Current test charges: C1 0.000 C2 0.000 O2 0.000 HO2 -0.450 Iteration: 0 O2 QME: -6.069 MME: -2.694 (3.375) QMD: 2.978 MMDistDelta: 0.250 H11 QME: -1.696 MME: -0.812 (0.884) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -3.053 (-1.865) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -2.212 (-1.412) QMD: 2.751 MMDistDelta: 0.000 H21 QME: -1.204 MME: -1.172 (0.032) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -2.123 (-1.266) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 9.305 (15.250) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {4.578 2.369 -1.332} (5.324 D) Ratio: 2.96 Current objective value: 8558.103557 ( En: 6295.038027 Dist: 24.500000 Dipole: 2238.565530 ) Current test charges: C1 0.000 C2 -0.000 O2 0.000 HO2 -0.450 Iteration: 1 O2 QME: -6.069 MME: -2.692 (3.377) QMD: 2.978 MMDistDelta: 0.250 H11 QME: -1.696 MME: -0.813 (0.884) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -3.053 (-1.865) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -2.212 (-1.413) QMD: 2.751 MMDistDelta: 0.000 H21 QME: -1.204 MME: -1.170 (0.034) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -2.122 (-1.265) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 9.305 (15.250) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {4.578 2.367 -1.333} (5.323 D) Ratio: 2.96 Current objective value: 8558.065708 ( En: 6295.607587 Dist: 24.500000 Dipole: 2237.958122 ) Current test charges: C1 -0.231 C2 -0.083 O2 -0.624 HO2 0.489 Iteration: 2 O2 QME: -6.069 MME: -5.501 (0.568) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.693 (0.003) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.928 (0.260) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.327 (0.472) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.910 (0.294) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.173 (1.030) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -8.349 (-2.404) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.345 -0.786 1.875} (2.438 D) Ratio: 1.36 Current objective value: 211.982057 ( En: 188.482057 Dist: 23.500000 Dipole: 0.000000 ) Current test charges: C1 -0.047 C2 -0.017 O2 -0.125 HO2 -0.262 Iteration: 3 O2 QME: -6.069 MME: -3.178 (2.891) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -0.986 (0.710) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -2.613 (-1.425) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.817 (-1.017) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -1.118 (0.086) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -1.642 (-0.784) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: 6.206 (12.150) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.928 1.738 -0.691} (4.350 D) Ratio: 2.42 Current objective value: 5139.217909 ( En: 4004.613665 Dist: 23.250000 Dipole: 1111.354245 ) Current test charges: C1 0.363 C2 -0.869 O2 -0.656 HO2 0.712 Iteration: 4 O2 QME: -6.069 MME: -7.869 (-1.800) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -4.255 (-2.559) QMD: 2.737 MMDistDelta: -0.050 H12 QME: -1.188 MME: -2.475 (-1.287) QMD: 2.778 MMDistDelta: -0.050 H13 QME: -0.799 MME: -2.186 (-1.387) QMD: 2.751 MMDistDelta: 0.000 H21 QME: -1.204 MME: 1.387 (2.591) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.833 (3.691) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -13.973 (-8.028) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.949 -4.499 2.332} (6.424 D) Ratio: 3.57 Current objective value: 5562.798515 ( En: 2453.653447 Dist: 34.750000 Dipole: 3074.395068 ) Current test charges: C1 0.027 C2 -0.191 O2 -0.256 HO2 -0.030 Iteration: 5 O2 QME: -6.069 MME: -4.144 (1.925) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.662 (0.034) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.500 (-1.312) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.813 (-1.014) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.529 (0.675) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.548 (0.310) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.489 (8.434) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.808 0.365 0.040} (3.826 D) Ratio: 2.13 Current objective value: 2402.511149 ( En: 1953.648520 Dist: 29.000000 Dipole: 419.862628 ) Current test charges: C1 0.027 C2 -0.191 O2 -0.256 HO2 -0.030 Iteration: 6 O2 QME: -6.069 MME: -4.144 (1.925) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.662 (0.034) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.499 (-1.312) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.812 (-1.013) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.529 (0.675) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.547 (0.311) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.484 (8.429) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.807 0.363 0.041} (3.824 D) Ratio: 2.13 Current objective value: 2399.226516 ( En: 1951.415482 Dist: 29.000000 Dipole: 418.811033 ) Current test charges: C1 0.026 C2 -0.190 O2 -0.256 HO2 -0.030 Iteration: 7 O2 QME: -6.069 MME: -4.143 (1.926) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.660 (0.036) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.499 (-1.311) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.811 (-1.012) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.531 (0.673) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.550 (0.308) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.488 (8.433) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.805 0.367 0.041} (3.823 D) Ratio: 2.13 Current objective value: 2400.591873 ( En: 1952.931581 Dist: 29.000000 Dipole: 418.660292 ) Current test charges: C1 0.026 C2 -0.190 O2 -0.256 HO2 -0.030 Iteration: 8 O2 QME: -6.069 MME: -4.146 (1.923) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.662 (0.035) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.500 (-1.312) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.812 (-1.013) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.531 (0.673) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.549 (0.308) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.490 (8.435) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.808 0.367 0.041} (3.826 D) Ratio: 2.13 Current objective value: 2402.454247 ( En: 1953.490379 Dist: 29.000000 Dipole: 419.963868 ) Current test charges: C1 0.027 C2 -0.190 O2 -0.256 HO2 -0.031 Iteration: 9 O2 QME: -6.069 MME: -4.143 (1.926) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.661 (0.036) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.501 (-1.313) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.813 (-1.014) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.530 (0.674) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.550 (0.307) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.498 (8.443) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.810 0.368 0.039} (3.828 D) Ratio: 2.13 Current objective value: 2407.689240 ( En: 1957.442375 Dist: 29.000000 Dipole: 421.246865 ) Current test charges: C1 0.027 C2 -0.190 O2 -0.256 HO2 -0.031 Iteration: 10 O2 QME: -6.069 MME: -4.149 (1.920) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.662 (0.034) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.504 (-1.316) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.815 (-1.015) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.531 (0.673) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.551 (0.306) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.502 (8.447) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.814 0.369 0.039} (3.832 D) Ratio: 2.13 Current objective value: 2411.106190 ( En: 1958.695900 Dist: 29.000000 Dipole: 423.410291 ) Current test charges: C1 0.027 C2 -0.190 O2 -0.256 HO2 -0.031 Iteration: 11 O2 QME: -6.069 MME: -4.146 (1.923) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.662 (0.035) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.503 (-1.315) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.814 (-1.015) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.530 (0.674) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.550 (0.307) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.501 (8.446) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.812 0.368 0.039} (3.830 D) Ratio: 2.13 Current objective value: 2410.043801 ( En: 1958.469785 Dist: 29.000000 Dipole: 422.574016 ) Current test charges: C1 0.026 C2 -0.190 O2 -0.256 HO2 -0.031 Iteration: 12 O2 QME: -6.069 MME: -4.140 (1.929) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.660 (0.037) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.499 (-1.311) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.811 (-1.012) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.531 (0.673) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: -0.550 (0.308) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 2.492 (8.436) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.805 0.367 0.040} (3.823 D) Ratio: 2.13 Current objective value: 2402.452845 ( En: 1954.660067 Dist: 29.000000 Dipole: 418.792779 ) Current test charges: C1 -0.396 C2 -0.392 O2 -0.495 HO2 0.833 Iteration: 13 O2 QME: -6.069 MME: -2.428 (3.641) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.479 (0.217) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: 0.911 (2.099) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.745 (1.545) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -0.040 (1.164) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.586 (2.444) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -22.522 (-16.577) QMD: 2.031 MMDistDelta: -0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-2.327 -3.047 2.805} (4.750 D) Ratio: 2.64 Current objective value: 9876.722454 ( En: 7555.711150 Dist: 80.500000 Dipole: 2240.511304 ) Current test charges: C1 -0.327 C2 0.259 O2 -0.415 HO2 0.034 Iteration: 14 O2 QME: -6.069 MME: -4.121 (1.948) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.612 (1.085) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.456 (-0.268) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.547 (0.253) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.129 (-0.925) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.947 (-1.089) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 1.439 (7.384) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.145 1.916 0.461} (2.913 D) Ratio: 1.62 Current objective value: 1926.131900 ( En: 1541.895743 Dist: 26.250000 Dipole: 357.986157 ) Current test charges: C1 -0.045 C2 -0.130 O2 -0.359 HO2 0.084 Iteration: 15 O2 QME: -6.069 MME: -4.587 (1.482) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.628 (0.069) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -2.148 (-0.960) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.435 (-0.635) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.733 (0.471) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.498 (0.360) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 0.661 (6.606) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.294 0.257 0.467} (3.337 D) Ratio: 1.86 Current objective value: 1348.226400 ( En: 1188.082670 Dist: 26.750000 Dipole: 133.393730 ) Current test charges: C1 0.404 C2 0.131 O2 -0.301 HO2 -0.683 Iteration: 16 O2 QME: -6.069 MME: -8.205 (-2.136) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.396 (-0.699) QMD: 2.737 MMDistDelta: -0.050 H12 QME: -1.188 MME: -6.517 (-5.329) QMD: 2.778 MMDistDelta: -0.150 H13 QME: -0.799 MME: -4.659 (-3.860) QMD: 2.751 MMDistDelta: -0.100 H21 QME: -1.204 MME: -1.534 (-0.330) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -2.944 (-2.086) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: 16.001 (21.946) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {10.067 3.619 -1.898} (10.865 D) Ratio: 6.05 Current objective value: 28337.922124 ( En: 13361.045831 Dist: 20.000000 Dipole: 14956.876293 ) Current test charges: C1 0.008 C2 -0.128 O2 -0.397 HO2 0.067 Iteration: 17 O2 QME: -6.069 MME: -5.281 (0.788) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.841 (-0.144) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.529 (-1.342) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.707 (-0.908) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -0.727 (0.477) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.520 (0.338) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: 1.283 (7.227) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.938 0.322 0.428} (3.974 D) Ratio: 2.21 Current objective value: 1839.783132 ( En: 1396.066662 Dist: 26.000000 Dipole: 417.716470 ) Current test charges: C1 -0.107 C2 -0.437 O2 -1.128 HO2 1.222 Iteration: 18 O2 QME: -6.069 MME: -9.932 (-3.863) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -3.499 (-1.803) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -0.449 (0.739) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.005 (0.795) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: 0.135 (1.339) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.606 (3.463) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -31.928 (-25.984) QMD: 2.031 MMDistDelta: -0.300 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.797 -4.363 4.291} (6.171 D) Ratio: 3.43 Current objective value: 20551.901406 ( En: 17707.012529 Dist: 50.000000 Dipole: 2794.888877 ) Current test charges: C1 -0.077 C2 -0.314 O2 -0.743 HO2 0.683 Iteration: 19 O2 QME: -6.069 MME: -6.984 (-0.915) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -2.597 (-0.901) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.182 (0.006) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.651 (0.149) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.184 (1.020) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.208 (2.066) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -13.584 (-7.639) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.869 -2.262 2.463} (3.831 D) Ratio: 2.13 Current objective value: 1951.616026 ( En: 1633.237031 Dist: 38.500000 Dipole: 279.878995 ) Current test charges: C1 -0.782 C2 0.948 O2 -0.315 HO2 -0.301 Iteration: 20 O2 QME: -6.069 MME: -2.136 (3.933) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: 1.268 (2.965) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: -0.721 (0.467) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.463 (1.262) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -4.918 (-3.714) QMD: 2.796 MMDistDelta: -0.150 H22 QME: -0.857 MME: -5.461 (-4.603) QMD: 2.752 MMDistDelta: -0.100 HO2 QME: -5.945 MME: 6.663 (12.607) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.658 5.595 -0.411} (5.648 D) Ratio: 3.14 Current objective value: 9523.447101 ( En: 5499.952422 Dist: 67.500000 Dipole: 3955.994680 ) Current test charges: C1 -0.296 C2 0.178 O2 -0.460 HO2 0.128 Iteration: 21 O2 QME: -6.069 MME: -4.458 (1.611) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.873 (0.824) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.387 (-0.199) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.540 (0.259) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.823 (-0.620) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -1.441 (-0.583) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -0.117 (5.828) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.053 1.316 0.751} (2.552 D) Ratio: 1.42 Current objective value: 1083.832953 ( En: 951.716590 Dist: 27.250000 Dipole: 104.866362 ) Current test charges: C1 -0.311 C2 0.452 O2 -0.072 HO2 -0.519 Iteration: 22 O2 QME: -6.069 MME: -2.307 (3.762) QMD: 2.978 MMDistDelta: 0.250 H11 QME: -1.696 MME: 0.307 (2.003) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -2.330 (-1.142) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.223 (-0.424) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -2.881 (-1.677) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -3.987 (-3.130) QMD: 2.752 MMDistDelta: -0.050 HO2 QME: -5.945 MME: 10.480 (16.424) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.446 4.332 -1.370} (5.702 D) Ratio: 3.17 Current objective value: 10815.223475 ( En: 7550.462598 Dist: 30.250000 Dipole: 3234.510877 ) Current test charges: C1 -0.195 C2 0.073 O2 -0.404 HO2 0.075 Iteration: 23 O2 QME: -6.069 MME: -4.447 (1.622) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.114 (0.583) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.759 (-0.571) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.938 (-0.139) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -1.440 (-0.236) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -1.190 (-0.333) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: 0.801 (6.746) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.666 1.071 0.526} (2.921 D) Ratio: 1.63 Current objective value: 1353.684324 ( En: 1224.623356 Dist: 21.750000 Dipole: 107.310968 ) Current test charges: C1 0.076 C2 -0.378 O2 -0.492 HO2 0.344 Iteration: 24 O2 QME: -6.069 MME: -5.804 (0.265) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.528 (-0.832) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.131 (-0.944) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.568 (-0.769) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: 0.022 (1.226) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.738 (1.596) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -4.151 (1.794) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.328 -1.489 1.262} (3.858 D) Ratio: 2.15 Current objective value: 564.350308 ( En: 237.795448 Dist: 33.750000 Dipole: 292.804859 ) Current test charges: C1 0.076 C2 -0.378 O2 -0.492 HO2 0.344 Iteration: 25 O2 QME: -6.069 MME: -5.804 (0.265) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.528 (-0.832) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -2.131 (-0.944) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.568 (-0.769) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: 0.022 (1.226) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.738 (1.596) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -4.151 (1.794) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.328 -1.489 1.262} (3.858 D) Ratio: 2.15 Current objective value: 564.350308 ( En: 237.795448 Dist: 33.750000 Dipole: 292.804859 ) Current test charges: C1 -0.329 C2 0.009 O2 -0.559 HO2 0.429 Iteration: 26 O2 QME: -6.069 MME: -4.522 (1.547) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.226 (0.470) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.608 (0.580) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.047 (0.752) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.239 (-0.036) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.250 (0.608) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.198 (-1.253) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.717 -0.249 1.689} (1.851 D) Ratio: 1.03 Current objective value: 181.925518 ( En: 136.486051 Dist: 25.250000 Dipole: 20.189467 ) Current test charges: C1 -0.329 C2 0.009 O2 -0.559 HO2 0.429 Iteration: 27 O2 QME: -6.069 MME: -4.522 (1.547) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.226 (0.470) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.608 (0.580) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.047 (0.752) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.239 (-0.036) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.250 (0.608) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.198 (-1.253) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.717 -0.249 1.689} (1.851 D) Ratio: 1.03 Current objective value: 181.925518 ( En: 136.486051 Dist: 25.250000 Dipole: 20.189467 ) Current test charges: C1 -0.126 C2 -0.281 O2 -0.623 HO2 0.580 Iteration: 28 O2 QME: -6.069 MME: -5.674 (0.395) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.184 (-0.487) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.994 (0.194) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.541 (0.258) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.284 (0.920) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.897 (1.755) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -11.090 (-5.145) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.473 -1.830 2.097} (3.149 D) Ratio: 1.75 Current objective value: 847.717230 ( En: 772.402774 Dist: 30.500000 Dipole: 44.814456 ) Current test charges: C1 -0.126 C2 -0.281 O2 -0.623 HO2 0.580 Iteration: 29 O2 QME: -6.069 MME: -5.674 (0.395) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.184 (-0.487) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.994 (0.194) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.541 (0.258) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.284 (0.920) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.897 (1.755) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -11.090 (-5.145) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.473 -1.830 2.097} (3.149 D) Ratio: 1.75 Current objective value: 847.717230 ( En: 772.402774 Dist: 30.500000 Dipole: 44.814456 ) Current test charges: C1 -0.358 C2 -0.087 O2 -0.802 HO2 0.797 Iteration: 30 O2 QME: -6.069 MME: -6.041 (0.028) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.789 (-0.093) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.061 (1.127) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.391 (1.190) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -0.916 (0.288) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.761 (1.618) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -18.220 (-12.276) QMD: 2.031 MMDistDelta: -0.200 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.181 -1.732 2.923} (3.402 D) Ratio: 1.89 Current objective value: 4283.894951 ( En: 3902.125819 Dist: 54.500000 Dipole: 327.269132 ) Current test charges: C1 -0.358 C2 -0.087 O2 -0.802 HO2 0.797 Iteration: 31 O2 QME: -6.069 MME: -6.041 (0.028) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.789 (-0.093) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.061 (1.127) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.391 (1.190) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -0.916 (0.288) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.761 (1.618) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -18.220 (-12.276) QMD: 2.031 MMDistDelta: -0.200 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.181 -1.732 2.923} (3.402 D) Ratio: 1.89 Current objective value: 4283.894951 ( En: 3902.125819 Dist: 54.500000 Dipole: 327.269132 ) Current test charges: C1 -0.270 C2 -0.099 O2 -0.677 HO2 0.595 Iteration: 32 O2 QME: -6.069 MME: -5.607 (0.462) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.737 (-0.040) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.611 (0.577) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.077 (0.722) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -0.865 (0.339) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.415 (1.273) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -11.600 (-5.655) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.801 -1.170 2.229} (2.642 D) Ratio: 1.47 Current objective value: 901.898018 ( En: 869.582470 Dist: 32.000000 Dipole: 0.315548 ) Current test charges: C1 -0.020 C2 -0.614 O2 -0.771 HO2 0.954 Iteration: 33 O2 QME: -6.069 MME: -6.728 (-0.659) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -3.175 (-1.479) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -0.590 (0.598) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.434 (0.365) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.627 (1.830) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.537 (3.395) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -23.630 (-17.685) QMD: 2.031 MMDistDelta: -0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.856 -4.251 3.233} (5.409 D) Ratio: 3.01 Current objective value: 10148.972011 ( En: 8268.680629 Dist: 43.000000 Dipole: 1837.291382 ) Current test charges: C1 -0.020 C2 -0.614 O2 -0.771 HO2 0.954 Iteration: 34 O2 QME: -6.069 MME: -6.728 (-0.659) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -3.175 (-1.479) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -0.590 (0.598) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.434 (0.365) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.627 (1.830) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.537 (3.395) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -23.630 (-17.685) QMD: 2.031 MMDistDelta: -0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.856 -4.251 3.233} (5.409 D) Ratio: 3.01 Current objective value: 10148.972011 ( En: 8268.680629 Dist: 43.000000 Dipole: 1837.291382 ) Current test charges: C1 -0.098 C2 -0.390 O2 -0.683 HO2 0.721 Iteration: 35 O2 QME: -6.069 MME: -6.065 (0.003) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.517 (-0.821) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.814 (0.374) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.464 (0.335) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.016 (1.220) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.469 (2.327) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -15.517 (-9.572) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.194 -2.678 2.532} (3.874 D) Ratio: 2.16 Current objective value: 2891.658488 ( En: 2486.083697 Dist: 40.000000 Dipole: 365.574791 ) Current test charges: C1 -0.137 C2 -0.278 O2 -0.639 HO2 0.604 Iteration: 36 O2 QME: -6.069 MME: -5.742 (0.327) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.190 (-0.493) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.926 (0.262) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.479 (0.320) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.294 (0.910) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.935 (1.793) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -11.808 (-5.863) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.364 -1.891 2.181} (3.193 D) Ratio: 1.78 Current objective value: 1061.806625 ( En: 973.541886 Dist: 31.750000 Dipole: 56.514738 ) Current test charges: C1 -0.156 C2 -0.222 O2 -0.617 HO2 0.546 Iteration: 37 O2 QME: -6.069 MME: -5.580 (0.489) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.026 (-0.330) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.983 (0.205) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.486 (0.313) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.461 (0.743) QMD: 2.796 MMDistDelta: 0.250 H22 QME: -0.857 MME: 0.668 (1.525) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.058 (-4.113) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.448 -1.498 2.006} (2.892 D) Ratio: 1.61 Current objective value: 543.278452 ( En: 507.175604 Dist: 27.750000 Dipole: 8.352848 ) Current test charges: C1 -0.002 C2 -0.311 O2 -0.461 HO2 0.324 Iteration: 38 O2 QME: -6.069 MME: -5.180 (0.889) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -2.179 (-0.483) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.811 (-0.623) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.275 (-0.476) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.175 (1.029) QMD: 2.796 MMDistDelta: 0.350 H22 QME: -0.857 MME: 0.499 (1.356) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -4.013 (1.932) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.781 -1.172 1.210} (3.251 D) Ratio: 1.81 Current objective value: 305.397471 ( En: 206.739207 Dist: 31.750000 Dipole: 66.908264 ) Current test charges: C1 -0.002 C2 -0.311 O2 -0.461 HO2 0.324 Iteration: 39 O2 QME: -6.069 MME: -5.180 (0.889) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -2.179 (-0.483) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.811 (-0.623) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.275 (-0.476) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.175 (1.029) QMD: 2.796 MMDistDelta: 0.350 H22 QME: -0.857 MME: 0.499 (1.356) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -4.013 (1.932) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.781 -1.172 1.210} (3.251 D) Ratio: 1.81 Current objective value: 305.397471 ( En: 206.739207 Dist: 31.750000 Dipole: 66.908264 ) Current test charges: C1 -0.131 C2 -0.088 O2 -0.458 HO2 0.227 Iteration: 40 O2 QME: -6.069 MME: -4.864 (1.205) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.579 (0.118) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.650 (-0.462) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.964 (-0.164) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.882 (0.322) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.339 (0.519) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -1.858 (4.087) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.510 -0.010 0.973} (2.692 D) Ratio: 1.50 Current objective value: 487.549330 ( En: 469.549330 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.131 C2 -0.088 O2 -0.458 HO2 0.227 Iteration: 41 O2 QME: -6.069 MME: -4.864 (1.205) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.579 (0.118) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.650 (-0.462) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.964 (-0.164) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.882 (0.322) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.339 (0.519) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -1.858 (4.087) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.510 -0.010 0.973} (2.692 D) Ratio: 1.50 Current objective value: 487.549330 ( En: 469.549330 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.490 C2 0.172 O2 -0.611 HO2 0.480 Iteration: 42 O2 QME: -6.069 MME: -4.237 (1.832) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.804 (0.893) QMD: 2.737 MMDistDelta: 0.300 H12 QME: -1.188 MME: -0.097 (1.091) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.472 (1.272) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.831 (-0.627) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.683 (0.175) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -8.871 (-2.927) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.278 0.226 1.925} (1.958 D) Ratio: 1.09 Current objective value: 727.151712 ( En: 398.730768 Dist: 44.750000 Dipole: 283.670944 ) Current test charges: C1 -0.490 C2 0.172 O2 -0.611 HO2 0.480 Iteration: 43 O2 QME: -6.069 MME: -4.237 (1.832) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.804 (0.893) QMD: 2.737 MMDistDelta: 0.300 H12 QME: -1.188 MME: -0.097 (1.091) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.472 (1.272) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.831 (-0.627) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.683 (0.175) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -8.871 (-2.927) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.278 0.226 1.925} (1.958 D) Ratio: 1.09 Current objective value: 727.151712 ( En: 398.730768 Dist: 44.750000 Dipole: 283.670944 ) Current test charges: C1 -0.330 C2 0.016 O2 -0.578 HO2 0.441 Iteration: 44 O2 QME: -6.069 MME: -4.677 (1.392) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.252 (0.444) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.616 (0.572) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.038 (0.761) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.262 (-0.059) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.243 (0.615) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.455 (-1.511) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.741 -0.259 1.738} (1.907 D) Ratio: 1.06 Current objective value: 181.663475 ( En: 142.644573 Dist: 25.500000 Dipole: 13.518903 ) Current test charges: C1 -0.268 C2 0.079 O2 -0.431 HO2 0.169 Iteration: 45 O2 QME: -6.069 MME: -4.153 (1.916) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.000 (0.696) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.550 (0.249) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.474 (-0.270) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -1.023 (-0.165) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -1.010 (4.934) QMD: 2.031 MMDistDelta: 0.350 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.841 0.808 0.835} (2.177 D) Ratio: 1.21 Current objective value: 751.667994 ( En: 716.850766 Dist: 23.000000 Dipole: 11.817228 ) Current test charges: C1 -0.268 C2 0.079 O2 -0.431 HO2 0.169 Iteration: 46 O2 QME: -6.069 MME: -4.153 (1.916) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.000 (0.696) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.550 (0.249) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.474 (-0.270) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -1.023 (-0.165) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -1.010 (4.934) QMD: 2.031 MMDistDelta: 0.350 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.841 0.808 0.835} (2.177 D) Ratio: 1.21 Current objective value: 751.667994 ( En: 716.850766 Dist: 23.000000 Dipole: 11.817228 ) Current test charges: C1 -0.236 C2 -0.006 O2 -0.483 HO2 0.275 Iteration: 47 O2 QME: -6.069 MME: -4.547 (1.521) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.289 (0.407) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.191 (-0.003) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.532 (0.267) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.173 (0.031) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.509 (0.348) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -3.124 (2.821) QMD: 2.031 MMDistDelta: 0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.730 0.157 1.166} (2.092 D) Ratio: 1.16 Current objective value: 282.225779 ( En: 265.822977 Dist: 15.500000 Dipole: 0.902802 ) Current test charges: C1 -0.348 C2 -0.058 O2 -0.650 HO2 0.607 Iteration: 48 O2 QME: -6.069 MME: -4.915 (1.154) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.459 (0.237) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.252 (0.936) QMD: 2.778 MMDistDelta: 0.300 H13 QME: -0.799 MME: 0.203 (1.002) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.014 (0.190) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.304 (1.162) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -12.441 (-6.496) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.101 -1.049 2.267} (2.500 D) Ratio: 1.39 Current objective value: 1317.871640 ( En: 1171.312073 Dist: 49.750000 Dipole: 96.809566 ) Current test charges: C1 -0.348 C2 -0.058 O2 -0.650 HO2 0.607 Iteration: 49 O2 QME: -6.069 MME: -4.915 (1.154) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.459 (0.237) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.252 (0.936) QMD: 2.778 MMDistDelta: 0.300 H13 QME: -0.799 MME: 0.203 (1.002) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.014 (0.190) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.304 (1.162) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -12.441 (-6.496) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.101 -1.049 2.267} (2.500 D) Ratio: 1.39 Current objective value: 1317.871640 ( En: 1171.312073 Dist: 49.750000 Dipole: 96.809566 ) Current test charges: C1 -0.287 C2 -0.067 O2 -0.596 HO2 0.499 Iteration: 50 O2 QME: -6.069 MME: -4.893 (1.176) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.487 (0.210) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.628 (0.560) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.104 (0.696) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -0.977 (0.227) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.128 (0.985) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -9.051 (-3.106) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.782 -0.755 1.901} (2.190 D) Ratio: 1.22 Current objective value: 349.825565 ( En: 322.325565 Dist: 27.500000 Dipole: 0.000000 ) Current test charges: C1 -0.256 C2 -0.071 O2 -0.568 HO2 0.445 Iteration: 51 O2 QME: -6.069 MME: -4.884 (1.185) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.504 (0.193) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.822 (0.366) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.265 (0.535) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.958 (0.246) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.038 (0.895) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -7.455 (-1.510) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.122 -0.608 1.718} (2.141 D) Ratio: 1.19 Current objective value: 146.183503 ( En: 125.128264 Dist: 21.000000 Dipole: 0.055239 ) Current test charges: C1 -0.633 C2 0.342 O2 -0.694 HO2 0.535 Iteration: 52 O2 QME: -6.069 MME: -4.365 (1.704) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -0.502 (1.195) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: 0.260 (1.448) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.915 (1.714) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -2.470 (-1.267) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.146 (-0.288) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -10.488 (-4.543) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-1.015 0.720 2.193} (2.521 D) Ratio: 1.40 Current objective value: 1705.723331 ( En: 792.172856 Dist: 50.250000 Dipole: 863.300475 ) Current test charges: C1 -0.633 C2 0.342 O2 -0.694 HO2 0.535 Iteration: 53 O2 QME: -6.069 MME: -4.365 (1.704) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -0.502 (1.195) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: 0.260 (1.448) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.915 (1.714) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -2.470 (-1.267) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.146 (-0.288) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -10.488 (-4.543) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-1.015 0.720 2.193} (2.521 D) Ratio: 1.40 Current objective value: 1705.723331 ( En: 792.172856 Dist: 50.250000 Dipole: 863.300475 ) Current test charges: C1 -0.455 C2 0.158 O2 -0.628 HO2 0.476 Iteration: 54 O2 QME: -6.069 MME: -4.590 (1.479) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -0.922 (0.775) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -0.255 (0.933) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.352 (1.152) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.773 (-0.569) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.633 (0.224) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -8.516 (-2.571) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.058 0.185 1.915} (1.925 D) Ratio: 1.07 Current objective value: 439.986879 ( En: 299.204659 Dist: 37.500000 Dipole: 103.282220 ) Current test charges: C1 -0.366 C2 0.065 O2 -0.595 HO2 0.446 Iteration: 55 O2 QME: -6.069 MME: -4.703 (1.366) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.152 (0.545) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.534 (0.654) QMD: 2.778 MMDistDelta: 0.250 H13 QME: -0.799 MME: 0.068 (0.867) QMD: 2.751 MMDistDelta: 0.350 H21 QME: -1.204 MME: -1.434 (-0.230) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.389 (0.468) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -7.565 (-1.620) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.595 -0.082 1.776} (1.875 D) Ratio: 1.04 Current objective value: 201.178435 ( En: 155.974004 Dist: 28.000000 Dipole: 17.204432 ) Current test charges: C1 -0.389 C2 -0.021 O2 -0.717 HO2 0.677 Iteration: 56 O2 QME: -6.069 MME: -5.290 (0.779) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.466 (0.231) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.098 (1.089) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.373 (1.173) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.140 (0.064) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: 0.339 (1.197) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -14.549 (-8.604) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.170 -1.117 2.530} (2.771 D) Ratio: 1.54 Current objective value: 2205.231841 ( En: 1967.192476 Dist: 51.750000 Dipole: 186.289365 ) Current test charges: C1 -0.389 C2 -0.021 O2 -0.717 HO2 0.677 Iteration: 57 O2 QME: -6.069 MME: -5.290 (0.779) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.466 (0.231) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.098 (1.089) QMD: 2.778 MMDistDelta: 0.350 H13 QME: -0.799 MME: 0.373 (1.173) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.140 (0.064) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: 0.339 (1.197) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -14.549 (-8.604) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.170 -1.117 2.530} (2.771 D) Ratio: 1.54 Current objective value: 2205.231841 ( En: 1967.192476 Dist: 51.750000 Dipole: 186.289365 ) Current test charges: C1 -0.346 C2 -0.017 O2 -0.651 HO2 0.564 Iteration: 58 O2 QME: -6.069 MME: -5.071 (0.998) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.414 (0.282) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.392 (0.796) QMD: 2.778 MMDistDelta: 0.250 H13 QME: -0.799 MME: 0.134 (0.933) QMD: 2.751 MMDistDelta: 0.350 H21 QME: -1.204 MME: -1.149 (0.055) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: 0.109 (0.966) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -10.947 (-5.002) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.367 -0.757 2.145} (2.304 D) Ratio: 1.28 Current objective value: 764.027329 ( En: 713.326119 Dist: 33.750000 Dipole: 16.951210 ) Current test charges: C1 -0.324 C2 -0.015 O2 -0.618 HO2 0.507 Iteration: 59 O2 QME: -6.069 MME: -4.962 (1.107) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.389 (0.308) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.544 (0.644) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.009 (0.808) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.154 (0.050) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.010 (0.848) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -9.227 (-3.282) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.636 -0.577 1.952} (2.132 D) Ratio: 1.19 Current objective value: 374.606643 ( En: 346.979029 Dist: 27.500000 Dipole: 0.127615 ) Current test charges: C1 -0.313 C2 -0.014 O2 -0.602 HO2 0.478 Iteration: 60 O2 QME: -6.069 MME: -4.907 (1.162) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.376 (0.321) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.622 (0.566) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.055 (0.745) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.156 (0.048) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.069 (0.788) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -8.415 (-2.471) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.770 -0.487 1.856} (2.067 D) Ratio: 1.15 Current objective value: 255.605312 ( En: 226.367938 Dist: 27.500000 Dipole: 1.737374 ) Current test charges: C1 -0.308 C2 -0.013 O2 -0.593 HO2 0.464 Iteration: 61 O2 QME: -6.069 MME: -4.880 (1.189) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.369 (0.327) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.661 (0.527) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.087 (0.713) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.157 (0.046) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.100 (0.758) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -8.010 (-2.065) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.837 -0.442 1.807} (2.040 D) Ratio: 1.14 Current objective value: 203.611753 ( En: 178.673435 Dist: 22.000000 Dipole: 2.938318 ) Current test charges: C1 -0.430 C2 0.112 O2 -0.520 HO2 0.388 Iteration: 62 O2 QME: -6.069 MME: -3.775 (2.294) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.809 (0.888) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -0.303 (0.885) QMD: 2.778 MMDistDelta: 0.300 H13 QME: -0.799 MME: 0.231 (1.031) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.614 (-0.410) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.686 (0.172) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.528 (-0.583) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.097 0.268 1.577} (1.603 D) Ratio: 0.89 Current objective value: 397.014382 ( En: 210.852902 Dist: 34.750000 Dipole: 151.411480 ) Current test charges: C1 -0.430 C2 0.112 O2 -0.520 HO2 0.388 Iteration: 63 O2 QME: -6.069 MME: -3.775 (2.294) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.809 (0.888) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -0.303 (0.885) QMD: 2.778 MMDistDelta: 0.300 H13 QME: -0.799 MME: 0.231 (1.031) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -1.614 (-0.410) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.686 (0.172) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.528 (-0.583) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.097 0.268 1.577} (1.603 D) Ratio: 0.89 Current objective value: 397.014382 ( En: 210.852902 Dist: 34.750000 Dipole: 151.411480 ) Current test charges: C1 -0.374 C2 0.057 O2 -0.549 HO2 0.417 Iteration: 64 O2 QME: -6.069 MME: -4.253 (1.816) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.051 (0.646) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -0.472 (0.716) QMD: 2.778 MMDistDelta: 0.250 H13 QME: -0.799 MME: 0.084 (0.883) QMD: 2.751 MMDistDelta: 0.350 H21 QME: -1.204 MME: -1.409 (-0.205) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.433 (0.425) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -7.022 (-1.077) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.450 -0.030 1.662} (1.722 D) Ratio: 0.96 Current objective value: 231.480062 ( En: 159.714754 Dist: 30.750000 Dipole: 41.015309 ) Current test charges: C1 -0.346 C2 0.029 O2 -0.564 HO2 0.431 Iteration: 65 O2 QME: -6.069 MME: -4.493 (1.576) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.175 (0.521) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.558 (0.630) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.006 (0.806) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.309 (-0.105) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.308 (0.550) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -7.272 (-1.327) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.626 -0.179 1.704} (1.824 D) Ratio: 1.01 Current objective value: 194.200583 ( En: 146.945445 Dist: 23.250000 Dipole: 24.005138 ) Current test charges: C1 -0.348 C2 0.040 O2 -0.547 HO2 0.405 Iteration: 66 O2 QME: -6.069 MME: -4.370 (1.699) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.120 (0.576) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.583 (0.605) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.012 (0.788) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.347 (-0.143) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.399 (0.458) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.620 (-0.675) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.660 -0.059 1.618} (1.748 D) Ratio: 0.97 Current objective value: 181.440564 ( En: 122.311801 Dist: 23.000000 Dipole: 36.128763 ) Current test charges: C1 -0.348 C2 0.040 O2 -0.547 HO2 0.405 Iteration: 67 O2 QME: -6.069 MME: -4.370 (1.699) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.120 (0.576) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.583 (0.605) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.012 (0.788) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.347 (-0.143) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.399 (0.458) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.620 (-0.675) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.660 -0.059 1.618} (1.748 D) Ratio: 0.97 Current objective value: 181.440564 ( En: 122.311801 Dist: 23.000000 Dipole: 36.128763 ) Current test charges: C1 -0.265 C2 -0.074 O2 -0.521 HO2 0.410 Iteration: 68 O2 QME: -6.069 MME: -4.441 (1.628) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.390 (0.306) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.772 (0.416) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.255 (0.545) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -0.951 (0.253) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.033 (0.825) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.740 (-0.795) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.006 -0.517 1.585} (1.947 D) Ratio: 1.08 Current objective value: 147.257526 ( En: 114.754101 Dist: 23.000000 Dipole: 9.503424 ) Current test charges: C1 -0.265 C2 -0.074 O2 -0.521 HO2 0.410 Iteration: 69 O2 QME: -6.069 MME: -4.441 (1.628) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.390 (0.306) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.772 (0.416) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.255 (0.545) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -0.951 (0.253) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.033 (0.825) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.740 (-0.795) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.006 -0.517 1.585} (1.947 D) Ratio: 1.08 Current objective value: 147.257526 ( En: 114.754101 Dist: 23.000000 Dipole: 9.503424 ) Current test charges: C1 -0.253 C2 -0.074 O2 -0.542 HO2 0.420 Iteration: 70 O2 QME: -6.069 MME: -4.690 (1.379) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.461 (0.236) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.840 (0.348) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.294 (0.505) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.948 (0.256) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.006 (0.851) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.852 (-0.907) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.140 -0.546 1.625} (2.059 D) Ratio: 1.15 Current objective value: 121.481659 ( En: 98.648882 Dist: 20.750000 Dipole: 2.082777 ) Current test charges: C1 -0.253 C2 -0.074 O2 -0.542 HO2 0.420 Iteration: 71 O2 QME: -6.069 MME: -4.690 (1.379) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.461 (0.236) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.840 (0.348) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.294 (0.505) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.948 (0.256) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.006 (0.851) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.852 (-0.907) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.140 -0.546 1.625} (2.059 D) Ratio: 1.15 Current objective value: 121.481659 ( En: 98.648882 Dist: 20.750000 Dipole: 2.082777 ) Current test charges: C1 -0.241 C2 -0.087 O2 -0.541 HO2 0.418 Iteration: 72 O2 QME: -6.069 MME: -4.730 (1.339) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.501 (0.195) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.883 (0.305) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.338 (0.461) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.904 (0.300) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.030 (0.888) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.785 (-0.840) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.216 -0.590 1.615} (2.107 D) Ratio: 1.17 Current objective value: 114.337684 ( En: 93.044300 Dist: 20.750000 Dipole: 0.543384 ) Current test charges: C1 -0.241 C2 -0.087 O2 -0.541 HO2 0.418 Iteration: 73 O2 QME: -6.069 MME: -4.730 (1.339) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.501 (0.195) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.883 (0.305) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.338 (0.461) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.904 (0.300) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.030 (0.888) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.785 (-0.840) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.216 -0.590 1.615} (2.107 D) Ratio: 1.17 Current objective value: 114.337684 ( En: 93.044300 Dist: 20.750000 Dipole: 0.543384 ) Current test charges: C1 -0.198 C2 -0.144 O2 -0.500 HO2 0.392 Iteration: 74 O2 QME: -6.069 MME: -4.553 (1.516) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.584 (0.112) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.997 (0.190) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.492 (0.308) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.714 (0.490) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.140 (0.998) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.169 (-0.224) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.403 -0.731 1.495} (2.177 D) Ratio: 1.21 Current objective value: 122.655226 ( En: 93.155226 Dist: 29.500000 Dipole: 0.000000 ) Current test charges: C1 -0.198 C2 -0.144 O2 -0.500 HO2 0.392 Iteration: 75 O2 QME: -6.069 MME: -4.553 (1.516) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.584 (0.112) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.997 (0.190) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.492 (0.308) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.714 (0.490) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.140 (0.998) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.169 (-0.224) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.403 -0.731 1.495} (2.177 D) Ratio: 1.21 Current objective value: 122.655226 ( En: 93.155226 Dist: 29.500000 Dipole: 0.000000 ) Current test charges: C1 -0.106 C2 -0.259 O2 -0.519 HO2 0.433 Iteration: 76 O2 QME: -6.069 MME: -5.037 (1.032) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.985 (-0.288) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.244 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.766 (0.034) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.345 (0.859) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.549 (1.406) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -7.027 (-1.083) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.849 -1.300 1.595} (2.767 D) Ratio: 1.54 Current objective value: 157.356708 ( En: 126.022703 Dist: 30.250000 Dipole: 1.084005 ) Current test charges: C1 -0.106 C2 -0.259 O2 -0.519 HO2 0.433 Iteration: 77 O2 QME: -6.069 MME: -5.037 (1.032) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.985 (-0.288) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.244 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.766 (0.034) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.345 (0.859) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.549 (1.406) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -7.027 (-1.083) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.849 -1.300 1.595} (2.767 D) Ratio: 1.54 Current objective value: 157.356708 ( En: 126.022703 Dist: 30.250000 Dipole: 1.084005 ) Current test charges: C1 -0.174 C2 -0.174 O2 -0.527 HO2 0.425 Iteration: 78 O2 QME: -6.069 MME: -4.848 (1.221) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.732 (-0.036) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.050 (0.138) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.544 (0.256) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.613 (0.591) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.294 (1.152) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.912 (-0.967) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.513 -0.949 1.602} (2.399 D) Ratio: 1.33 Current objective value: 131.177623 ( En: 104.677623 Dist: 26.500000 Dipole: 0.000000 ) Current test charges: C1 -0.172 C2 -0.157 O2 -0.554 HO2 0.433 Iteration: 79 O2 QME: -6.069 MME: -5.134 (0.935) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.773 (-0.076) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.111 (0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.561 (0.238) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.667 (0.537) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.267 (1.125) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.951 (-1.006) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.634 -0.904 1.645} (2.488 D) Ratio: 1.38 Current objective value: 112.204040 ( En: 87.704040 Dist: 24.500000 Dipole: 0.000000 ) Current test charges: C1 -0.172 C2 -0.157 O2 -0.554 HO2 0.433 Iteration: 80 O2 QME: -6.069 MME: -5.134 (0.935) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.773 (-0.076) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.111 (0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.561 (0.238) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.667 (0.537) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.267 (1.125) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.951 (-1.006) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.634 -0.904 1.645} (2.488 D) Ratio: 1.38 Current objective value: 112.204040 ( En: 87.704040 Dist: 24.500000 Dipole: 0.000000 ) Current test charges: C1 -0.145 C2 -0.201 O2 -0.487 HO2 0.382 Iteration: 81 O2 QME: -6.069 MME: -4.670 (1.399) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.750 (-0.054) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.180 (0.008) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.685 (0.115) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.527 (0.677) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.283 (1.141) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.815 (0.129) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.718 -0.920 1.438} (2.422 D) Ratio: 1.35 Current objective value: 119.021164 ( En: 93.771164 Dist: 25.250000 Dipole: 0.000000 ) Current test charges: C1 -0.145 C2 -0.201 O2 -0.487 HO2 0.382 Iteration: 82 O2 QME: -6.069 MME: -4.670 (1.399) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.750 (-0.054) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.180 (0.008) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.685 (0.115) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.527 (0.677) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.283 (1.141) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.815 (0.129) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.718 -0.920 1.438} (2.422 D) Ratio: 1.35 Current objective value: 119.021164 ( En: 93.771164 Dist: 25.250000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 -0.078 O2 -0.522 HO2 0.388 Iteration: 83 O2 QME: -6.069 MME: -4.633 (1.435) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.458 (0.238) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.937 (0.251) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.381 (0.418) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.933 (0.271) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.058 (0.800) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.997 (-0.052) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.303 -0.464 1.515} (2.052 D) Ratio: 1.14 Current objective value: 99.915423 ( En: 76.772486 Dist: 20.750000 Dipole: 2.392937 ) Current test charges: C1 -0.238 C2 -0.078 O2 -0.522 HO2 0.388 Iteration: 84 O2 QME: -6.069 MME: -4.633 (1.435) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.458 (0.238) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.937 (0.251) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.381 (0.418) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.933 (0.271) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.058 (0.800) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.997 (-0.052) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.303 -0.464 1.515} (2.052 D) Ratio: 1.14 Current objective value: 99.915423 ( En: 76.772486 Dist: 20.750000 Dipole: 2.392937 ) Current test charges: C1 -0.225 C2 -0.088 O2 -0.567 HO2 0.429 Iteration: 85 O2 QME: -6.069 MME: -5.058 (1.011) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.594 (0.103) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.977 (0.211) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.397 (0.403) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.897 (0.307) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.062 (0.919) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.885 (-0.940) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.401 -0.625 1.662} (2.262 D) Ratio: 1.26 Current objective value: 99.798339 ( En: 76.548339 Dist: 23.250000 Dipole: 0.000000 ) Current test charges: C1 -0.225 C2 -0.088 O2 -0.567 HO2 0.429 Iteration: 86 O2 QME: -6.069 MME: -5.058 (1.011) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.594 (0.103) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.977 (0.211) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.397 (0.403) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.897 (0.307) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.062 (0.919) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.885 (-0.940) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.401 -0.625 1.662} (2.262 D) Ratio: 1.26 Current objective value: 99.798339 ( En: 76.548339 Dist: 23.250000 Dipole: 0.000000 ) Current test charges: C1 -0.140 C2 -0.184 O2 -0.524 HO2 0.397 Iteration: 87 O2 QME: -6.069 MME: -5.043 (1.026) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.819 (-0.123) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.707 (0.092) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.576 (0.628) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.276 (1.133) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.012 (-0.067) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.864 -0.902 1.510} (2.563 D) Ratio: 1.43 Current objective value: 94.369596 ( En: 69.119596 Dist: 25.250000 Dipole: 0.000000 ) Current test charges: C1 -0.140 C2 -0.184 O2 -0.524 HO2 0.397 Iteration: 88 O2 QME: -6.069 MME: -5.043 (1.026) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.819 (-0.123) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.707 (0.092) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.576 (0.628) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.276 (1.133) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.012 (-0.067) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.864 -0.902 1.510} (2.563 D) Ratio: 1.43 Current objective value: 94.369596 ( En: 69.119596 Dist: 25.250000 Dipole: 0.000000 ) Current test charges: C1 -0.279 C2 -0.012 O2 -0.613 HO2 0.454 Iteration: 89 O2 QME: -6.069 MME: -5.265 (0.804) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.472 (0.224) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.842 (0.346) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.211 (0.589) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.154 (0.050) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.111 (0.746) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.468 (-1.524) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.180 -0.407 1.785} (2.178 D) Ratio: 1.21 Current objective value: 119.600368 ( En: 101.100368 Dist: 18.500000 Dipole: 0.000000 ) Current test charges: C1 -0.279 C2 -0.012 O2 -0.613 HO2 0.454 Iteration: 90 O2 QME: -6.069 MME: -5.265 (0.804) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.472 (0.224) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.842 (0.346) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.211 (0.589) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.154 (0.050) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.111 (0.746) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.468 (-1.524) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.180 -0.407 1.785} (2.178 D) Ratio: 1.21 Current objective value: 119.600368 ( En: 101.100368 Dist: 18.500000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 -0.065 O2 -0.577 HO2 0.434 Iteration: 91 O2 QME: -6.069 MME: -5.088 (0.981) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.550 (0.146) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.936 (0.252) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.342 (0.457) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.972 (0.232) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.005 (0.863) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.988 (-1.043) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.332 -0.552 1.687} (2.219 D) Ratio: 1.23 Current objective value: 98.555908 ( En: 78.555908 Dist: 20.000000 Dipole: 0.000000 ) Current test charges: C1 -0.154 C2 -0.150 O2 -0.560 HO2 0.414 Iteration: 92 O2 QME: -6.069 MME: -5.336 (0.733) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.819 (-0.122) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.661 (0.139) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.684 (0.520) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.218 (1.076) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.282 (-0.337) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.885 -0.818 1.588} (2.597 D) Ratio: 1.45 Current objective value: 77.427335 ( En: 52.927335 Dist: 24.500000 Dipole: 0.000000 ) Current test charges: C1 -0.154 C2 -0.150 O2 -0.560 HO2 0.414 Iteration: 93 O2 QME: -6.069 MME: -5.336 (0.733) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.819 (-0.122) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.661 (0.139) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.684 (0.520) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.218 (1.076) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.282 (-0.337) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.885 -0.818 1.588} (2.597 D) Ratio: 1.45 Current objective value: 77.427335 ( En: 52.927335 Dist: 24.500000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 -0.056 O2 -0.544 HO2 0.386 Iteration: 94 O2 QME: -6.069 MME: -4.891 (1.178) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.483 (0.213) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.016 (0.171) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.412 (0.387) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.002 (0.202) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.121 (0.737) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.759 (0.186) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.457 -0.371 1.524} (2.141 D) Ratio: 1.19 Current objective value: 76.564190 ( En: 55.760972 Dist: 20.750000 Dipole: 0.053217 ) Current test charges: C1 -0.235 C2 -0.056 O2 -0.544 HO2 0.386 Iteration: 95 O2 QME: -6.069 MME: -4.891 (1.178) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.483 (0.213) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.016 (0.171) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.412 (0.387) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.002 (0.202) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.121 (0.737) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.759 (0.186) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.457 -0.371 1.524} (2.141 D) Ratio: 1.19 Current objective value: 76.564190 ( En: 55.760972 Dist: 20.750000 Dipole: 0.053217 ) Current test charges: C1 -0.148 C2 -0.149 O2 -0.596 HO2 0.443 Iteration: 96 O2 QME: -6.069 MME: -5.689 (0.380) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.908 (-0.211) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.283 (-0.095) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.664 (0.136) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.686 (0.518) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.277 (1.134) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.890 (-0.945) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.958 -0.900 1.697} (2.743 D) Ratio: 1.53 Current objective value: 91.566634 ( En: 66.587622 Dist: 24.500000 Dipole: 0.479013 ) Current test charges: C1 -0.148 C2 -0.149 O2 -0.596 HO2 0.443 Iteration: 97 O2 QME: -6.069 MME: -5.689 (0.380) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.908 (-0.211) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.283 (-0.095) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.664 (0.136) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.686 (0.518) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.277 (1.134) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.890 (-0.945) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.958 -0.900 1.697} (2.743 D) Ratio: 1.53 Current objective value: 91.566634 ( En: 66.587622 Dist: 24.500000 Dipole: 0.479013 ) Current test charges: C1 -0.130 C2 -0.164 O2 -0.551 HO2 0.396 Iteration: 98 O2 QME: -6.069 MME: -5.400 (0.669) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.876 (-0.179) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.371 (-0.183) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.767 (0.032) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.635 (0.569) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.226 (1.084) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.738 (0.207) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.086 -0.818 1.523} (2.709 D) Ratio: 1.51 Current objective value: 75.933108 ( En: 51.393633 Dist: 24.500000 Dipole: 0.039475 ) Current test charges: C1 -0.130 C2 -0.164 O2 -0.551 HO2 0.396 Iteration: 99 O2 QME: -6.069 MME: -5.400 (0.669) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.876 (-0.179) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.371 (-0.183) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.767 (0.032) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.635 (0.569) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.226 (1.084) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.738 (0.207) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.086 -0.818 1.523} (2.709 D) Ratio: 1.51 Current objective value: 75.933108 ( En: 51.393633 Dist: 24.500000 Dipole: 0.039475 ) Current test charges: C1 -0.058 C2 -0.238 O2 -0.526 HO2 0.373 Iteration: 100 O2 QME: -6.069 MME: -5.504 (0.565) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.088 (-0.391) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.636 (-0.448) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.046 (-0.247) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.395 (0.809) QMD: 2.796 MMDistDelta: 0.250 H22 QME: -0.857 MME: 0.393 (1.251) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.058 (0.887) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.523 -1.035 1.414} (3.072 D) Ratio: 1.71 Current objective value: 149.125791 ( En: 93.456272 Dist: 25.000000 Dipole: 30.669518 ) Current test charges: C1 -0.058 C2 -0.238 O2 -0.526 HO2 0.373 Iteration: 101 O2 QME: -6.069 MME: -5.504 (0.565) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.088 (-0.391) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.636 (-0.448) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.046 (-0.247) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.395 (0.809) QMD: 2.796 MMDistDelta: 0.250 H22 QME: -0.857 MME: 0.393 (1.251) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.058 (0.887) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.523 -1.035 1.414} (3.072 D) Ratio: 1.71 Current objective value: 149.125791 ( En: 93.456272 Dist: 25.000000 Dipole: 30.669518 ) Current test charges: C1 -0.110 C2 -0.189 O2 -0.541 HO2 0.390 Iteration: 102 O2 QME: -6.069 MME: -5.387 (0.682) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.934 (-0.237) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.432 (-0.244) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.840 (-0.041) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.552 (0.651) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.286 (1.143) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.583 (0.362) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.187 -0.898 1.491} (2.795 D) Ratio: 1.56 Current objective value: 86.522648 ( En: 61.140777 Dist: 23.250000 Dipole: 2.131871 ) Current test charges: C1 -0.176 C2 -0.087 O2 -0.604 HO2 0.416 Iteration: 103 O2 QME: -6.069 MME: -5.735 (0.334) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.780 (-0.084) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.294 (-0.106) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.617 (0.183) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.889 (0.315) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.052 (0.909) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.100 (-0.155) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.980 -0.577 1.637} (2.633 D) Ratio: 1.46 Current objective value: 46.822411 ( En: 27.822411 Dist: 19.000000 Dipole: 0.000000 ) Current test charges: C1 -0.176 C2 -0.087 O2 -0.604 HO2 0.416 Iteration: 104 O2 QME: -6.069 MME: -5.735 (0.334) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.780 (-0.084) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.294 (-0.106) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.617 (0.183) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.889 (0.315) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.052 (0.909) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.100 (-0.155) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.980 -0.577 1.637} (2.633 D) Ratio: 1.46 Current objective value: 46.822411 ( En: 27.822411 Dist: 19.000000 Dipole: 0.000000 ) Current test charges: C1 -0.177 C2 -0.104 O2 -0.513 HO2 0.345 Iteration: 105 O2 QME: -6.069 MME: -4.918 (1.151) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.607 (0.090) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.260 (-0.072) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.652 (0.148) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.836 (0.368) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.055 (0.802) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -4.652 (1.293) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.869 -0.432 1.364} (2.354 D) Ratio: 1.31 Current objective value: 113.269904 ( En: 95.269904 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.177 C2 -0.104 O2 -0.513 HO2 0.345 Iteration: 106 O2 QME: -6.069 MME: -4.918 (1.151) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.607 (0.090) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.260 (-0.072) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.652 (0.148) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.836 (0.368) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.055 (0.802) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -4.652 (1.293) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.869 -0.432 1.364} (2.354 D) Ratio: 1.31 Current objective value: 113.269904 ( En: 95.269904 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.169 C2 -0.117 O2 -0.536 HO2 0.372 Iteration: 107 O2 QME: -6.069 MME: -5.127 (0.942) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.692 (0.005) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.266 (-0.079) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.655 (0.144) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.793 (0.411) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.041 (0.899) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -5.261 (0.683) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.894 -0.564 1.458} (2.456 D) Ratio: 1.37 Current objective value: 78.204287 ( En: 58.954287 Dist: 19.250000 Dipole: 0.000000 ) Current test charges: C1 -0.255 C2 -0.018 O2 -0.583 HO2 0.406 Iteration: 108 O2 QME: -6.069 MME: -5.179 (0.890) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.471 (0.226) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.994 (0.194) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.344 (0.456) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.132 (0.072) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.193 (0.665) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.140 (-0.195) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.436 -0.281 1.617} (2.181 D) Ratio: 1.21 Current objective value: 55.321233 ( En: 39.321233 Dist: 16.000000 Dipole: 0.000000 ) Current test charges: C1 -0.255 C2 -0.018 O2 -0.583 HO2 0.406 Iteration: 109 O2 QME: -6.069 MME: -5.179 (0.890) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.471 (0.226) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.994 (0.194) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.344 (0.456) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.132 (0.072) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.193 (0.665) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.140 (-0.195) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.436 -0.281 1.617} (2.181 D) Ratio: 1.21 Current objective value: 55.321233 ( En: 39.321233 Dist: 16.000000 Dipole: 0.000000 ) Current test charges: C1 -0.217 C2 -0.067 O2 -0.610 HO2 0.444 Iteration: 110 O2 QME: -6.069 MME: -5.541 (0.528) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.674 (0.023) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.078 (0.110) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.434 (0.365) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.962 (0.242) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.040 (0.897) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.991 (-1.047) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.606 -0.584 1.733} (2.434 D) Ratio: 1.35 Current objective value: 79.581007 ( En: 59.581007 Dist: 20.000000 Dipole: 0.000000 ) Current test charges: C1 -0.217 C2 -0.067 O2 -0.610 HO2 0.444 Iteration: 111 O2 QME: -6.069 MME: -5.541 (0.528) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.674 (0.023) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.078 (0.110) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.434 (0.365) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.962 (0.242) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.040 (0.897) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.991 (-1.047) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.606 -0.584 1.733} (2.434 D) Ratio: 1.35 Current objective value: 79.581007 ( En: 59.581007 Dist: 20.000000 Dipole: 0.000000 ) Current test charges: C1 -0.204 C2 -0.081 O2 -0.589 HO2 0.424 Iteration: 112 O2 QME: -6.069 MME: -5.424 (0.645) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.679 (0.018) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.131 (0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.495 (0.304) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.914 (0.290) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.040 (0.898) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.498 (-0.553) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.688 -0.579 1.655} (2.434 D) Ratio: 1.35 Current objective value: 59.685985 ( En: 42.685985 Dist: 17.000000 Dipole: 0.000000 ) Current test charges: C1 -0.260 C2 0.009 O2 -0.594 HO2 0.395 Iteration: 113 O2 QME: -6.069 MME: -5.310 (0.759) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.448 (0.248) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.042 (0.146) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.354 (0.446) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.221 (-0.017) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.293 (0.564) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.741 (0.204) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.527 -0.145 1.595} (2.213 D) Ratio: 1.23 Current objective value: 46.444949 ( En: 30.444949 Dist: 16.000000 Dipole: 0.000000 ) Current test charges: C1 -0.260 C2 0.009 O2 -0.594 HO2 0.395 Iteration: 114 O2 QME: -6.069 MME: -5.310 (0.759) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.448 (0.248) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.042 (0.146) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.354 (0.446) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.221 (-0.017) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.293 (0.564) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.741 (0.204) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.527 -0.145 1.595} (2.213 D) Ratio: 1.23 Current objective value: 46.444949 ( En: 30.444949 Dist: 16.000000 Dipole: 0.000000 ) Current test charges: C1 -0.166 C2 -0.084 O2 -0.636 HO2 0.435 Iteration: 115 O2 QME: -6.069 MME: -6.091 (-0.022) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.869 (-0.172) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.362 (-0.174) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.649 (0.150) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.896 (0.308) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.087 (0.945) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.412 (-0.468) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.116 -0.621 1.711} (2.791 D) Ratio: 1.55 Current objective value: 53.210683 ( En: 32.237378 Dist: 19.000000 Dipole: 1.973305 ) Current test charges: C1 -0.166 C2 -0.084 O2 -0.636 HO2 0.435 Iteration: 116 O2 QME: -6.069 MME: -6.091 (-0.022) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.869 (-0.172) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.362 (-0.174) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.649 (0.150) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.896 (0.308) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.087 (0.945) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.412 (-0.468) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.116 -0.621 1.711} (2.791 D) Ratio: 1.55 Current objective value: 53.210683 ( En: 32.237378 Dist: 19.000000 Dipole: 1.973305 ) Current test charges: C1 -0.318 C2 0.094 O2 -0.666 HO2 0.441 Iteration: 117 O2 QME: -6.069 MME: -5.740 (0.329) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.360 (0.336) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.902 (0.286) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.144 (0.656) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.519 (-0.316) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.464 (0.394) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.751 (-0.806) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.312 0.050 1.800} (2.227 D) Ratio: 1.24 Current objective value: 57.932108 ( En: 40.932108 Dist: 17.000000 Dipole: 0.000000 ) Current test charges: C1 -0.318 C2 0.094 O2 -0.666 HO2 0.441 Iteration: 118 O2 QME: -6.069 MME: -5.740 (0.329) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.360 (0.336) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.902 (0.286) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.144 (0.656) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.519 (-0.316) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.464 (0.394) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.751 (-0.806) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.312 0.050 1.800} (2.227 D) Ratio: 1.24 Current objective value: 57.932108 ( En: 40.932108 Dist: 17.000000 Dipole: 0.000000 ) Current test charges: C1 -0.276 C2 0.066 O2 -0.652 HO2 0.412 Iteration: 119 O2 QME: -6.069 MME: -5.854 (0.215) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.462 (0.235) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.097 (0.091) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.319 (0.480) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.414 (-0.211) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.428 (0.430) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.880 (0.065) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.657 0.028 1.694} (2.369 D) Ratio: 1.32 Current objective value: 28.092039 ( En: 14.342039 Dist: 13.750000 Dipole: 0.000000 ) Current test charges: C1 -0.276 C2 0.066 O2 -0.652 HO2 0.412 Iteration: 120 O2 QME: -6.069 MME: -5.854 (0.215) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.462 (0.235) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.097 (0.091) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.319 (0.480) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.414 (-0.211) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.428 (0.430) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.880 (0.065) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.657 0.028 1.694} (2.369 D) Ratio: 1.32 Current objective value: 28.092039 ( En: 14.342039 Dist: 13.750000 Dipole: 0.000000 ) Current test charges: C1 -0.107 C2 -0.174 O2 -0.546 HO2 0.377 Iteration: 121 O2 QME: -6.069 MME: -5.496 (0.573) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.932 (-0.235) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.499 (-0.311) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.877 (-0.077) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.599 (0.605) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.222 (1.080) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.171 (0.774) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.304 -0.799 1.457} (2.841 D) Ratio: 1.58 Current objective value: 92.762194 ( En: 65.428501 Dist: 22.750000 Dipole: 4.583693 ) Current test charges: C1 -0.107 C2 -0.174 O2 -0.546 HO2 0.377 Iteration: 122 O2 QME: -6.069 MME: -5.496 (0.573) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.932 (-0.235) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.499 (-0.311) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.877 (-0.077) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -0.599 (0.605) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.222 (1.080) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -5.171 (0.774) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.304 -0.799 1.457} (2.841 D) Ratio: 1.58 Current objective value: 92.762194 ( En: 65.428501 Dist: 22.750000 Dipole: 4.583693 ) Current test charges: C1 -0.167 C2 -0.099 O2 -0.580 HO2 0.395 Iteration: 123 O2 QME: -6.069 MME: -5.565 (0.504) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.766 (-0.070) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.327 (-0.139) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.664 (0.135) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.850 (0.354) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.041 (0.899) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -5.602 (0.343) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.024 -0.559 1.554} (2.612 D) Ratio: 1.45 Current objective value: 52.691294 ( En: 33.691294 Dist: 19.000000 Dipole: 0.000000 ) Current test charges: C1 -0.149 C2 -0.067 O2 -0.652 HO2 0.417 Iteration: 124 O2 QME: -6.069 MME: -6.402 (-0.333) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.921 (-0.225) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.527 (-0.339) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.753 (0.046) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.947 (0.257) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.009 (0.867) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.697 (0.248) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.413 -0.497 1.665} (2.973 D) Ratio: 1.65 Current objective value: 61.381664 ( En: 28.948371 Dist: 15.750000 Dipole: 16.683293 ) Current test charges: C1 -0.149 C2 -0.067 O2 -0.652 HO2 0.417 Iteration: 125 O2 QME: -6.069 MME: -6.402 (-0.333) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.921 (-0.225) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.527 (-0.339) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.753 (0.046) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.947 (0.257) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.009 (0.867) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.697 (0.248) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.413 -0.497 1.665} (2.973 D) Ratio: 1.65 Current objective value: 61.381664 ( En: 28.948371 Dist: 15.750000 Dipole: 16.683293 ) Current test charges: C1 -0.179 C2 -0.053 O2 -0.632 HO2 0.414 Iteration: 126 O2 QME: -6.069 MME: -6.057 (0.012) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.791 (-0.095) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.375 (-0.187) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.636 (0.164) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.999 (0.205) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.047 (0.811) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -5.822 (0.123) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.137 -0.436 1.652} (2.736 D) Ratio: 1.52 Current objective value: 35.723404 ( En: 19.631066 Dist: 15.750000 Dipole: 0.342339 ) Current test charges: C1 -0.271 C2 0.033 O2 -0.581 HO2 0.369 Iteration: 127 O2 QME: -6.069 MME: -5.201 (0.868) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.367 (0.330) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.053 (0.135) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.348 (0.452) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.308 (-0.104) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.429 (0.429) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.096 (0.849) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.539 0.031 1.515} (2.160 D) Ratio: 1.20 Current objective value: 64.005655 ( En: 50.005655 Dist: 14.000000 Dipole: 0.000000 ) Current test charges: C1 -0.271 C2 0.033 O2 -0.581 HO2 0.369 Iteration: 128 O2 QME: -6.069 MME: -5.201 (0.868) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.367 (0.330) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.053 (0.135) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.348 (0.452) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.308 (-0.104) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.429 (0.429) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.096 (0.849) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.539 0.031 1.515} (2.160 D) Ratio: 1.20 Current objective value: 64.005655 ( En: 50.005655 Dist: 14.000000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.000 O2 -0.597 HO2 0.387 Iteration: 129 O2 QME: -6.069 MME: -5.453 (0.616) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.507 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.138 (0.050) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.431 (0.368) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.190 (0.014) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.278 (0.579) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.452 (0.493) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.702 -0.154 1.571} (2.321 D) Ratio: 1.29 Current objective value: 43.313566 ( En: 28.313566 Dist: 15.000000 Dipole: 0.000000 ) Current test charges: C1 -0.304 C2 0.098 O2 -0.663 HO2 0.418 Iteration: 130 O2 QME: -6.069 MME: -5.834 (0.235) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.380 (0.316) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.014 (0.174) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.224 (0.576) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.532 (-0.328) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.522 (0.336) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.054 (-0.109) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.510 0.137 1.728} (2.299 D) Ratio: 1.28 Current objective value: 31.751182 ( En: 18.751182 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.304 C2 0.098 O2 -0.663 HO2 0.418 Iteration: 131 O2 QME: -6.069 MME: -5.834 (0.235) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.380 (0.316) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.014 (0.174) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.224 (0.576) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.532 (-0.328) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.522 (0.336) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.054 (-0.109) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.510 0.137 1.728} (2.299 D) Ratio: 1.28 Current objective value: 31.751182 ( En: 18.751182 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.350 C2 0.168 O2 -0.658 HO2 0.390 Iteration: 132 O2 QME: -6.069 MME: -5.658 (0.411) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.182 (0.514) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.929 (0.259) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.109 (0.690) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.786 (-0.583) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.815 (0.042) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.388 (0.557) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.351 0.489 1.662} (2.197 D) Ratio: 1.22 Current objective value: 56.225139 ( En: 40.725139 Dist: 15.500000 Dipole: 0.000000 ) Current test charges: C1 -0.350 C2 0.168 O2 -0.658 HO2 0.390 Iteration: 133 O2 QME: -6.069 MME: -5.658 (0.411) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.182 (0.514) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.929 (0.259) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.109 (0.690) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.786 (-0.583) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.815 (0.042) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.388 (0.557) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.351 0.489 1.662} (2.197 D) Ratio: 1.22 Current objective value: 56.225139 ( En: 40.725139 Dist: 15.500000 Dipole: 0.000000 ) Current test charges: C1 -0.301 C2 0.096 O2 -0.643 HO2 0.398 Iteration: 134 O2 QME: -6.069 MME: -5.680 (0.389) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.348 (0.349) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.030 (0.158) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.248 (0.551) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.525 (-0.321) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.559 (0.299) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.587 (0.358) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.529 0.187 1.655} (2.261 D) Ratio: 1.26 Current objective value: 36.055924 ( En: 23.055924 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.260 C2 0.084 O2 -0.694 HO2 0.420 Iteration: 135 O2 QME: -6.069 MME: -6.383 (-0.314) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.560 (0.136) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.244 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.392 (0.407) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.473 (-0.269) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.457 (0.400) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.781 (0.164) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.940 0.079 1.744} (2.610 D) Ratio: 1.45 Current objective value: 25.151788 ( En: 13.651788 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.260 C2 0.084 O2 -0.694 HO2 0.420 Iteration: 136 O2 QME: -6.069 MME: -6.383 (-0.314) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.560 (0.136) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.244 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.392 (0.407) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.473 (-0.269) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.457 (0.400) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.781 (0.164) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.940 0.079 1.744} (2.610 D) Ratio: 1.45 Current objective value: 25.151788 ( En: 13.651788 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.294 C2 0.134 O2 -0.735 HO2 0.445 Iteration: 137 O2 QME: -6.069 MME: -6.645 (-0.576) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.508 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.166 (0.022) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.273 (0.526) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.650 (-0.447) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.561 (0.297) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.312 (-0.367) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.823 0.197 1.855} (2.608 D) Ratio: 1.45 Current objective value: 37.684493 ( En: 26.684493 Dist: 11.000000 Dipole: 0.000000 ) Current test charges: C1 -0.294 C2 0.134 O2 -0.735 HO2 0.445 Iteration: 138 O2 QME: -6.069 MME: -6.645 (-0.576) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.508 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.166 (0.022) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.273 (0.526) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.650 (-0.447) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.561 (0.297) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.312 (-0.367) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.823 0.197 1.855} (2.608 D) Ratio: 1.45 Current objective value: 37.684493 ( En: 26.684493 Dist: 11.000000 Dipole: 0.000000 ) Current test charges: C1 -0.279 C2 0.096 O2 -0.696 HO2 0.428 Iteration: 139 O2 QME: -6.069 MME: -6.292 (-0.223) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.508 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.158 (0.030) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.318 (0.481) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.517 (-0.313) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.480 (0.377) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.069 (-0.124) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.789 0.098 1.775} (2.522 D) Ratio: 1.40 Current objective value: 27.094883 ( En: 14.344883 Dist: 12.750000 Dipole: 0.000000 ) Current test charges: C1 -0.205 C2 0.009 O2 -0.699 HO2 0.445 Iteration: 140 O2 QME: -6.069 MME: -6.619 (-0.550) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.791 (-0.095) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.372 (-0.184) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.547 (0.252) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.208 (-0.004) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.162 (0.695) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.355 (-0.410) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.167 -0.287 1.800} (2.832 D) Ratio: 1.58 Current objective value: 42.062245 ( En: 26.528079 Dist: 11.500000 Dipole: 4.034166 ) Current test charges: C1 -0.205 C2 0.009 O2 -0.699 HO2 0.445 Iteration: 141 O2 QME: -6.069 MME: -6.619 (-0.550) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.791 (-0.095) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.372 (-0.184) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.547 (0.252) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.208 (-0.004) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.162 (0.695) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.355 (-0.410) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.167 -0.287 1.800} (2.832 D) Ratio: 1.58 Current objective value: 42.062245 ( En: 26.528079 Dist: 11.500000 Dipole: 4.034166 ) Current test charges: C1 -0.232 C2 0.034 O2 -0.683 HO2 0.432 Iteration: 142 O2 QME: -6.069 MME: -6.346 (-0.277) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.664 (0.032) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.460 (0.339) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.297 (-0.093) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.272 (0.586) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.138 (-0.193) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.987 -0.153 1.759} (2.658 D) Ratio: 1.48 Current objective value: 27.729576 ( En: 14.729576 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.389 C2 0.243 O2 -0.736 HO2 0.433 Iteration: 143 O2 QME: -6.069 MME: -6.263 (-0.194) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.166 (0.531) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.884 (0.304) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.022 (0.821) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -2.055 (-0.851) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -0.963 (-0.106) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -6.195 (-0.250) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.309 0.654 1.854} (2.362 D) Ratio: 1.31 Current objective value: 65.090282 ( En: 47.090282 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.389 C2 0.243 O2 -0.736 HO2 0.433 Iteration: 144 O2 QME: -6.069 MME: -6.263 (-0.194) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.166 (0.531) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.884 (0.304) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.022 (0.821) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -2.055 (-0.851) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -0.963 (-0.106) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -6.195 (-0.250) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.309 0.654 1.854} (2.362 D) Ratio: 1.31 Current objective value: 65.090282 ( En: 47.090282 Dist: 18.000000 Dipole: 0.000000 ) Current test charges: C1 -0.330 C2 0.159 O2 -0.707 HO2 0.427 Iteration: 145 O2 QME: -6.069 MME: -6.197 (-0.128) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.337 (0.359) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.019 (0.169) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.158 (0.642) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.749 (-0.545) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.694 (0.164) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.090 (-0.145) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.543 0.346 1.797} (2.393 D) Ratio: 1.33 Current objective value: 36.507211 ( En: 23.257211 Dist: 13.250000 Dipole: 0.000000 ) Current test charges: C1 -0.300 C2 0.117 O2 -0.692 HO2 0.425 Iteration: 146 O2 QME: -6.069 MME: -6.169 (-0.100) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.426 (0.270) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.088 (0.100) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.249 (0.550) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.597 (-0.393) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.560 (0.297) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.037 (-0.092) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.660 0.192 1.768} (2.433 D) Ratio: 1.35 Current objective value: 29.178143 ( En: 16.178143 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.225 C2 0.055 O2 -0.711 HO2 0.431 Iteration: 147 O2 QME: -6.069 MME: -6.713 (-0.644) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.711 (-0.015) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.383 (-0.195) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.512 (0.288) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.365 (-0.162) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.332 (0.525) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.886 (0.059) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.191 -0.065 1.774} (2.820 D) Ratio: 1.57 Current objective value: 34.906619 ( En: 21.042665 Dist: 10.500000 Dipole: 3.363955 ) Current test charges: C1 -0.225 C2 0.055 O2 -0.711 HO2 0.431 Iteration: 148 O2 QME: -6.069 MME: -6.713 (-0.644) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.711 (-0.015) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.383 (-0.195) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.512 (0.288) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.365 (-0.162) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.332 (0.525) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.886 (0.059) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.191 -0.065 1.774} (2.820 D) Ratio: 1.57 Current objective value: 34.906619 ( En: 21.042665 Dist: 10.500000 Dipole: 3.363955 ) Current test charges: C1 -0.247 C2 0.067 O2 -0.697 HO2 0.427 Iteration: 149 O2 QME: -6.069 MME: -6.457 (-0.388) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.618 (0.079) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.277 (-0.089) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.428 (0.371) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.412 (-0.208) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.386 (0.472) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.933 (0.012) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.999 -0.008 1.761} (2.664 D) Ratio: 1.48 Current objective value: 26.468030 ( En: 14.218030 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.206 C2 0.007 O2 -0.674 HO2 0.423 Iteration: 150 O2 QME: -6.069 MME: -6.390 (-0.321) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.741 (-0.044) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.372 (-0.184) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.562 (0.237) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.202 (0.002) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.205 (0.653) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.860 (0.085) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.153 -0.229 1.718} (2.764 D) Ratio: 1.54 Current objective value: 28.466350 ( En: 15.700680 Dist: 11.750000 Dipole: 1.015670 ) Current test charges: C1 -0.206 C2 0.007 O2 -0.674 HO2 0.423 Iteration: 151 O2 QME: -6.069 MME: -6.390 (-0.321) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.741 (-0.044) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.372 (-0.184) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.562 (0.237) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.202 (0.002) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.205 (0.653) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.860 (0.085) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.153 -0.229 1.718} (2.764 D) Ratio: 1.54 Current objective value: 28.466350 ( En: 15.700680 Dist: 11.750000 Dipole: 1.015670 ) Current test charges: C1 -0.232 C2 0.038 O2 -0.679 HO2 0.423 Iteration: 152 O2 QME: -6.069 MME: -6.327 (-0.258) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.651 (0.046) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.291 (-0.103) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.471 (0.328) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.312 (-0.108) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.303 (0.555) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.910 (0.035) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.014 -0.110 1.732} (2.659 D) Ratio: 1.48 Current objective value: 23.432493 ( En: 12.682493 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.217 C2 0.062 O2 -0.739 HO2 0.445 Iteration: 153 O2 QME: -6.069 MME: -7.054 (-0.985) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.782 (-0.086) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.448 (-0.260) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.541 (0.258) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.385 (-0.181) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.317 (0.541) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.079 (-0.134) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.322 -0.080 1.833} (2.959 D) Ratio: 1.65 Current objective value: 60.634743 ( En: 36.369270 Dist: 9.250000 Dipole: 15.015472 ) Current test charges: C1 -0.217 C2 0.062 O2 -0.739 HO2 0.445 Iteration: 154 O2 QME: -6.069 MME: -7.054 (-0.985) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.782 (-0.086) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.448 (-0.260) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.541 (0.258) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.385 (-0.181) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.317 (0.541) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.079 (-0.134) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.322 -0.080 1.833} (2.959 D) Ratio: 1.65 Current objective value: 60.634743 ( En: 36.369270 Dist: 9.250000 Dipole: 15.015472 ) Current test charges: C1 -0.234 C2 0.063 O2 -0.715 HO2 0.435 Iteration: 155 O2 QME: -6.069 MME: -6.707 (-0.638) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.690 (0.006) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.348 (-0.161) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.477 (0.323) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.393 (-0.189) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.348 (0.509) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.022 (-0.078) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.134 -0.049 1.794} (2.788 D) Ratio: 1.55 Current objective value: 33.286816 ( En: 20.952359 Dist: 10.500000 Dipole: 1.834456 ) Current test charges: C1 -0.242 C2 0.063 O2 -0.702 HO2 0.431 Iteration: 156 O2 QME: -6.069 MME: -6.533 (-0.464) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.645 (0.051) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.299 (-0.111) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.445 (0.355) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.398 (-0.194) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.364 (0.494) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.994 (-0.049) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.040 -0.034 1.774} (2.703 D) Ratio: 1.50 Current objective value: 26.513754 ( En: 16.001331 Dist: 10.500000 Dipole: 0.012422 ) Current test charges: C1 -0.278 C2 0.117 O2 -0.707 HO2 0.418 Iteration: 157 O2 QME: -6.069 MME: -6.469 (-0.400) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.508 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.227 (-0.039) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.347 (0.453) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.589 (-0.385) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.563 (0.294) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.677 (0.268) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.916 0.210 1.754} (2.607 D) Ratio: 1.45 Current objective value: 29.217846 ( En: 17.717846 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.278 C2 0.117 O2 -0.707 HO2 0.418 Iteration: 158 O2 QME: -6.069 MME: -6.469 (-0.400) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.508 (0.189) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.227 (-0.039) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.347 (0.453) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.589 (-0.385) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.563 (0.294) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.677 (0.268) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.916 0.210 1.754} (2.607 D) Ratio: 1.45 Current objective value: 29.217846 ( En: 17.717846 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.265 C2 0.093 O2 -0.700 HO2 0.422 Iteration: 159 O2 QME: -6.069 MME: -6.433 (-0.364) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.552 (0.144) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.240 (-0.052) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.379 (0.421) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.505 (-0.301) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.481 (0.377) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.807 (0.138) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.936 0.108 1.756} (2.616 D) Ratio: 1.46 Current objective value: 26.120438 ( En: 14.620438 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.211 C2 0.035 O2 -0.693 HO2 0.420 Iteration: 160 O2 QME: -6.069 MME: -6.601 (-0.532) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.733 (-0.037) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.417 (-0.229) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.564 (0.236) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.295 (-0.091) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.291 (0.566) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.647 (0.298) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.242 -0.112 1.726} (2.831 D) Ratio: 1.58 Current objective value: 35.741236 ( En: 20.256190 Dist: 11.500000 Dipole: 3.985045 ) Current test charges: C1 -0.211 C2 0.035 O2 -0.693 HO2 0.420 Iteration: 161 O2 QME: -6.069 MME: -6.601 (-0.532) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.733 (-0.037) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.417 (-0.229) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.564 (0.236) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.295 (-0.091) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.291 (0.566) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.647 (0.298) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.242 -0.112 1.726} (2.831 D) Ratio: 1.58 Current objective value: 35.741236 ( En: 20.256190 Dist: 11.500000 Dipole: 3.985045 ) Current test charges: C1 -0.230 C2 0.052 O2 -0.694 HO2 0.422 Iteration: 162 O2 QME: -6.069 MME: -6.514 (-0.445) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.669 (0.028) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.344 (-0.156) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.493 (0.307) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.357 (-0.153) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.345 (0.513) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.766 (0.179) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.114 -0.053 1.739} (2.738 D) Ratio: 1.52 Current objective value: 26.768599 ( En: 15.881141 Dist: 10.500000 Dipole: 0.387458 ) Current test charges: C1 -0.240 C2 0.061 O2 -0.694 HO2 0.423 Iteration: 163 O2 QME: -6.069 MME: -6.470 (-0.401) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.637 (0.060) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.307 (-0.119) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.457 (0.342) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.388 (-0.184) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.371 (0.486) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.826 (0.119) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.050 -0.023 1.746} (2.693 D) Ratio: 1.50 Current objective value: 24.999340 ( En: 14.499340 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.258 C2 0.076 O2 -0.681 HO2 0.413 Iteration: 164 O2 QME: -6.069 MME: -6.263 (-0.194) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.549 (0.147) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.237 (-0.049) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.400 (0.399) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.443 (-0.239) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.446 (0.411) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.666 (0.279) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.920 0.065 1.714} (2.575 D) Ratio: 1.43 Current objective value: 25.636090 ( En: 13.136090 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.258 C2 0.076 O2 -0.681 HO2 0.413 Iteration: 165 O2 QME: -6.069 MME: -6.263 (-0.194) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.549 (0.147) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.237 (-0.049) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.400 (0.399) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.443 (-0.239) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.446 (0.411) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.666 (0.279) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.920 0.065 1.714} (2.575 D) Ratio: 1.43 Current objective value: 25.636090 ( En: 13.136090 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.256 C2 0.075 O2 -0.681 HO2 0.412 Iteration: 166 O2 QME: -6.069 MME: -6.269 (-0.200) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.554 (0.143) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.247 (-0.059) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.409 (0.391) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.439 (-0.235) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.445 (0.412) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.622 (0.323) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.937 0.065 1.709} (2.584 D) Ratio: 1.44 Current objective value: 26.155793 ( En: 13.655793 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.256 C2 0.075 O2 -0.681 HO2 0.412 Iteration: 167 O2 QME: -6.069 MME: -6.269 (-0.200) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.554 (0.143) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.247 (-0.059) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.409 (0.391) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.439 (-0.235) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.445 (0.412) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.622 (0.323) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.937 0.065 1.709} (2.584 D) Ratio: 1.44 Current objective value: 26.155793 ( En: 13.655793 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.254 C2 0.073 O2 -0.685 HO2 0.416 Iteration: 168 O2 QME: -6.069 MME: -6.321 (-0.252) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.572 (0.125) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.255 (-0.068) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.414 (0.385) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.432 (-0.228) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.428 (0.429) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.710 (0.235) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.955 0.044 1.724} (2.606 D) Ratio: 1.45 Current objective value: 25.573343 ( En: 13.073343 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.031 O2 -0.669 HO2 0.416 Iteration: 169 O2 QME: -6.069 MME: -6.253 (-0.184) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.648 (0.048) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.302 (-0.114) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.491 (0.309) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.288 (-0.084) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.559) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.741 (0.204) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.027 -0.114 1.701} (2.649 D) Ratio: 1.47 Current objective value: 25.643899 ( En: 12.643899 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.031 O2 -0.669 HO2 0.416 Iteration: 170 O2 QME: -6.069 MME: -6.253 (-0.184) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.648 (0.048) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.302 (-0.114) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.491 (0.309) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.288 (-0.084) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.559) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.741 (0.204) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.027 -0.114 1.701} (2.649 D) Ratio: 1.47 Current objective value: 25.643899 ( En: 12.643899 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.049 O2 -0.678 HO2 0.417 Iteration: 171 O2 QME: -6.069 MME: -6.302 (-0.233) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.621 (0.075) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.284 (-0.096) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.458 (0.341) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.349 (-0.145) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.350 (0.508) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.760 (0.185) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.001 -0.052 1.717} (2.637 D) Ratio: 1.47 Current objective value: 23.217254 ( En: 12.467254 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.042 O2 -0.693 HO2 0.429 Iteration: 172 O2 QME: -6.069 MME: -6.490 (-0.421) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.685 (0.012) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.327 (-0.140) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.490 (0.310) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.322 (-0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.559) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.969 (-0.024) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.085 -0.113 1.757} (2.729 D) Ratio: 1.52 Current objective value: 26.224645 ( En: 15.488917 Dist: 10.500000 Dipole: 0.235728 ) Current test charges: C1 -0.228 C2 0.042 O2 -0.693 HO2 0.429 Iteration: 173 O2 QME: -6.069 MME: -6.490 (-0.421) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.685 (0.012) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.327 (-0.140) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.490 (0.310) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.322 (-0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.559) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.969 (-0.024) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.085 -0.113 1.757} (2.729 D) Ratio: 1.52 Current objective value: 26.224645 ( En: 15.488917 Dist: 10.500000 Dipole: 0.235728 ) Current test charges: C1 -0.236 C2 0.051 O2 -0.689 HO2 0.424 Iteration: 174 O2 QME: -6.069 MME: -6.424 (-0.355) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.646 (0.050) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.302 (-0.114) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.464 (0.336) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.356 (-0.152) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.340 (0.517) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.883 (0.062) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.039 -0.063 1.745} (2.684 D) Ratio: 1.49 Current objective value: 24.222520 ( En: 13.722520 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.226 C2 0.036 O2 -0.689 HO2 0.429 Iteration: 175 O2 QME: -6.069 MME: -6.458 (-0.389) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.690 (0.007) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.325 (-0.137) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.494 (0.305) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.303 (-0.099) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.281 (0.576) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.990 (-0.046) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.079 -0.135 1.754} (2.723 D) Ratio: 1.52 Current objective value: 28.103622 ( En: 15.189890 Dist: 12.750000 Dipole: 0.163733 ) Current test charges: C1 -0.226 C2 0.036 O2 -0.689 HO2 0.429 Iteration: 176 O2 QME: -6.069 MME: -6.458 (-0.389) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.690 (0.007) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.325 (-0.137) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.494 (0.305) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.303 (-0.099) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.281 (0.576) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.990 (-0.046) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.079 -0.135 1.754} (2.723 D) Ratio: 1.52 Current objective value: 28.103622 ( En: 15.189890 Dist: 12.750000 Dipole: 0.163733 ) Current test charges: C1 -0.234 C2 0.046 O2 -0.688 HO2 0.425 Iteration: 177 O2 QME: -6.069 MME: -6.419 (-0.350) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.656 (0.040) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.305 (-0.117) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.471 (0.328) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.339 (-0.135) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.323 (0.535) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.911 (0.034) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.044 -0.084 1.745} (2.689 D) Ratio: 1.50 Current objective value: 24.280264 ( En: 13.780264 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.204 C2 0.003 O2 -0.675 HO2 0.426 Iteration: 178 O2 QME: -6.069 MME: -6.394 (-0.325) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.750 (-0.054) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.367 (-0.180) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.561 (0.238) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.188 (0.016) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.186 (0.672) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.958 (-0.013) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.146 -0.255 1.728} (2.767 D) Ratio: 1.54 Current objective value: 29.078235 ( En: 16.232224 Dist: 11.750000 Dipole: 1.096011 ) Current test charges: C1 -0.204 C2 0.003 O2 -0.675 HO2 0.426 Iteration: 179 O2 QME: -6.069 MME: -6.394 (-0.325) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.750 (-0.054) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.367 (-0.180) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.561 (0.238) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.188 (0.016) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.186 (0.672) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.958 (-0.013) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.146 -0.255 1.728} (2.767 D) Ratio: 1.54 Current objective value: 29.078235 ( En: 16.232224 Dist: 11.750000 Dipole: 1.096011 ) Current test charges: C1 -0.220 C2 0.026 O2 -0.680 HO2 0.425 Iteration: 180 O2 QME: -6.069 MME: -6.390 (-0.321) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.696 (0.001) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.333 (-0.145) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.513 (0.287) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.268 (-0.065) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.261 (0.597) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.908 (0.037) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.088 -0.161 1.733} (2.718 D) Ratio: 1.51 Current objective value: 27.301656 ( En: 14.197713 Dist: 13.000000 Dipole: 0.103943 ) Current test charges: C1 -0.228 C2 0.038 O2 -0.683 HO2 0.424 Iteration: 181 O2 QME: -6.069 MME: -6.388 (-0.319) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.669 (0.027) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.315 (-0.127) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.489 (0.311) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.309 (-0.105) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.559) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.883 (0.062) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.059 -0.113 1.735} (2.694 D) Ratio: 1.50 Current objective value: 24.322044 ( En: 13.572044 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.226 C2 0.024 O2 -0.670 HO2 0.422 Iteration: 182 O2 QME: -6.069 MME: -6.250 (-0.181) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.664 (0.032) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.290 (-0.102) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.488 (0.311) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.261 (-0.057) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.261 (0.597) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.926 (0.019) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.007 -0.164 1.719} (2.648 D) Ratio: 1.47 Current objective value: 25.520453 ( En: 12.520453 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.226 C2 0.024 O2 -0.670 HO2 0.422 Iteration: 183 O2 QME: -6.069 MME: -6.250 (-0.181) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.664 (0.032) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.290 (-0.102) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.488 (0.311) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.261 (-0.057) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.261 (0.597) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.926 (0.019) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.007 -0.164 1.719} (2.648 D) Ratio: 1.47 Current objective value: 25.520453 ( En: 12.520453 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.230 C2 0.034 O2 -0.677 HO2 0.422 Iteration: 184 O2 QME: -6.069 MME: -6.311 (-0.242) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.656 (0.040) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.295 (-0.107) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.479 (0.320) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.297 (-0.093) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.291 (0.566) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.898 (0.047) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.019 -0.124 1.727} (2.660 D) Ratio: 1.48 Current objective value: 25.632600 ( En: 12.632600 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.232 C2 0.039 O2 -0.680 HO2 0.423 Iteration: 185 O2 QME: -6.069 MME: -6.341 (-0.272) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.653 (0.044) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.297 (-0.109) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.475 (0.324) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.315 (-0.111) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.307 (0.551) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.884 (0.061) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.025 -0.104 1.731} (2.666 D) Ratio: 1.48 Current objective value: 23.555472 ( En: 12.805472 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.243 C2 0.054 O2 -0.683 HO2 0.421 Iteration: 186 O2 QME: -6.069 MME: -6.327 (-0.258) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.615 (0.082) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.271 (-0.083) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.441 (0.358) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.367 (-0.164) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.358 (0.499) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.852 (0.093) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.042 1.733} (2.632 D) Ratio: 1.46 Current objective value: 24.818846 ( En: 12.318846 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.243 C2 0.054 O2 -0.683 HO2 0.421 Iteration: 187 O2 QME: -6.069 MME: -6.327 (-0.258) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.615 (0.082) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.271 (-0.083) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.441 (0.358) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.367 (-0.164) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.358 (0.499) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.852 (0.093) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.042 1.733} (2.632 D) Ratio: 1.46 Current objective value: 24.818846 ( En: 12.318846 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.049 O2 -0.683 HO2 0.422 Iteration: 188 O2 QME: -6.069 MME: -6.344 (-0.275) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.630 (0.066) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.283 (-0.095) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.455 (0.345) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.351 (-0.147) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.341 (0.516) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.861 (0.084) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.003 -0.063 1.733} (2.649 D) Ratio: 1.47 Current objective value: 23.332195 ( En: 12.582195 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.044 O2 -0.674 HO2 0.418 Iteration: 189 O2 QME: -6.069 MME: -6.256 (-0.187) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.619 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.456 (0.343) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.333 (-0.129) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.336 (0.522) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.792 (0.153) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.070 1.714} (2.620 D) Ratio: 1.46 Current objective value: 22.717894 ( En: 11.967894 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.044 O2 -0.674 HO2 0.418 Iteration: 190 O2 QME: -6.069 MME: -6.256 (-0.187) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.619 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.456 (0.343) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.333 (-0.129) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.336 (0.522) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.792 (0.153) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.070 1.714} (2.620 D) Ratio: 1.46 Current objective value: 22.717894 ( En: 11.967894 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.035 O2 -0.665 HO2 0.416 Iteration: 191 O2 QME: -6.069 MME: -6.175 (-0.106) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.300 (-0.096) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.311 (0.547) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.787 (0.158) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.961 -0.102 1.700} (2.597 D) Ratio: 1.45 Current objective value: 22.501769 ( En: 11.751769 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.035 O2 -0.665 HO2 0.416 Iteration: 192 O2 QME: -6.069 MME: -6.175 (-0.106) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.300 (-0.096) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.311 (0.547) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.787 (0.158) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.961 -0.102 1.700} (2.597 D) Ratio: 1.45 Current objective value: 22.501769 ( En: 11.751769 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.242 C2 0.048 O2 -0.670 HO2 0.415 Iteration: 193 O2 QME: -6.069 MME: -6.203 (-0.134) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.597 (0.100) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.256 (-0.069) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.442 (0.357) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.347 (-0.143) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.355 (0.502) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.742 (0.203) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.948 -0.047 1.704} (2.589 D) Ratio: 1.44 Current objective value: 24.349453 ( En: 11.849453 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.242 C2 0.048 O2 -0.670 HO2 0.415 Iteration: 194 O2 QME: -6.069 MME: -6.203 (-0.134) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.597 (0.100) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.256 (-0.069) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.442 (0.357) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.347 (-0.143) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.355 (0.502) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.742 (0.203) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.948 -0.047 1.704} (2.589 D) Ratio: 1.44 Current objective value: 24.349453 ( En: 11.849453 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.046 O2 -0.673 HO2 0.417 Iteration: 195 O2 QME: -6.069 MME: -6.242 (-0.173) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.084) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.268 (-0.080) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.451 (0.348) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.338 (-0.134) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.342 (0.516) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.782 (0.163) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.970 -0.063 1.712} (2.611 D) Ratio: 1.45 Current objective value: 24.378645 ( En: 11.878645 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.044 O2 -0.674 HO2 0.418 Iteration: 196 O2 QME: -6.069 MME: -6.261 (-0.192) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.076) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.456 (0.344) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.334 (-0.130) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.335 (0.523) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.802 (0.143) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.071 1.715} (2.621 D) Ratio: 1.46 Current objective value: 22.715162 ( En: 11.965162 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.244 C2 0.052 O2 -0.669 HO2 0.411 Iteration: 197 O2 QME: -6.069 MME: -6.190 (-0.121) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.585 (0.112) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.257 (-0.069) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.440 (0.360) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.361 (-0.157) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.375 (0.482) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.658 (0.287) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.948 -0.021 1.695} (2.582 D) Ratio: 1.44 Current objective value: 25.023674 ( En: 12.523674 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.244 C2 0.052 O2 -0.669 HO2 0.411 Iteration: 198 O2 QME: -6.069 MME: -6.190 (-0.121) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.585 (0.112) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.257 (-0.069) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.440 (0.360) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.361 (-0.157) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.375 (0.482) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.658 (0.287) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.948 -0.021 1.695} (2.582 D) Ratio: 1.44 Current objective value: 25.023674 ( En: 12.523674 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.048 O2 -0.672 HO2 0.415 Iteration: 199 O2 QME: -6.069 MME: -6.229 (-0.160) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.603 (0.093) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.266 (-0.078) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.449 (0.351) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.347 (-0.143) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.355 (0.503) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.729 (0.216) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.967 -0.046 1.705} (2.603 D) Ratio: 1.45 Current objective value: 24.582736 ( En: 12.082736 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.046 O2 -0.673 HO2 0.416 Iteration: 200 O2 QME: -6.069 MME: -6.248 (-0.179) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.613 (0.084) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.271 (-0.083) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.453 (0.346) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.340 (-0.136) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.345 (0.513) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.765 (0.180) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.976 -0.059 1.711} (2.614 D) Ratio: 1.45 Current objective value: 24.506733 ( En: 12.006733 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.045 O2 -0.674 HO2 0.417 Iteration: 201 O2 QME: -6.069 MME: -6.258 (-0.189) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.617 (0.079) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.455 (0.344) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.337 (-0.133) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.339 (0.518) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.783 (0.162) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.065 1.713} (2.620 D) Ratio: 1.46 Current objective value: 24.504849 ( En: 12.004849 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.045 O2 -0.674 HO2 0.418 Iteration: 202 O2 QME: -6.069 MME: -6.263 (-0.194) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.275 (-0.087) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.456 (0.343) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.335 (-0.131) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.337 (0.521) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.792 (0.153) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.983 -0.068 1.714} (2.622 D) Ratio: 1.46 Current objective value: 22.762234 ( En: 12.012234 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.035 O2 -0.660 HO2 0.411 Iteration: 203 O2 QME: -6.069 MME: -6.131 (-0.062) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.607 (0.090) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.262 (-0.075) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.303 (-0.100) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.323 (0.534) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.690 (0.255) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.954 -0.086 1.685} (2.581 D) Ratio: 1.44 Current objective value: 23.039246 ( En: 12.289246 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.035 O2 -0.660 HO2 0.411 Iteration: 204 O2 QME: -6.069 MME: -6.131 (-0.062) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.607 (0.090) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.262 (-0.075) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.303 (-0.100) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.323 (0.534) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.690 (0.255) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.954 -0.086 1.685} (2.581 D) Ratio: 1.44 Current objective value: 23.039246 ( En: 12.289246 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.030 O2 -0.659 HO2 0.414 Iteration: 205 O2 QME: -6.069 MME: -6.107 (-0.038) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.084) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.251 (-0.063) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.341) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.285 (-0.081) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.301 (0.557) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.789 (0.156) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.933 -0.116 1.692} (2.571 D) Ratio: 1.43 Current objective value: 26.492641 ( En: 11.742641 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.030 O2 -0.659 HO2 0.414 Iteration: 206 O2 QME: -6.069 MME: -6.107 (-0.038) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.084) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.251 (-0.063) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.341) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.285 (-0.081) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.301 (0.557) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.789 (0.156) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.933 -0.116 1.692} (2.571 D) Ratio: 1.43 Current objective value: 26.492641 ( En: 11.742641 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.035 O2 -0.664 HO2 0.415 Iteration: 207 O2 QME: -6.069 MME: -6.162 (-0.093) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.615 (0.082) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.260 (-0.073) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.341) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.303 (-0.099) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.314 (0.543) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.781 (0.164) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.952 -0.098 1.699} (2.590 D) Ratio: 1.44 Current objective value: 24.214983 ( En: 11.714983 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.237 C2 0.038 O2 -0.667 HO2 0.416 Iteration: 208 O2 QME: -6.069 MME: -6.190 (-0.121) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.616 (0.081) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.341) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.312 (-0.108) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.321 (0.536) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.777 (0.168) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.962 -0.089 1.702} (2.599 D) Ratio: 1.45 Current objective value: 24.269370 ( En: 11.769370 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.237 C2 0.039 O2 -0.668 HO2 0.416 Iteration: 209 O2 QME: -6.069 MME: -6.203 (-0.134) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.617 (0.080) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.268 (-0.080) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.458 (0.341) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.317 (-0.113) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.325 (0.533) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.775 (0.170) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.967 -0.084 1.704} (2.604 D) Ratio: 1.45 Current objective value: 22.563561 ( En: 11.813561 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.049 O2 -0.685 HO2 0.424 Iteration: 210 O2 QME: -6.069 MME: -6.363 (-0.294) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.635 (0.061) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.282 (-0.094) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.452 (0.347) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.350 (-0.146) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.335 (0.522) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.919 (0.026) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.001 -0.070 1.742} (2.654 D) Ratio: 1.48 Current objective value: 23.607360 ( En: 12.857360 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.049 O2 -0.685 HO2 0.424 Iteration: 211 O2 QME: -6.069 MME: -6.363 (-0.294) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.635 (0.061) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.282 (-0.094) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.452 (0.347) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.350 (-0.146) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.335 (0.522) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.919 (0.026) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.001 -0.070 1.742} (2.654 D) Ratio: 1.48 Current objective value: 23.607360 ( En: 12.857360 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.045 O2 -0.678 HO2 0.421 Iteration: 212 O2 QME: -6.069 MME: -6.297 (-0.228) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.627 (0.069) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.276 (-0.089) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.455 (0.344) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.337 (-0.133) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.332 (0.526) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.854 (0.091) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.988 -0.075 1.726} (2.634 D) Ratio: 1.47 Current objective value: 22.888838 ( En: 12.138838 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.237 C2 0.043 O2 -0.675 HO2 0.419 Iteration: 213 O2 QME: -6.069 MME: -6.265 (-0.196) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.623 (0.073) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.456 (0.343) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.330 (-0.127) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.330 (0.527) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.822 (0.123) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.077 1.718} (2.623 D) Ratio: 1.46 Current objective value: 22.694432 ( En: 11.944432 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.036 O2 -0.667 HO2 0.416 Iteration: 214 O2 QME: -6.069 MME: -6.192 (-0.123) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.460 (0.340) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.307 (-0.103) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.315 (0.543) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.801 (0.144) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.963 -0.097 1.705} (2.601 D) Ratio: 1.45 Current objective value: 22.463314 ( En: 11.713314 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.036 O2 -0.667 HO2 0.416 Iteration: 215 O2 QME: -6.069 MME: -6.192 (-0.123) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.460 (0.340) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.307 (-0.103) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.315 (0.543) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.801 (0.144) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.963 -0.097 1.705} (2.601 D) Ratio: 1.45 Current objective value: 22.463314 ( En: 11.713314 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.034 O2 -0.665 HO2 0.416 Iteration: 216 O2 QME: -6.069 MME: -6.171 (-0.102) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.621 (0.076) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.263 (-0.075) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.338) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.297 (-0.093) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.307 (0.551) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.804 (0.141) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.957 -0.107 1.701} (2.596 D) Ratio: 1.44 Current objective value: 22.447352 ( En: 11.697352 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.034 O2 -0.665 HO2 0.416 Iteration: 217 O2 QME: -6.069 MME: -6.171 (-0.102) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.621 (0.076) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.263 (-0.075) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.338) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.297 (-0.093) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.307 (0.551) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.804 (0.141) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.957 -0.107 1.701} (2.596 D) Ratio: 1.44 Current objective value: 22.447352 ( En: 11.697352 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.029 O2 -0.660 HO2 0.415 Iteration: 218 O2 QME: -6.069 MME: -6.123 (-0.054) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.258 (-0.070) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.465 (0.335) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.280 (-0.076) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.295 (0.563) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.792 (0.153) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.946 -0.123 1.693} (2.582 D) Ratio: 1.44 Current objective value: 24.786467 ( En: 11.786467 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.029 O2 -0.660 HO2 0.415 Iteration: 219 O2 QME: -6.069 MME: -6.123 (-0.054) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.258 (-0.070) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.465 (0.335) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.280 (-0.076) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.295 (0.563) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.792 (0.153) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.946 -0.123 1.693} (2.582 D) Ratio: 1.44 Current objective value: 24.786467 ( En: 11.786467 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.033 O2 -0.664 HO2 0.416 Iteration: 220 O2 QME: -6.069 MME: -6.162 (-0.093) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.620 (0.077) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.263 (-0.075) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.295 (-0.091) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.306 (0.552) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.795 (0.150) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.956 -0.108 1.699} (2.593 D) Ratio: 1.44 Current objective value: 22.470634 ( En: 11.720634 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.025 O2 -0.654 HO2 0.412 Iteration: 221 O2 QME: -6.069 MME: -6.071 (-0.002) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.614 (0.082) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.467 (0.333) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.268 (-0.064) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.290 (0.568) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.754 (0.191) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.934 -0.129 1.681} (2.566 D) Ratio: 1.43 Current objective value: 25.110834 ( En: 12.110834 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.025 O2 -0.654 HO2 0.412 Iteration: 222 O2 QME: -6.069 MME: -6.071 (-0.002) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.614 (0.082) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.253 (-0.065) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.467 (0.333) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.268 (-0.064) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.290 (0.568) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.754 (0.191) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.934 -0.129 1.681} (2.566 D) Ratio: 1.43 Current objective value: 25.110834 ( En: 12.110834 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.234 C2 0.030 O2 -0.660 HO2 0.414 Iteration: 223 O2 QME: -6.069 MME: -6.126 (-0.057) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.617 (0.080) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.259 (-0.071) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.464 (0.336) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.286 (-0.082) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.301 (0.557) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.773 (0.172) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.947 -0.115 1.692} (2.582 D) Ratio: 1.44 Current objective value: 24.829289 ( En: 11.829289 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.033 O2 -0.663 HO2 0.415 Iteration: 224 O2 QME: -6.069 MME: -6.153 (-0.084) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.618 (0.078) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.262 (-0.074) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.294 (-0.091) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.307 (0.551) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.783 (0.162) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.954 -0.107 1.697} (2.590 D) Ratio: 1.44 Current objective value: 22.505600 ( En: 11.755600 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.027 O2 -0.660 HO2 0.416 Iteration: 225 O2 QME: -6.069 MME: -6.128 (-0.059) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.624 (0.073) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.258 (-0.071) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.466 (0.334) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.276 (-0.072) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.289 (0.569) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.819 (0.126) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.947 -0.131 1.696} (2.585 D) Ratio: 1.44 Current objective value: 24.740458 ( En: 11.740458 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.027 O2 -0.660 HO2 0.416 Iteration: 226 O2 QME: -6.069 MME: -6.128 (-0.059) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.624 (0.073) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.258 (-0.071) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.466 (0.334) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.276 (-0.072) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.289 (0.569) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.819 (0.126) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.947 -0.131 1.696} (2.585 D) Ratio: 1.44 Current objective value: 24.740458 ( En: 11.740458 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.234 C2 0.031 O2 -0.662 HO2 0.416 Iteration: 227 O2 QME: -6.069 MME: -6.149 (-0.080) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.622 (0.075) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.261 (-0.073) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.464 (0.336) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.287 (-0.083) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.299 (0.559) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.807 (0.138) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.952 -0.118 1.698} (2.590 D) Ratio: 1.44 Current objective value: 24.712950 ( En: 11.712950 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.234 C2 0.032 O2 -0.664 HO2 0.416 Iteration: 228 O2 QME: -6.069 MME: -6.160 (-0.091) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.621 (0.076) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.262 (-0.074) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.463 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.293 (-0.089) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.304 (0.554) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.800 (0.145) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.955 -0.111 1.699} (2.593 D) Ratio: 1.44 Current objective value: 22.463100 ( En: 11.713100 Dist: 10.750000 Dipole: 0.000000 ) FINAL CHARGES C1 -0.235 C2 0.034 O2 -0.665 HO2 0.416 END Be sure to check sum of charges for rounding errors!