.3785 77.4131 77.4429 77.4504 77.4782 77.4988 77.5603 77.5862 77.5943 77.6318 77.6738 77.6804 77.7334 77.7436 77.7556 77.7769 77.8058 77.8190 77.8390 77.8997 77.9223 77.9345 77.9536 77.9778 77.9946 78.0035 78.0234 78.0544 78.0985 78.1321 78.1557 78.1657 78.1910 78.2191 78.2296 78.2751 78.2779 78.3208 78.3311 78.3486 78.3924 78.4049 78.4182 78.4400 78.4792 78.4896 78.4974 78.5252 78.5499 78.5726 78.5873 78.5986 78.6240 78.6554 78.6812 78.6852 78.7422 78.7570 78.7854 78.7994 78.8055 78.8202 78.8329 78.8520 78.8576 78.8877 78.9207 78.9316 78.9666 78.9900 79.0012 79.0225 79.0684 79.0746 79.0880 79.1166 79.1440 79.1570 79.1750 79.2058 79.2149 79.2379 79.2497 79.2866 79.3066 79.3306 79.3521 79.3892 79.4039 79.4382 79.4774 79.4863 79.4949 79.5451 79.5756 79.6036 79.6232 79.6321 79.6456 79.6740 79.6884 79.7335 79.7460 79.7682 79.7833 79.8071 79.8479 79.8768 79.8897 79.9266 79.9500 79.9576 79.9746 79.9873 80.0298 80.0545 80.0693 80.0961 80.1222 80.1304 80.1560 80.1739 80.1882 80.2378 80.2434 80.2600 80.2918 80.3015 80.3412 80.3466 80.3887 80.4202 80.4319 80.4557 80.4726 80.4932 80.5245 80.5385 80.5592 80.5943 80.6221 80.6429 80.6631 80.6738 80.7051 80.7162 80.7416 80.7581 80.8053 80.8278 80.8421 80.8742 80.9071 80.9176 80.9617 80.9868 81.0148 81.0368 81.0624 81.0664 81.1180 81.1315 81.1608 81.1888 81.2114 81.2532 81.2743 81.2867 81.3282 81.3440 81.3835 81.4239 81.4589 81.4892 81.5151 81.5575 81.5736 81.6145 81.6546 81.6863 81.7065 81.7306 81.7484 81.7657 81.7741 81.8052 81.8294 81.8859 81.9127 81.9408 81.9488 81.9724 81.9795 82.0019 82.0206 82.0804 82.1092 82.1227 82.1327 82.1596 82.1895 82.2188 82.2539 82.2663 82.3082 82.3110 82.3443 82.3524 82.3770 82.4222 82.4513 82.4630 82.4743 82.4904 82.5324 82.5471 82.6185 82.6325 82.6775 82.6995 82.7129 82.7558 82.7641 82.7940 82.8190 82.8790 82.8863 82.9232 82.9351 82.9748 82.9904 82.9937 83.0375 83.0828 83.1083 83.1382 83.1684 83.1836 83.2207 83.2531 83.2710 83.3091 83.3130 83.3662 83.3819 83.4097 83.4144 83.4437 83.4639 83.4887 83.5155 83.5424 83.5597 83.5967 83.6089 83.6395 83.6564 83.6797 83.6912 83.7101 83.7217 83.7428 83.7944 83.8230 83.8311 83.8466 83.8791 83.8980 83.9282 83.9454 83.9680 83.9720 84.0089 84.0359 84.0368 84.0801 84.1095 84.1405 84.1754 84.1897 84.2154 84.2204 84.2421 84.3018 84.3262 84.3515 84.3838 84.3971 84.4375 84.4489 84.4683 84.4985 84.5044 84.5192 84.5584 84.5783 84.6097 84.6161 84.6502 84.6572 84.6706 84.6891 84.7194 84.7584 84.7788 84.7825 84.8071 84.8367 84.8742 84.8956 84.9143 84.9455 84.9794 84.9992 85.0308 85.0588 85.0812 85.1028 85.1287 85.1485 85.1671 85.1957 85.2177 85.2380 85.2863 85.2888 85.3206 85.3354 85.3478 85.3849 85.3948 85.4328 85.4646 85.4687 85.4890 85.5238 85.5678 85.5752 85.5956 85.6124 85.6189 85.6446 85.6705 85.7047 85.7185 85.7466 85.7650 85.7832 85.8072 85.8207 85.8418 85.8708 85.8897 85.9040 85.9252 85.9654 85.9750 86.0004 86.0302 86.0390 86.0723 86.0810 86.0949 86.1276 86.1609 86.1865 86.2175 86.2470 86.2560 86.2848 86.3217 86.3787 86.3905 86.4179 86.4315 86.4673 86.5186 86.5533 86.5595 86.6048 86.6144 86.6549 86.6590 86.7117 86.7324 86.7581 86.7648 86.7796 86.8263 86.8462 86.8611 86.8790 86.8985 86.9226 86.9408 86.9554 86.9814 86.9941 87.0415 87.0644 87.0888 87.1196 87.1292 87.1406 87.1600 87.1790 87.2020 87.2094 87.2251 87.2586 87.2677 87.2927 87.3026 87.3212 87.3295 87.3865 87.4050 87.4088 87.4333 87.4505 87.4567 87.4731 87.5030 87.5186 87.5323 87.5574 87.5887 87.6130 87.6411 87.6605 87.6963 87.7091 87.7616 87.7700 87.8073 87.8145 87.8261 87.8433 87.8957 87.9072 87.9375 87.9481 87.9686 87.9803 87.9932 88.0306 88.0499 88.0730 88.1049 88.1164 88.1326 88.1426 88.1756 88.2060 88.2272 88.2452 88.2759 88.2839 88.3032 88.3392 88.3879 88.4105 88.4339 88.4544 88.4848 88.5052 88.5285 88.5497 88.5579 88.5887 88.6185 88.6370 88.6434 88.6643 88.6840 88.7168 88.7415 88.7536 88.7769 88.7910 88.8009 88.8248 88.8872 88.8919 88.9279 88.9414 88.9613 88.9737 89.0059 89.0156 89.0638 89.0790 89.1076 89.1354 89.1433 89.1497 89.1771 89.1907 89.2245 89.2502 89.2677 89.2994 89.3042 89.3285 89.3474 89.3635 89.3722 89.3857 89.3984 89.4227 89.4315 89.4835 89.4904 89.5072 89.5380 89.5637 89.5867 89.6248 89.6350 89.6492 89.6681 89.6837 89.7099 89.7262 89.7642 89.7745 89.7895 89.8186 89.8422 89.8676 89.8781 89.9035 89.9210 89.9335 89.9629 89.9837 89.9889 90.0032 90.0372 90.0557 90.0613 90.0738 90.0930 90.1204 90.1474 90.1644 90.1910 90.1963 90.2229 90.2531 90.2705 90.2742 90.3083 90.3266 90.3419 90.3775 90.4068 90.4210 90.4468 90.4531 90.4724 90.4979 90.5244 90.5391 90.5532 90.5777 90.5886 90.6193 90.6340 90.6568 90.6705 90.7036 90.7229 90.7415 90.7720 90.7911 90.8112 90.8151 90.8616 90.8651 90.8875 90.9176 90.9481 90.9709 90.9759 91.0019 91.0190 91.0319 91.0436 91.0596 91.0806 91.0918 91.1211 91.1332 91.1680 91.1945 91.2063 91.2209 91.2401 91.2465 91.2755 91.2890 91.3376 91.3433 91.3731 91.3779 91.3829 91.4214 91.4267 91.4437 91.4559 91.4882 91.5189 91.5385 91.5508 91.5665 91.5964 91.6196 91.6409 91.6567 91.6838 91.7053 91.7191 91.7309 91.7570 91.7743 91.7839 91.8231 91.8337 91.8482 91.8689 91.8814 91.9037 91.9257 91.9730 91.9855 91.9985 92.0120 92.0303 92.0350 92.0796 92.1073 92.1188 92.1371 92.1514 92.1724 92.1836 92.2100 92.2326 92.2535 92.2809 92.3051 92.3324 92.3403 92.3476 92.3792 92.3977 92.4243 92.4569 92.4697 92.4850 92.5131 92.5250 92.5415 92.5693 92.5977 92.6029 92.6037 92.6549 92.6676 92.6784 92.6806 92.7006 92.7109 92.7402 92.7521 92.7645 92.7731 92.8077 92.8211 92.8401 92.8568 92.8975 92.9232 92.9306 92.9533 92.9602 92.9650 92.9951 93.0172 93.0376 93.0475 93.0616 93.0879 93.1019 93.1324 93.1456 93.1684 93.1757 93.1961 93.2139 93.2345 93.2483 93.2894 93.2984 93.3086 93.3173 93.3607 93.3786 93.4086 93.4293 93.4374 93.4641 93.4993 93.5229 93.5334 93.5558 93.5760 93.6234 93.6283 93.6520 93.6689 93.6810 93.6961 93.7133 93.7209 93.7515 93.7633 93.7764 93.7972 93.8096 93.8346 93.8497 93.8654 93.8806 93.8940 93.9251 93.9346 93.9425 93.9671 93.9779 93.9914 94.0096 94.0449 94.0472 94.0677 94.0931 94.1051 94.1218 94.1522 94.1772 94.1978 94.2012 94.2134 94.2552 94.2662 94.2893 94.3063 94.3302 94.3505 94.3659 94.3762 94.4108 94.4270 94.4425 94.4627 94.4769 94.4925 94.5069 94.5136 94.5441 94.5589 94.5801 94.5892 94.6183 94.6279 94.6532 94.6540 94.6745 94.6994 94.7087 94.7179 94.7391 94.7598 94.7795 94.7920 94.7979 94.8105 94.8365 94.8533 94.8682 94.9313 94.9550 94.9728 94.9761 95.0003 95.0154 95.0336 95.0594 95.0827 95.0840 95.1119 95.1233 95.1350 95.1597 95.1810 95.1861 95.1986 95.2156 95.2457 95.2523 95.2733 95.2878 95.3241 95.3325 95.3419 95.3575 95.3726 95.3894 95.3987 95.4228 95.4507 95.4566 95.4804 95.4820 95.5362 95.5498 95.5726 95.6025 95.6093 95.6420 95.6544 95.6734 95.7302 95.7373 95.7416 95.7648 95.7752 95.8197 95.8247 95.8764 95.8988 95.9061 95.9514 95.9705 96.0012 96.0314 96.0535 96.0674 96.1006 96.1555 96.1723 96.1943 96.2024 96.2301 96.2398 96.2525 96.2696 96.3044 96.3406 96.3513 96.3870 96.3999 96.4279 96.4632 96.4828 96.5005 96.5182 96.5287 96.5761 96.5889 96.6338 96.6365 96.6876 96.7121 96.7208 96.7744 96.7781 96.7990 96.8026 96.8127 96.8549 96.8777 96.9076 96.9218 96.9374 96.9515 96.9792 97.0186 97.0308 97.0817 97.0902 97.1141 97.1457 97.1564 97.1721 97.2149 97.2209 97.2464 97.2822 97.2960 97.3113 97.3253 97.3541 97.3685 97.3834 97.4168 97.4232 97.4447 97.4609 97.4760 97.5069 97.5137 97.5564 97.5958 97.6442 97.6845 97.6943 97.7098 97.7201 97.7533 97.7764 97.8300 97.8396 97.8521 97.8667 97.8860 97.9148 97.9182 97.9343 97.9539 97.9786 97.9965 98.0322 98.0413 98.0530 98.0912 98.1143 98.1468 98.1489 98.1873 98.2003 98.2160 98.2263 98.2386 98.2702 98.2746 98.3068 98.3186 98.3509 98.3670 98.4008 98.4280 98.4367 98.4766 98.4897 98.4935 98.5531 98.5790 98.5941 98.6226 98.6303 98.6643 98.6792 98.7016 98.7320 98.7468 98.7709 98.7844 98.8054 98.8173 98.8469 98.8587 98.8679 98.8990 98.9205 98.9446 98.9593 98.9816 99.0301 99.0431 99.0562 99.0888 99.1070 99.1337 99.1481 99.1564 99.1647 99.1837 99.2151 99.2379 99.2563 99.2897 99.3379 99.3479 99.3596 99.3858 99.4386 99.4607 99.4832 99.5141 99.5346 99.5493 99.5744 99.6079 99.6464 99.6481 99.6670 99.6834 99.6985 99.7291 99.7547 99.7737 99.8145 99.8330 99.8499 99.8744 99.8948 99.9126 99.9294 99.9404 99.9714 99.9976 100.0018 100.0379 100.0436 100.0523 100.0762 100.1029 100.1693 100.1814 100.2066 100.2283 100.2362 100.2539 100.2764 100.2812 100.2949 100.3159 100.3315 100.3728 100.4008 100.4586 100.4860 100.5174 100.5252 100.5301 100.5534 100.5874 100.5975 100.6067 100.6419 100.6567 100.6869 100.7073 100.7153 100.7183 100.7635 100.8321 100.8555 100.8707 100.9033 100.9423 100.9497 100.9544 100.9934 101.0156 101.0422 101.0537 101.0654 101.0902 101.1132 101.1506 101.1776 101.1996 101.2313 101.2463 101.2846 101.3235 101.3587 101.3887 101.4000 101.4530 101.4537 101.5234 101.5622 101.5911 101.6277 101.6452 101.6818 101.7238 101.7327 101.7646 101.7922 101.8330 101.8713 101.9048 101.9111 101.9425 101.9595 101.9917 102.0188 102.0744 102.1405 102.1569 102.1688 102.1946 102.2214 102.2302 102.2707 102.2750 102.3415 102.3474 102.3572 102.3925 102.4149 102.4825 102.4996 102.5292 102.5603 102.5673 102.5763 102.6131 102.6609 102.6755 102.7028 102.7441 102.7815 102.8006 102.8565 102.8815 102.8936 102.9339 102.9662 102.9849 103.0149 103.0481 103.0740 103.0929 103.1329 103.1562 103.1944 103.2061 103.2671 103.2847 103.3113 103.3286 103.3346 103.3722 103.3984 103.4352 103.4619 103.4778 103.5019 103.5188 103.5573 103.5831 103.6158 103.6626 103.6811 103.6971 103.7435 103.7568 103.7645 103.8024 103.8178 103.8533 103.8730 103.9254 103.9315 103.9560 104.0071 104.0422 104.0957 104.1390 104.1498 104.2136 104.2280 104.2306 104.2788 104.2853 104.3398 104.3897 104.4073 104.4235 104.4536 104.4902 104.5457 104.5578 104.5837 104.6270 104.6349 104.6470 104.6641 104.7148 104.7404 104.8189 104.8766 104.8950 104.9695 104.9877 105.0361 105.1115 105.1518 105.1787 105.2102 105.2397 105.2687 105.2874 105.3159 105.3631 105.4362 105.4916 105.5094 105.5297 105.5729 105.5987 105.6104 105.6654 105.6962 105.7174 105.7362 105.7554 105.8108 105.8299 105.8451 105.8869 105.9257 105.9328 105.9891 106.0070 106.0328 106.0576 106.0940 106.1271 106.1575 106.1882 106.2522 106.2827 106.2829 106.3104 106.3297 106.3745 106.3892 106.4215 106.4505 106.4838 106.5158 106.5522 106.5792 106.6224 106.6549 106.6695 106.7052 106.7339 106.7545 106.7786 106.7962 106.8436 106.8622 106.8654 106.8805 106.9164 106.9568 106.9874 107.0281 107.0505 107.0829 107.1012 107.1068 107.1254 107.1460 107.1659 107.1955 107.2268 107.2449 107.2554 107.2640 107.3243 107.3306 107.3543 107.3897 107.4108 107.4377 107.4892 107.5035 107.5263 107.5686 107.5985 107.6631 107.6740 107.7081 107.7609 107.7839 107.7937 107.8309 107.8433 107.8765 107.9308 107.9487 107.9593 108.0025 108.0319 108.0622 108.0910 108.1261 108.1691 108.1994 108.2454 108.2563 108.2696 108.3164 108.3414 108.3656 108.3859 108.4061 108.4378 108.4697 108.5002 108.5060 108.5303 108.5660 108.6190 108.6903 108.7062 108.7455 108.7641 108.7806 108.8054 108.8826 108.9118 108.9572 108.9964 109.0097 109.0518 109.1009 109.1386 109.2249 109.2483 109.2586 109.2877 109.3056 109.3713 109.4099 109.4399 109.4505 109.4548 109.4891 109.5348 109.5600 109.5957 109.6320 109.6609 109.6801 109.7510 109.7566 109.7786 109.8189 109.8641 109.9619 109.9804 109.9998 110.0227 110.0418 110.0587 110.0946 110.1504 110.1806 110.2007 110.2421 110.3027 110.3209 110.3660 110.3914 110.4209 110.4783 110.5248 110.5638 110.5785 110.6155 110.6546 110.6652 110.6949 110.7677 110.8394 110.8419 110.8743 110.8928 110.9149 110.9382 111.0402 111.0915 111.1797 111.1957 111.2188 111.2541 111.2687 111.2982 111.3213 111.3546 111.3906 111.4211 111.4387 111.4758 111.4912 111.5112 111.5554 111.5902 111.6173 111.6683 111.6924 111.7253 111.7507 111.8170 111.8546 111.8914 111.9379 111.9672 112.0016 112.0669 112.1126 112.2015 112.2146 112.2485 112.2595 112.2983 112.3647 112.3843 112.4264 112.4638 112.6069 112.6268 112.6967 112.7372 112.7705 112.7765 112.8181 112.8451 112.8838 112.9142 112.9731 113.0636 113.1108 113.1616 113.1915 113.2244 113.2702 113.3112 113.3435 113.3761 113.4012 113.4284 113.4572 113.5005 113.5310 113.5977 113.6266 113.6683 113.7369 113.7690 113.7898 113.8124 113.8799 113.8996 113.9563 113.9704 114.0378 114.1341 114.1453 114.1644 114.1794 114.1939 114.2703 114.2889 114.3401 114.3578 114.4279 114.4539 114.4697 114.4996 114.5129 114.5315 114.5626 114.5892 114.6063 114.6379 114.6776 114.6888 114.7069 114.7404 114.8057 114.8354 114.8546 114.8823 114.8950 114.9136 114.9479 114.9826 115.0236 115.0409 115.0512 115.1102 115.1382 115.1589 115.1761 115.2174 115.2713 115.2822 115.3461 115.3724 115.4313 115.4659 115.4676 115.4755 115.5069 115.5281 115.5614 115.5964 115.6277 115.6571 115.6763 115.7170 115.7787 115.7985 115.8214 115.8389 115.8509 115.8655 115.8811 115.9145 115.9466 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91 102 92 103 92 104 93 95 93 96 94 105 94 106 94 107 95 108 95 109 95 110 96 111 96 112 96 113 97 114 98 115 98 116 98 117 99 118 99 119 99 120 121 124 121 133 122 133 122 134 122 135 123 124 123 128 123 129 123 130 124 125 124 129 125 126 125 133 126 127 126 129 126 136 127 128 127 137 127 138 128 139 128 140 129 131 129 132 130 141 130 142 130 143 131 144 131 145 131 146 132 147 132 148 132 149 133 150 134 151 134 152 134 153 135 154 135 155 135 156 157 160 158 169 158 170 158 171 159 160 159 161 159 164 159 165 159 166 160 161 161 162 161 169 162 163 162 165 162 172 163 164 163 173 163 174 164 175 164 176 165 167 165 168 166 177 166 178 166 179 167 180 167 181 167 182 168 183 168 184 168 185 169 186 170 187 170 188 170 189 171 190 171 191 171 192 193 196 194 205 194 206 194 207 195 196 195 197 195 200 195 201 195 202 196 197 196 201 197 198 197 205 198 199 198 201 198 208 199 200 199 209 199 210 200 211 200 212 201 203 201 204 202 213 202 214 202 215 203 216 203 217 203 218 204 219 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