Current test charges: C1 -0.235 C2 0.034 O2 -0.665 HO2 0.416 Iteration: 0 O2 QME: -6.069 MME: -6.173 (-0.104) 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: -1.263 (-0.076) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.461 (0.338) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.299 (-0.095) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.308 (0.549) 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: {1.958 -0.105 1.701} (2.596 D) Ratio: 1.44 Current objective value: 22.452812 ( En: 11.702812 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.047 C2 0.007 O2 -0.133 HO2 -0.277 Iteration: 1 O2 QME: -6.069 MME: -3.294 (2.775) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -0.973 (0.724) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -2.687 (-1.499) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.849 (-1.050) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -1.197 (0.006) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -1.752 (-0.895) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: 6.535 (12.480) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {4.055 1.875 -0.727} (4.526 D) Ratio: 2.52 Current objective value: 5486.943588 ( En: 4203.398306 Dist: 23.250000 Dipole: 1260.295282 ) Current test charges: C1 -0.902 C2 -0.581 O2 0.546 HO2 0.486 Iteration: 2 O2 QME: -6.069 MME: 6.882 (12.951) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: 1.134 (2.830) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: 3.962 (5.150) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 2.422 (3.221) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: 0.369 (1.572) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.157 (2.015) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -19.968 (-14.023) QMD: 2.031 MMDistDelta: -0.200 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-9.303 -2.801 1.200} (9.790 D) Ratio: 5.45 Current objective value: 25711.581013 ( En: 10395.588362 Dist: 100.000000 Dipole: 15215.992651 ) Current test charges: C1 -0.227 C2 -0.109 O2 -0.024 HO2 -0.090 Iteration: 3 O2 QME: -6.069 MME: -1.195 (4.874) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: -0.488 (1.209) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.084 (0.104) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.769 (0.030) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.849 (0.355) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -1.032 (-0.175) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: 2.068 (8.013) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.282 0.842 -0.221} (1.550 D) Ratio: 0.86 Current objective value: 3002.089006 ( En: 2239.652239 Dist: 45.000000 Dipole: 717.436767 ) Current test charges: C1 -0.227 C2 -0.109 O2 -0.024 HO2 -0.090 Iteration: 4 O2 QME: -6.069 MME: -1.192 (4.877) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: -0.487 (1.210) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.082 (0.106) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.767 (0.032) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.849 (0.355) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -1.032 (-0.174) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: 2.062 (8.007) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.278 0.842 -0.220} (1.546 D) Ratio: 0.86 Current objective value: 3002.676044 ( En: 2238.117242 Dist: 45.000000 Dipole: 719.558802 ) Current test charges: C1 -0.920 C2 -0.805 O2 0.425 HO2 0.850 Iteration: 5 O2 QME: -6.069 MME: 6.823 (12.892) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: 0.636 (2.332) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: 4.734 (5.921) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 2.891 (3.690) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: 0.960 (2.164) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.454 (3.312) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -33.839 (-27.895) QMD: 2.031 MMDistDelta: -0.300 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-10.792 -4.774 2.326} (12.028 D) Ratio: 6.69 Current objective value: 48057.503220 ( En: 25351.875851 Dist: 105.000000 Dipole: 22600.627369 ) Current test charges: C1 -0.442 C2 -0.161 O2 0.144 HO2 0.009 Iteration: 6 O2 QME: -6.069 MME: 1.080 (7.149) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: 0.159 (1.856) QMD: 2.737 MMDistDelta: 0.400 H12 QME: -1.188 MME: 0.320 (1.508) QMD: 2.778 MMDistDelta: 0.400 H13 QME: -0.799 MME: 0.173 (0.973) QMD: 2.751 MMDistDelta: 0.400 H21 QME: -1.204 MME: -0.730 (0.474) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.746 (0.111) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -1.038 (4.907) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-1.533 0.324 0.003} (1.567 D) Ratio: 0.87 Current objective value: 7646.881680 ( En: 2052.197383 Dist: 86.250000 Dipole: 5508.434297 ) Current test charges: C1 -0.234 C2 -0.158 O2 -0.177 HO2 0.120 Iteration: 7 O2 QME: -6.069 MME: -1.945 (4.124) QMD: 2.978 MMDistDelta: 0.300 H11 QME: -1.696 MME: -0.852 (0.844) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.826 (0.362) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.536 (0.263) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.685 (0.519) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.417 (0.440) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -1.265 (4.680) QMD: 2.031 MMDistDelta: 0.350 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.910 0.020 0.492} (1.035 D) Ratio: 0.58 Current objective value: 1319.921748 ( En: 1007.064062 Dist: 40.000000 Dipole: 272.857687 ) Current test charges: C1 -0.461 C2 0.645 O2 -0.744 HO2 0.110 Iteration: 8 O2 QME: -6.069 MME: -7.049 (-0.980) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -0.514 (1.182) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -1.684 (-0.496) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.238 (0.562) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -3.587 (-2.383) QMD: 2.796 MMDistDelta: -0.100 H22 QME: -0.857 MME: -3.128 (-2.270) QMD: 2.752 MMDistDelta: -0.050 HO2 QME: -5.945 MME: 1.370 (7.315) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.720 3.199 0.970} (4.310 D) Ratio: 2.40 Current objective value: 2684.648158 ( En: 1681.704956 Dist: 28.500000 Dipole: 974.443202 ) Current test charges: C1 0.151 C2 0.945 O2 -0.965 HO2 -0.580 Iteration: 9 O2 QME: -6.069 MME: -15.266 (-9.197) QMD: 2.978 MMDistDelta: -0.100 H11 QME: -1.696 MME: -2.145 (-0.449) QMD: 2.737 MMDistDelta: -0.050 H12 QME: -1.188 MME: -7.230 (-6.042) QMD: 2.778 MMDistDelta: -0.150 H13 QME: -0.799 MME: -4.122 (-3.323) QMD: 2.751 MMDistDelta: -0.100 H21 QME: -1.204 MME: -4.661 (-3.457) QMD: 2.796 MMDistDelta: -0.150 H22 QME: -0.857 MME: -5.722 (-4.864) QMD: 2.752 MMDistDelta: -0.100 HO2 QME: -5.945 MME: 16.861 (22.806) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {11.615 6.499 -1.016} (13.348 D) Ratio: 7.43 Current objective value: 42277.795860 ( En: 17201.616518 Dist: 23.750000 Dipole: 25052.429342 ) Current test charges: C1 -0.303 C2 0.203 O2 -0.376 HO2 0.026 Iteration: 10 O2 QME: -6.069 MME: -3.828 (2.241) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -0.653 (1.044) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.452 (-0.264) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.610 (0.189) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.922 (-0.718) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.770 (-0.912) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 1.434 (7.379) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.116 1.720 0.401} (2.757 D) Ratio: 1.53 Current objective value: 1896.181375 ( En: 1550.244315 Dist: 25.750000 Dipole: 320.187060 ) Current test charges: C1 0.402 C2 1.014 O2 -1.546 HO2 -0.319 Iteration: 11 O2 QME: -6.069 MME: -24.364 (-18.295) QMD: 2.978 MMDistDelta: -0.200 H11 QME: -1.696 MME: -4.101 (-2.404) QMD: 2.737 MMDistDelta: -0.100 H12 QME: -1.188 MME: -9.295 (-8.108) QMD: 2.778 MMDistDelta: -0.200 H13 QME: -0.799 MME: -5.380 (-4.580) QMD: 2.751 MMDistDelta: -0.150 H21 QME: -1.204 MME: -4.832 (-3.628) QMD: 2.796 MMDistDelta: -0.150 H22 QME: -0.857 MME: -5.162 (-4.305) QMD: 2.752 MMDistDelta: -0.100 HO2 QME: -5.945 MME: 15.105 (21.050) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {14.933 6.014 0.082} (16.098 D) Ratio: 8.96 Current objective value: 61771.380323 ( En: 22550.070372 Dist: 30.500000 Dipole: 39190.809951 ) Current test charges: C1 -0.243 C2 0.223 O2 -0.442 HO2 0.013 Iteration: 12 O2 QME: -6.069 MME: -4.839 (1.230) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.897 (0.800) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.906 (-0.718) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.903 (-0.104) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -1.978 (-0.774) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.840 (-0.982) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 2.126 (8.071) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.937 1.844 0.394} (3.490 D) Ratio: 1.94 Current objective value: 2148.328240 ( En: 1734.528039 Dist: 20.750000 Dipole: 393.050201 ) Current test charges: C1 -0.105 C2 0.644 O2 -1.292 HO2 0.303 Iteration: 13 O2 QME: -6.069 MME: -15.490 (-9.421) QMD: 2.978 MMDistDelta: -0.150 H11 QME: -1.696 MME: -2.515 (-0.818) QMD: 2.737 MMDistDelta: 0.000 H12 QME: -1.188 MME: -4.028 (-2.840) QMD: 2.778 MMDistDelta: -0.050 H13 QME: -0.799 MME: -1.723 (-0.923) QMD: 2.751 MMDistDelta: 0.000 H21 QME: -1.204 MME: -3.465 (-2.261) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -2.471 (-1.614) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: 0.939 (6.884) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {6.888 2.651 1.818} (7.601 D) Ratio: 4.23 Current objective value: 9123.847400 ( En: 3836.108262 Dist: 18.750000 Dipole: 5268.989138 ) Current test charges: C1 -0.105 C2 0.644 O2 -0.995 HO2 0.006 Iteration: 14 O2 QME: -6.069 MME: -12.355 (-6.286) QMD: 2.978 MMDistDelta: -0.100 H11 QME: -1.696 MME: -1.875 (-0.178) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -4.141 (-2.954) QMD: 2.778 MMDistDelta: -0.050 H13 QME: -0.799 MME: -1.967 (-1.168) QMD: 2.751 MMDistDelta: 0.000 H21 QME: -1.204 MME: -3.495 (-2.291) QMD: 2.796 MMDistDelta: -0.100 H22 QME: -0.857 MME: -3.221 (-2.363) QMD: 2.752 MMDistDelta: -0.050 HO2 QME: -5.945 MME: 5.227 (11.171) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {6.904 3.540 0.750} (7.794 D) Ratio: 4.34 Current objective value: 10499.375502 ( En: 4631.776299 Dist: 18.750000 Dipole: 5848.849202 ) Current test charges: C1 -0.200 C2 0.417 O2 -0.738 HO2 0.071 Iteration: 15 O2 QME: -6.069 MME: -8.305 (-2.236) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.372 (0.324) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -2.751 (-1.563) QMD: 2.778 MMDistDelta: 0.000 H13 QME: -0.799 MME: -1.229 (-0.430) QMD: 2.751 MMDistDelta: 0.050 H21 QME: -1.204 MME: -2.663 (-1.459) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -2.317 (-1.460) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: 2.524 (8.469) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {4.516 2.438 0.771} (5.189 D) Ratio: 2.89 Current objective value: 3635.257556 ( En: 2092.853927 Dist: 17.500000 Dipole: 1524.903629 ) Current test charges: C1 -0.248 C2 0.303 O2 -0.609 HO2 0.104 Iteration: 16 O2 QME: -6.069 MME: -6.426 (-0.357) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.133 (0.564) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -2.078 (-0.890) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -0.881 (-0.082) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: -2.260 (-1.056) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.883 (-1.025) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: 1.173 (7.118) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {3.322 1.887 0.781} (3.899 D) Ratio: 2.17 Current objective value: 1830.921516 ( En: 1351.843622 Dist: 20.000000 Dipole: 459.077894 ) Current test charges: C1 0.018 C2 -0.560 O2 -0.077 HO2 0.170 Iteration: 17 O2 QME: -6.069 MME: -1.924 (4.144) QMD: 2.978 MMDistDelta: 0.300 H11 QME: -1.696 MME: -1.724 (-0.028) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.262 (-0.074) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -1.264 (-0.464) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.499 (1.703) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.818 (1.675) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -2.438 (3.507) QMD: 2.031 MMDistDelta: 0.200 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.636 -1.691 0.473} (2.400 D) Ratio: 1.34 Current objective value: 1078.985856 ( En: 885.141998 Dist: 48.000000 Dipole: 145.843858 ) Current test charges: C1 0.018 C2 -0.560 O2 -0.077 HO2 0.170 Iteration: 18 O2 QME: -6.069 MME: -1.924 (4.144) QMD: 2.978 MMDistDelta: 0.300 H11 QME: -1.696 MME: -1.724 (-0.028) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.262 (-0.074) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -1.264 (-0.464) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.499 (1.703) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.818 (1.675) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -2.438 (3.507) QMD: 2.031 MMDistDelta: 0.200 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.636 -1.691 0.473} (2.400 D) Ratio: 1.34 Current objective value: 1078.985856 ( En: 885.141998 Dist: 48.000000 Dipole: 145.843858 ) Current test charges: C1 -0.145 C2 -0.372 O2 -0.301 HO2 0.368 Iteration: 19 O2 QME: -6.069 MME: -2.804 (3.265) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.576 (0.120) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.693 (0.495) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.549 (0.250) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.039 (1.165) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.685 (1.543) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.747 (-0.802) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.755 -1.555 1.259} (2.139 D) Ratio: 1.19 Current objective value: 505.813431 ( En: 384.087325 Dist: 44.500000 Dipole: 77.226106 ) Current test charges: C1 -0.145 C2 -0.372 O2 -0.301 HO2 0.368 Iteration: 20 O2 QME: -6.069 MME: -2.804 (3.265) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.576 (0.120) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.693 (0.495) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.549 (0.250) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.039 (1.165) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.685 (1.543) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.747 (-0.802) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.755 -1.555 1.259} (2.139 D) Ratio: 1.19 Current objective value: 505.813431 ( En: 384.087325 Dist: 44.500000 Dipole: 77.226106 ) Current test charges: C1 0.006 C2 -0.610 O2 -0.353 HO2 0.508 Iteration: 21 O2 QME: -6.069 MME: -3.558 (2.511) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -2.343 (-0.646) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.918 (0.270) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.896 (-0.096) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.627 (1.831) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.629 (2.486) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.397 (-4.453) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.196 -2.901 1.644} (3.543 D) Ratio: 1.97 Current objective value: 1292.870018 ( En: 904.085727 Dist: 39.500000 Dipole: 349.284291 ) Current test charges: C1 0.006 C2 -0.610 O2 -0.353 HO2 0.508 Iteration: 22 O2 QME: -6.069 MME: -3.558 (2.511) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -2.343 (-0.646) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.918 (0.270) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.896 (-0.096) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.627 (1.831) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.629 (2.486) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.397 (-4.453) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.196 -2.901 1.644} (3.543 D) Ratio: 1.97 Current objective value: 1292.870018 ( En: 904.085727 Dist: 39.500000 Dipole: 349.284291 ) Current test charges: C1 0.050 C2 -1.161 O2 0.068 HO2 0.592 Iteration: 23 O2 QME: -6.069 MME: 0.040 (6.109) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: -2.249 (-0.552) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: 0.361 (1.548) QMD: 2.778 MMDistDelta: 0.300 H13 QME: -0.799 MME: -0.565 (0.234) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: 2.105 (3.309) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 3.200 (4.058) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -16.708 (-10.763) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-1.349 -5.320 1.546} (5.702 D) Ratio: 3.17 Current objective value: 8010.200923 ( En: 4583.554464 Dist: 64.250000 Dipole: 3362.396459 ) Current test charges: C1 0.050 C2 -0.995 O2 0.068 HO2 0.427 Iteration: 24 O2 QME: -6.069 MME: -0.327 (5.742) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: -2.040 (-0.344) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.140 (1.048) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.826 (-0.027) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 1.665 (2.869) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.447 (3.304) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.868 (-4.924) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {-0.419 -4.173 1.078} (4.330 D) Ratio: 2.41 Current objective value: 3731.840256 ( En: 1939.530306 Dist: 56.250000 Dipole: 1736.059949 ) Current test charges: C1 -0.034 C2 -0.664 O2 -0.123 HO2 0.372 Iteration: 25 O2 QME: -6.069 MME: -1.640 (4.429) QMD: 2.978 MMDistDelta: 0.350 H11 QME: -1.696 MME: -1.829 (-0.132) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.562 (0.625) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.782 (0.017) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.765 (1.968) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.470 (2.328) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -7.847 (-1.902) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.436 -2.710 1.096} (2.955 D) Ratio: 1.64 Current objective value: 1423.820055 ( En: 823.504220 Dist: 50.000000 Dipole: 550.315835 ) Current test charges: C1 -0.076 C2 -0.499 O2 -0.219 HO2 0.344 Iteration: 26 O2 QME: -6.069 MME: -2.377 (3.691) QMD: 2.978 MMDistDelta: 0.250 H11 QME: -1.696 MME: -1.723 (-0.026) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -0.775 (0.413) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.760 (0.039) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: 0.314 (1.518) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.982 (1.840) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.429 (-0.485) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.863 -1.978 1.105} (2.425 D) Ratio: 1.35 Current objective value: 721.204502 ( En: 493.099153 Dist: 43.750000 Dipole: 184.355349 ) Current test charges: C1 0.105 C2 -0.717 O2 -0.513 HO2 0.675 Iteration: 27 O2 QME: -6.069 MME: -5.184 (0.885) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -3.068 (-1.372) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.194 (-0.006) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.122 (-0.323) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.931 (2.135) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.276 (3.133) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -14.636 (-8.692) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.766 -3.812 2.204} (4.744 D) Ratio: 2.64 Current objective value: 3424.617051 ( En: 2317.192333 Dist: 36.750000 Dipole: 1070.674718 ) Current test charges: C1 0.105 C2 -0.717 O2 -0.513 HO2 0.675 Iteration: 28 O2 QME: -6.069 MME: -5.184 (0.885) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -3.068 (-1.372) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.194 (-0.006) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.122 (-0.323) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.931 (2.135) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 2.276 (3.133) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -14.636 (-8.692) QMD: 2.031 MMDistDelta: -0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.766 -3.812 2.204} (4.744 D) Ratio: 2.64 Current objective value: 3424.617051 ( En: 2317.192333 Dist: 36.750000 Dipole: 1070.674718 ) Current test charges: C1 0.009 C2 -0.559 O2 -0.418 HO2 0.518 Iteration: 29 O2 QME: -6.069 MME: -4.204 (1.865) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -2.425 (-0.728) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.086 (0.102) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.950 (-0.151) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.491 (1.695) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.522 (2.380) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.208 (-4.263) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.524 -2.729 1.720} (3.568 D) Ratio: 1.99 Current objective value: 1073.190624 ( En: 768.706665 Dist: 38.250000 Dipole: 266.233959 ) Current test charges: C1 -0.205 C2 -0.106 O2 -0.314 HO2 0.175 Iteration: 30 O2 QME: -6.069 MME: -3.197 (2.872) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.132 (0.565) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.139 (0.049) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.662 (0.137) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.842 (0.361) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.431 (0.427) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -1.650 (4.295) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.544 0.064 0.742} (1.714 D) Ratio: 0.95 Current objective value: 750.428012 ( En: 683.749960 Dist: 24.250000 Dipole: 42.428052 ) Current test charges: C1 -0.205 C2 -0.106 O2 -0.314 HO2 0.175 Iteration: 31 O2 QME: -6.069 MME: -3.197 (2.872) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.132 (0.565) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.139 (0.049) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.662 (0.137) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.842 (0.361) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.431 (0.427) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -1.650 (4.295) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.544 0.064 0.742} (1.714 D) Ratio: 0.95 Current objective value: 750.428012 ( En: 683.749960 Dist: 24.250000 Dipole: 42.428052 ) Current test charges: C1 -0.323 C2 0.037 O2 -0.781 HO2 0.617 Iteration: 32 O2 QME: -6.069 MME: -6.523 (-0.454) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.662 (0.035) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.654 (0.534) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.050 (0.849) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.321 (-0.117) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: 0.086 (0.944) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -11.658 (-5.713) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.929 -0.701 2.387} (2.656 D) Ratio: 1.48 Current objective value: 895.075342 ( En: 868.825342 Dist: 26.250000 Dipole: 0.000000 ) Current test charges: C1 -0.323 C2 0.037 O2 -0.781 HO2 0.617 Iteration: 33 O2 QME: -6.069 MME: -6.523 (-0.454) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.662 (0.035) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.654 (0.534) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.050 (0.849) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.321 (-0.117) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: 0.086 (0.944) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -11.658 (-5.713) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.929 -0.701 2.387} (2.656 D) Ratio: 1.48 Current objective value: 895.075342 ( En: 868.825342 Dist: 26.250000 Dipole: 0.000000 ) Current test charges: C1 -0.465 C2 0.311 O2 -0.505 HO2 0.210 Iteration: 34 O2 QME: -6.069 MME: -3.983 (2.086) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.457 (1.240) QMD: 2.737 MMDistDelta: 0.300 H12 QME: -1.188 MME: -0.688 (0.500) QMD: 2.778 MMDistDelta: 0.250 H13 QME: -0.799 MME: 0.101 (0.900) QMD: 2.751 MMDistDelta: 0.350 H21 QME: -1.204 MME: -2.337 (-1.133) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.750 (-0.893) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: -1.876 (4.069) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.802 1.581 1.073} (2.073 D) Ratio: 1.15 Current objective value: 1011.317780 ( En: 639.615198 Dist: 35.000000 Dipole: 336.702583 ) Current test charges: C1 -0.465 C2 0.311 O2 -0.505 HO2 0.210 Iteration: 35 O2 QME: -6.069 MME: -3.983 (2.086) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.457 (1.240) QMD: 2.737 MMDistDelta: 0.300 H12 QME: -1.188 MME: -0.688 (0.500) QMD: 2.778 MMDistDelta: 0.250 H13 QME: -0.799 MME: 0.101 (0.900) QMD: 2.751 MMDistDelta: 0.350 H21 QME: -1.204 MME: -2.337 (-1.133) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.750 (-0.893) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: -1.876 (4.069) QMD: 2.031 MMDistDelta: 0.250 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.802 1.581 1.073} (2.073 D) Ratio: 1.15 Current objective value: 1011.317780 ( En: 639.615198 Dist: 35.000000 Dipole: 336.702583 ) Current test charges: C1 -0.331 C2 0.065 O2 -0.481 HO2 0.297 Iteration: 36 O2 QME: -6.069 MME: -4.045 (2.024) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -0.988 (0.708) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.792 (0.396) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: -0.178 (0.621) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -1.431 (-0.227) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.710 (0.148) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -3.929 (2.016) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.006 0.363 1.256} (1.650 D) Ratio: 0.92 Current objective value: 306.448657 ( En: 232.031138 Dist: 18.750000 Dipole: 55.667520 ) Current test charges: C1 -0.037 C2 -0.452 O2 0.105 HO2 -0.066 Iteration: 37 O2 QME: -6.069 MME: -0.827 (5.242) QMD: 2.978 MMDistDelta: 0.400 H11 QME: -1.696 MME: -1.074 (0.622) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.309 (-0.121) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -1.300 (-0.501) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.203 (1.406) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.045 (0.903) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: 1.290 (7.234) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.610 -0.566 -0.314} (1.735 D) Ratio: 0.97 Current objective value: 2560.493668 ( En: 2081.568543 Dist: 68.250000 Dipole: 410.675125 ) Current test charges: C1 -0.118 C2 -0.314 O2 -0.145 HO2 0.127 Iteration: 38 O2 QME: -6.069 MME: -2.099 (3.970) QMD: 2.978 MMDistDelta: 0.300 H11 QME: -1.696 MME: -1.240 (0.456) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.118 (0.070) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.906 (-0.106) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.191 (1.013) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.059 (0.917) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -1.363 (4.582) QMD: 2.031 MMDistDelta: 0.300 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.418 -0.604 0.449} (1.605 D) Ratio: 0.89 Current objective value: 1087.639406 ( En: 970.997574 Dist: 48.500000 Dipole: 68.141833 ) Current test charges: C1 -0.158 C2 -0.245 O2 -0.271 HO2 0.223 Iteration: 39 O2 QME: -6.069 MME: -2.845 (3.224) QMD: 2.978 MMDistDelta: 0.200 H11 QME: -1.696 MME: -1.323 (0.373) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.023 (0.165) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.712 (0.088) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.400 (0.803) QMD: 2.796 MMDistDelta: 0.250 H22 QME: -0.857 MME: 0.067 (0.924) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -2.958 (2.986) QMD: 2.031 MMDistDelta: 0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.322 -0.623 0.831} (1.681 D) Ratio: 0.94 Current objective value: 607.735765 ( En: 524.680657 Dist: 34.000000 Dipole: 49.055108 ) Current test charges: C1 -0.169 C2 -0.329 O2 -0.483 HO2 0.531 Iteration: 40 O2 QME: -6.069 MME: -4.092 (1.977) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.851 (-0.154) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.610 (0.577) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.360 (0.439) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.158 (1.046) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.902 (1.759) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.659 (-4.715) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.709 -1.877 1.866} (2.740 D) Ratio: 1.52 Current objective value: 895.044648 ( En: 771.832180 Dist: 42.500000 Dipole: 80.712468 ) Current test charges: C1 -0.169 C2 -0.329 O2 -0.483 HO2 0.531 Iteration: 41 O2 QME: -6.069 MME: -4.092 (1.977) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.851 (-0.154) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.610 (0.577) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.360 (0.439) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.158 (1.046) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 0.902 (1.759) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -10.659 (-4.715) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.709 -1.877 1.866} (2.740 D) Ratio: 1.52 Current objective value: 895.044648 ( En: 771.832180 Dist: 42.500000 Dipole: 80.712468 ) Current test charges: C1 -0.179 C2 -0.266 O2 -0.435 HO2 0.430 Iteration: 42 O2 QME: -6.069 MME: -3.833 (2.236) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.648 (0.049) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.759 (0.429) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.445 (0.354) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.338 (0.866) QMD: 2.796 MMDistDelta: 0.300 H22 QME: -0.857 MME: 0.534 (1.392) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -7.766 (-1.821) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {0.945 -1.328 1.548} (2.248 D) Ratio: 1.25 Current objective value: 322.092407 ( En: 282.865822 Dist: 36.000000 Dipole: 3.226585 ) Current test charges: C1 -0.383 C2 0.288 O2 -0.705 HO2 0.351 Iteration: 43 O2 QME: -6.069 MME: -6.172 (-0.103) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.056 (0.641) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.074 (0.114) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.096 (0.703) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -2.222 (-1.018) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.298 (-0.441) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -4.027 (1.918) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.631 1.077 1.597} (2.524 D) Ratio: 1.40 Current objective value: 160.981873 ( En: 145.922597 Dist: 14.500000 Dipole: 0.559276 ) Current test charges: C1 -0.383 C2 0.288 O2 -0.705 HO2 0.351 Iteration: 44 O2 QME: -6.069 MME: -6.172 (-0.103) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.056 (0.641) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.074 (0.114) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.096 (0.703) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -2.222 (-1.018) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.298 (-0.441) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -4.027 (1.918) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.631 1.077 1.597} (2.524 D) Ratio: 1.40 Current objective value: 160.981873 ( En: 145.922597 Dist: 14.500000 Dipole: 0.559276 ) Current test charges: C1 -0.380 C2 0.202 O2 -0.838 HO2 0.566 Iteration: 45 O2 QME: -6.069 MME: -7.114 (-1.045) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.445 (0.251) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.779 (0.409) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.116 (0.916) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.902 (-0.698) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.526 (0.331) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -9.646 (-3.701) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.178 0.098 2.306} (2.591 D) Ratio: 1.44 Current objective value: 431.878266 ( En: 411.378266 Dist: 20.500000 Dipole: 0.000000 ) Current test charges: C1 -0.380 C2 0.202 O2 -0.838 HO2 0.566 Iteration: 46 O2 QME: -6.069 MME: -7.114 (-1.045) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.445 (0.251) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -0.779 (0.409) QMD: 2.778 MMDistDelta: 0.200 H13 QME: -0.799 MME: 0.116 (0.916) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -1.902 (-0.698) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.526 (0.331) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -9.646 (-3.701) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.178 0.098 2.306} (2.591 D) Ratio: 1.44 Current objective value: 431.878266 ( En: 411.378266 Dist: 20.500000 Dipole: 0.000000 ) Current test charges: C1 -0.505 C2 0.632 O2 -1.046 HO2 0.469 Iteration: 47 O2 QME: -6.069 MME: -9.488 (-3.419) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -1.061 (0.636) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.242 (-0.054) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: 0.220 (1.019) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -3.512 (-2.308) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -2.201 (-1.343) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: -5.367 (0.578) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.108 2.070 2.232} (3.703 D) Ratio: 2.06 Current objective value: 798.195101 ( En: 515.023000 Dist: 15.750000 Dipole: 267.422101 ) Current test charges: C1 -0.505 C2 0.632 O2 -0.995 HO2 0.418 Iteration: 48 O2 QME: -6.069 MME: -9.000 (-2.931) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -0.956 (0.741) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.260 (-0.072) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: 0.182 (0.982) QMD: 2.751 MMDistDelta: 0.300 H21 QME: -1.204 MME: -3.517 (-2.313) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -2.329 (-1.471) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: -4.254 (1.691) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.111 2.221 2.049} (3.687 D) Ratio: 2.05 Current objective value: 823.912305 ( En: 512.072541 Dist: 16.000000 Dipole: 295.839764 ) Current test charges: C1 -0.403 C2 0.348 O2 -0.810 HO2 0.415 Iteration: 49 O2 QME: -6.069 MME: -7.147 (-1.078) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.152 (0.545) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.096 (0.092) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.012 (0.787) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -2.439 (-1.235) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.345 (-0.488) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -5.181 (0.764) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.727 1.121 1.866} (2.779 D) Ratio: 1.55 Current objective value: 126.076655 ( En: 110.837479 Dist: 13.750000 Dipole: 1.489176 ) Current test charges: C1 -0.210 C2 -0.048 O2 -0.335 HO2 0.142 Iteration: 50 O2 QME: -6.069 MME: -3.478 (2.591) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.090 (0.607) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.286 (-0.099) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.715 (0.084) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.034 (0.170) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.676 (0.181) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -0.864 (5.081) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.812 0.392 0.667} (1.970 D) Ratio: 1.10 Current objective value: 861.252994 ( En: 824.428699 Dist: 28.750000 Dipole: 8.074295 ) Current test charges: C1 -0.210 C2 -0.048 O2 -0.335 HO2 0.142 Iteration: 51 O2 QME: -6.069 MME: -3.478 (2.591) QMD: 2.978 MMDistDelta: 0.150 H11 QME: -1.696 MME: -1.090 (0.607) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.286 (-0.099) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.715 (0.084) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.034 (0.170) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.676 (0.181) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -0.864 (5.081) QMD: 2.031 MMDistDelta: 0.400 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.812 0.392 0.667} (1.970 D) Ratio: 1.10 Current objective value: 861.252994 ( En: 824.428699 Dist: 28.750000 Dipole: 8.074295 ) Current test charges: C1 -0.258 C2 0.023 O2 -0.477 HO2 0.262 Iteration: 52 O2 QME: -6.069 MME: -4.421 (1.648) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.189 (0.507) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.139 (0.049) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.473 (0.326) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.275 (-0.071) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.633 (0.224) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -2.875 (3.070) QMD: 2.031 MMDistDelta: 0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.633 0.308 1.131} (2.010 D) Ratio: 1.12 Current objective value: 335.495364 ( En: 314.068255 Dist: 16.750000 Dipole: 4.677109 ) Current test charges: C1 -0.282 C2 0.058 O2 -0.548 HO2 0.322 Iteration: 53 O2 QME: -6.069 MME: -4.910 (1.159) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.239 (0.457) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.067 (0.121) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.355 (0.445) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.396 (-0.192) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.612 (0.246) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -4.044 (1.901) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.543 0.267 1.362} (2.076 D) Ratio: 1.15 Current objective value: 153.800817 ( En: 136.874695 Dist: 15.500000 Dipole: 1.426122 ) Current test charges: C1 -0.519 C2 0.711 O2 -0.910 HO2 0.269 Iteration: 54 O2 QME: -6.069 MME: -8.336 (-2.267) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -0.653 (1.044) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -1.445 (-0.257) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: 0.071 (0.871) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -3.844 (-2.640) QMD: 2.796 MMDistDelta: -0.100 H22 QME: -0.857 MME: -2.983 (-2.125) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: -1.031 (4.914) QMD: 2.031 MMDistDelta: 0.300 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.390 2.979 1.568} (4.129 D) Ratio: 2.30 Current objective value: 1807.918370 ( En: 1067.163147 Dist: 25.000000 Dipole: 715.755223 ) Current test charges: C1 -0.519 C2 0.711 O2 -0.910 HO2 0.269 Iteration: 55 O2 QME: -6.069 MME: -8.336 (-2.267) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -0.653 (1.044) QMD: 2.737 MMDistDelta: 0.250 H12 QME: -1.188 MME: -1.445 (-0.257) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: 0.071 (0.871) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -3.844 (-2.640) QMD: 2.796 MMDistDelta: -0.100 H22 QME: -0.857 MME: -2.983 (-2.125) QMD: 2.752 MMDistDelta: 0.000 HO2 QME: -5.945 MME: -1.031 (4.914) QMD: 2.031 MMDistDelta: 0.300 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.390 2.979 1.568} (4.129 D) Ratio: 2.30 Current objective value: 1807.918370 ( En: 1067.163147 Dist: 25.000000 Dipole: 715.755223 ) Current test charges: C1 -0.423 C2 0.435 O2 -0.776 HO2 0.315 Iteration: 56 O2 QME: -6.069 MME: -6.965 (-0.896) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -0.929 (0.768) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.251 (-0.063) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.073 (0.726) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -2.769 (-1.565) QMD: 2.796 MMDistDelta: -0.050 H22 QME: -0.857 MME: -1.884 (-1.026) QMD: 2.752 MMDistDelta: 0.050 HO2 QME: -5.945 MME: -2.707 (3.238) QMD: 2.031 MMDistDelta: 0.150 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.982 1.762 1.562} (3.077 D) Ratio: 1.71 Current objective value: 509.434639 ( En: 397.685107 Dist: 15.250000 Dipole: 96.499532 ) Current test charges: C1 -0.375 C2 0.297 O2 -0.709 HO2 0.337 Iteration: 57 O2 QME: -6.069 MME: -6.297 (-0.228) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.069 (0.628) QMD: 2.737 MMDistDelta: 0.200 H12 QME: -1.188 MME: -1.154 (0.034) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.146 (0.654) QMD: 2.751 MMDistDelta: 0.250 H21 QME: -1.204 MME: -2.253 (-1.049) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.355 (-0.498) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -3.624 (2.321) QMD: 2.031 MMDistDelta: 0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.777 1.153 1.559} (2.631 D) Ratio: 1.46 Current objective value: 206.965493 ( En: 190.227634 Dist: 14.500000 Dipole: 2.237860 ) Current test charges: C1 -0.342 C2 0.387 O2 -0.956 HO2 0.461 Iteration: 58 O2 QME: -6.069 MME: -9.135 (-3.066) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -1.540 (0.156) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.579 (-0.391) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.261 (0.538) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.560 (-1.356) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.332 (-0.475) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -5.339 (0.606) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.665 1.144 2.087} (3.573 D) Ratio: 1.99 Current objective value: 482.634276 ( En: 307.509828 Dist: 8.500000 Dipole: 166.624448 ) Current test charges: C1 -0.342 C2 0.387 O2 -0.956 HO2 0.461 Iteration: 59 O2 QME: -6.069 MME: -9.135 (-3.066) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -1.540 (0.156) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.579 (-0.391) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.261 (0.538) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.560 (-1.356) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.332 (-0.475) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -5.339 (0.606) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.665 1.144 2.087} (3.573 D) Ratio: 1.99 Current objective value: 482.634276 ( En: 307.509828 Dist: 8.500000 Dipole: 166.624448 ) Current test charges: C1 -0.339 C2 0.296 O2 -0.822 HO2 0.415 Iteration: 60 O2 QME: -6.069 MME: -7.592 (-1.523) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.382 (0.314) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.353 (-0.165) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.236 (0.563) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.235 (-1.031) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -1.153 (-0.295) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -4.923 (1.022) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.196 0.923 1.852} (3.017 D) Ratio: 1.68 Current objective value: 154.820166 ( En: 123.908011 Dist: 8.500000 Dipole: 22.412155 ) Current test charges: C1 -0.268 C2 0.085 O2 -0.711 HO2 0.444 Iteration: 61 O2 QME: -6.069 MME: -6.482 (-0.413) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.578 (0.118) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.190 (-0.002) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.343 (0.457) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.477 (-0.273) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.409 (0.448) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.395 (-0.450) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.855 0.011 1.827} (2.604 D) Ratio: 1.45 Current objective value: 33.295034 ( En: 21.795034 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.268 C2 0.085 O2 -0.711 HO2 0.444 Iteration: 62 O2 QME: -6.069 MME: -6.482 (-0.413) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.578 (0.118) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.190 (-0.002) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.343 (0.457) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.477 (-0.273) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.409 (0.448) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.395 (-0.450) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.855 0.011 1.827} (2.604 D) Ratio: 1.45 Current objective value: 33.295034 ( En: 21.795034 Dist: 11.500000 Dipole: 0.000000 ) Current test charges: C1 -0.204 C2 0.004 O2 -0.719 HO2 0.469 Iteration: 63 O2 QME: -6.069 MME: -6.788 (-0.719) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.842 (-0.146) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.355 (-0.167) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.528 (0.271) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.189 (0.015) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.093 (0.764) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.936 (-0.991) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.148 -0.380 1.883} (2.882 D) Ratio: 1.60 Current objective value: 74.185239 ( En: 55.154891 Dist: 11.500000 Dipole: 7.530348 ) Current test charges: C1 -0.204 C2 0.004 O2 -0.719 HO2 0.469 Iteration: 64 O2 QME: -6.069 MME: -6.788 (-0.719) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.842 (-0.146) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.355 (-0.167) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.528 (0.271) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.189 (0.015) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.093 (0.764) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.936 (-0.991) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.148 -0.380 1.883} (2.882 D) Ratio: 1.60 Current objective value: 74.185239 ( En: 55.154891 Dist: 11.500000 Dipole: 7.530348 ) Current test charges: C1 -0.200 C2 -0.141 O2 -0.520 HO2 0.412 Iteration: 65 O2 QME: -6.069 MME: -4.704 (1.365) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.618 (0.078) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.985 (0.203) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.470 (0.329) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.722 (0.482) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.173 (1.031) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.619 (-0.674) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.392 -0.780 1.567} (2.236 D) Ratio: 1.24 Current objective value: 123.713212 ( En: 94.213212 Dist: 29.500000 Dipole: 0.000000 ) Current test charges: C1 -0.200 C2 -0.141 O2 -0.520 HO2 0.412 Iteration: 66 O2 QME: -6.069 MME: -4.704 (1.365) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -1.618 (0.078) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -0.985 (0.203) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.470 (0.329) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -0.722 (0.482) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.173 (1.031) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.619 (-0.674) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.392 -0.780 1.567} (2.236 D) Ratio: 1.24 Current objective value: 123.713212 ( En: 94.213212 Dist: 29.500000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.076 O2 -0.863 HO2 0.573 Iteration: 67 O2 QME: -6.069 MME: -8.064 (-1.995) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.981 (-0.285) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.321 (-0.134) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.370 (0.430) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.431 (-0.228) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.081 (0.776) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -9.262 (-3.317) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.171 -0.409 2.298} (3.187 D) Ratio: 1.77 Current objective value: 464.672162 ( En: 398.050397 Dist: 14.250000 Dipole: 52.371765 ) Current test charges: C1 -0.236 C2 0.076 O2 -0.863 HO2 0.573 Iteration: 68 O2 QME: -6.069 MME: -8.064 (-1.995) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.981 (-0.285) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.321 (-0.134) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.370 (0.430) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.431 (-0.228) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.081 (0.776) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -9.262 (-3.317) QMD: 2.031 MMDistDelta: -0.100 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.171 -0.409 2.298} (3.187 D) Ratio: 1.77 Current objective value: 464.672162 ( En: 398.050397 Dist: 14.250000 Dipole: 52.371765 ) Current test charges: C1 -0.249 C2 0.071 O2 -0.774 HO2 0.502 Iteration: 69 O2 QME: -6.069 MME: -7.147 (-1.078) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.769 (-0.073) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.249 (-0.061) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.366 (0.434) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.421 (-0.217) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.229 (0.629) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -7.689 (-1.744) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.994 -0.218 2.033} (2.856 D) Ratio: 1.59 Current objective value: 141.395510 ( En: 121.095347 Dist: 14.750000 Dipole: 5.550163 ) Current test charges: C1 -0.256 C2 0.069 O2 -0.730 HO2 0.467 Iteration: 70 O2 QME: -6.069 MME: -6.688 (-0.619) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.665 (0.031) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.212 (-0.024) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.363 (0.436) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.416 (-0.212) 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: -6.915 (-0.971) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.905 -0.122 1.901} (2.694 D) Ratio: 1.50 Current objective value: 58.980763 ( En: 46.730763 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.011 C2 -0.429 O2 -0.486 HO2 0.476 Iteration: 71 O2 QME: -6.069 MME: -4.968 (1.101) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -2.356 (-0.660) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.348 (-0.160) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.009 (-0.209) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.140 (1.344) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.101 (1.958) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -8.363 (-2.418) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.013 -2.091 1.659} (3.343 D) Ratio: 1.86 Current objective value: 461.970304 ( En: 330.122529 Dist: 34.750000 Dipole: 97.097775 ) Current test charges: C1 -0.011 C2 -0.429 O2 -0.486 HO2 0.476 Iteration: 72 O2 QME: -6.069 MME: -4.968 (1.101) QMD: 2.978 MMDistDelta: 0.100 H11 QME: -1.696 MME: -2.356 (-0.660) QMD: 2.737 MMDistDelta: 0.050 H12 QME: -1.188 MME: -1.348 (-0.160) QMD: 2.778 MMDistDelta: 0.050 H13 QME: -0.799 MME: -1.009 (-0.209) QMD: 2.751 MMDistDelta: 0.100 H21 QME: -1.204 MME: 0.140 (1.344) QMD: 2.796 MMDistDelta: 0.400 H22 QME: -0.857 MME: 1.101 (1.958) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -8.363 (-2.418) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.013 -2.091 1.659} (3.343 D) Ratio: 1.86 Current objective value: 461.970304 ( En: 330.122529 Dist: 34.750000 Dipole: 97.097775 ) Current test charges: C1 -0.122 C2 -0.209 O2 -0.577 HO2 0.459 Iteration: 73 O2 QME: -6.069 MME: -5.547 (0.522) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -2.009 (-0.312) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.274 (-0.086) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.717 (0.082) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.494 (0.710) QMD: 2.796 MMDistDelta: 0.250 H22 QME: -0.857 MME: 0.471 (1.329) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -7.432 (-1.487) QMD: 2.031 MMDistDelta: -0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.932 -1.183 1.718} (2.843 D) Ratio: 1.58 Current objective value: 153.299634 ( En: 121.584714 Dist: 27.000000 Dipole: 4.714920 ) Current test charges: C1 -0.177 C2 -0.100 O2 -0.623 HO2 0.450 Iteration: 74 O2 QME: -6.069 MME: -5.850 (0.219) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.835 (-0.138) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.237 (-0.049) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.574 (0.225) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.847 (0.357) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: 0.155 (1.013) QMD: 2.752 MMDistDelta: 0.350 HO2 QME: -5.945 MME: -6.975 (-1.030) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.892 -0.729 1.747} (2.676 D) Ratio: 1.49 Current objective value: 77.361267 ( En: 58.361267 Dist: 19.000000 Dipole: 0.000000 ) Current test charges: C1 -0.264 C2 0.226 O2 -0.910 HO2 0.498 Iteration: 75 O2 QME: -6.069 MME: -8.784 (-2.715) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -1.825 (-0.128) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.600 (-0.412) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.433 (0.367) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.959 (-0.755) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.704 (0.153) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.586 (-0.641) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.680 0.404 2.131} (3.447 D) Ratio: 1.92 Current objective value: 346.723675 ( En: 217.383565 Dist: 7.000000 Dipole: 122.340111 ) Current test charges: C1 -0.264 C2 0.226 O2 -0.910 HO2 0.498 Iteration: 76 O2 QME: -6.069 MME: -8.784 (-2.715) QMD: 2.978 MMDistDelta: -0.050 H11 QME: -1.696 MME: -1.825 (-0.128) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.600 (-0.412) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.433 (0.367) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.959 (-0.755) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.704 (0.153) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.586 (-0.641) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.680 0.404 2.131} (3.447 D) Ratio: 1.92 Current objective value: 346.723675 ( En: 217.383565 Dist: 7.000000 Dipole: 122.340111 ) Current test charges: C1 -0.246 C2 0.122 O2 -0.800 HO2 0.474 Iteration: 77 O2 QME: -6.069 MME: -7.564 (-1.495) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.765 (-0.069) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.426 (-0.238) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.443 (0.357) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.597 (-0.393) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.441 (0.417) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.595 (-0.650) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.316 0.069 1.971} (3.042 D) Ratio: 1.69 Current objective value: 113.844112 ( En: 79.393765 Dist: 8.500000 Dipole: 25.950348 ) Current test charges: C1 -0.237 C2 0.070 O2 -0.745 HO2 0.461 Iteration: 78 O2 QME: -6.069 MME: -6.975 (-0.906) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.736 (-0.040) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.339 (-0.151) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.448 (0.352) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.418 (-0.214) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.313 (0.545) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.600 (-0.655) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.134 -0.098 1.892} (2.853 D) Ratio: 1.59 Current objective value: 59.371700 ( En: 43.509621 Dist: 10.500000 Dipole: 5.362079 ) Current test charges: C1 -0.322 C2 0.250 O2 -0.832 HO2 0.453 Iteration: 79 O2 QME: -6.069 MME: -7.670 (-1.601) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.500 (0.197) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.317 (-0.129) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.242 (0.558) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.063 (-0.859) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -0.908 (-0.050) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -5.951 (-0.006) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.140 0.628 1.963} (2.972 D) Ratio: 1.65 Current objective value: 116.439122 ( En: 91.704274 Dist: 8.250000 Dipole: 16.484847 ) Current test charges: C1 -0.322 C2 0.250 O2 -0.832 HO2 0.453 Iteration: 80 O2 QME: -6.069 MME: -7.670 (-1.601) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.500 (0.197) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.317 (-0.129) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.242 (0.558) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -2.063 (-0.859) QMD: 2.796 MMDistDelta: 0.000 H22 QME: -0.857 MME: -0.908 (-0.050) QMD: 2.752 MMDistDelta: 0.100 HO2 QME: -5.945 MME: -5.951 (-0.006) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.140 0.628 1.963} (2.972 D) Ratio: 1.65 Current objective value: 116.439122 ( En: 91.704274 Dist: 8.250000 Dipole: 16.484847 ) Current test charges: C1 -0.281 C2 0.151 O2 -0.773 HO2 0.452 Iteration: 81 O2 QME: -6.069 MME: -7.144 (-1.075) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.594 (0.103) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.294 (-0.106) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.335 (0.465) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.708 (-0.504) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.591 (0.267) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -6.240 (-0.295) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.070 0.245 1.902} (2.822 D) Ratio: 1.57 Current objective value: 58.339851 ( En: 45.141075 Dist: 9.750000 Dipole: 3.448776 ) Current test charges: C1 -0.322 C2 0.183 O2 -0.732 HO2 0.421 Iteration: 82 O2 QME: -6.069 MME: -6.563 (-0.494) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.377 (0.319) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.139 (0.049) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.214 (0.585) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.830 (-0.626) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.780 (0.078) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.681 (0.264) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.771 0.462 1.794} (2.563 D) Ratio: 1.43 Current objective value: 39.973134 ( En: 28.973134 Dist: 11.000000 Dipole: 0.000000 ) Current test charges: C1 -0.322 C2 0.183 O2 -0.732 HO2 0.421 Iteration: 83 O2 QME: -6.069 MME: -6.563 (-0.494) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.377 (0.319) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.139 (0.049) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.214 (0.585) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.830 (-0.626) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.780 (0.078) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.681 (0.264) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.771 0.462 1.794} (2.563 D) Ratio: 1.43 Current objective value: 39.973134 ( En: 28.973134 Dist: 11.000000 Dipole: 0.000000 ) Current test charges: C1 -0.318 C2 0.149 O2 -0.693 HO2 0.412 Iteration: 84 O2 QME: -6.069 MME: -6.135 (-0.066) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.347 (0.350) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.069 (0.119) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.208 (0.591) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.711 (-0.507) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.693 (0.164) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.695 (0.250) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.624 0.353 1.739} (2.405 D) Ratio: 1.34 Current objective value: 32.165174 ( En: 20.915174 Dist: 11.250000 Dipole: 0.000000 ) Current test charges: C1 -0.318 C2 0.149 O2 -0.693 HO2 0.412 Iteration: 85 O2 QME: -6.069 MME: -6.135 (-0.066) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.347 (0.350) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.069 (0.119) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.208 (0.591) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.711 (-0.507) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.693 (0.164) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.695 (0.250) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.624 0.353 1.739} (2.405 D) Ratio: 1.34 Current objective value: 32.165174 ( En: 20.915174 Dist: 11.250000 Dipole: 0.000000 ) Current test charges: C1 -0.322 C2 0.188 O2 -0.696 HO2 0.380 Iteration: 86 O2 QME: -6.069 MME: -6.245 (-0.176) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.293 (0.404) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.163 (0.025) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.246 (0.554) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.850 (-0.646) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.889 (-0.032) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -4.761 (1.183) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.792 0.603 1.652} (2.510 D) Ratio: 1.40 Current objective value: 69.249254 ( En: 57.999254 Dist: 11.250000 Dipole: 0.000000 ) Current test charges: C1 -0.322 C2 0.188 O2 -0.696 HO2 0.380 Iteration: 87 O2 QME: -6.069 MME: -6.245 (-0.176) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.293 (0.404) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.163 (0.025) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.246 (0.554) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.850 (-0.646) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.889 (-0.032) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -4.761 (1.183) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.792 0.603 1.652} (2.510 D) Ratio: 1.40 Current objective value: 69.249254 ( En: 57.999254 Dist: 11.250000 Dipole: 0.000000 ) Current test charges: C1 -0.303 C2 0.154 O2 -0.705 HO2 0.404 Iteration: 88 O2 QME: -6.069 MME: -6.370 (-0.301) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.398 (0.298) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.176 (0.012) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.279 (0.520) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.727 (-0.523) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.721 (0.136) QMD: 2.752 MMDistDelta: 0.150 HO2 QME: -5.945 MME: -5.345 (0.600) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.824 0.398 1.722} (2.540 D) Ratio: 1.41 Current objective value: 38.827341 ( En: 27.577341 Dist: 11.250000 Dipole: 0.000000 ) Current test charges: C1 -0.300 C2 0.082 O2 -0.608 HO2 0.376 Iteration: 89 O2 QME: -6.069 MME: -5.355 (0.714) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.296 (0.401) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.004 (0.184) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.257 (0.542) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.478 (-0.274) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.566 (0.292) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.205 (0.739) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.463 0.196 1.568} (2.154 D) Ratio: 1.20 Current objective value: 55.890897 ( En: 42.638857 Dist: 13.250000 Dipole: 0.002040 ) Current test charges: C1 -0.300 C2 0.082 O2 -0.608 HO2 0.376 Iteration: 90 O2 QME: -6.069 MME: -5.355 (0.714) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.296 (0.401) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.004 (0.184) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.257 (0.542) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.478 (-0.274) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.566 (0.292) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.205 (0.739) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.463 0.196 1.568} (2.154 D) Ratio: 1.20 Current objective value: 55.890897 ( En: 42.638857 Dist: 13.250000 Dipole: 0.002040 ) Current test charges: C1 -0.295 C2 0.102 O2 -0.655 HO2 0.398 Iteration: 91 O2 QME: -6.069 MME: -5.846 (0.223) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.380 (0.317) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.085 (0.103) QMD: 2.778 MMDistDelta: 0.150 H13 QME: -0.799 MME: -0.279 (0.520) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.543 (-0.339) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.572 (0.285) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.486 (0.459) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.635 0.210 1.662} (2.341 D) Ratio: 1.30 Current objective value: 33.949593 ( En: 20.949593 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.003 O2 -0.626 HO2 0.407 Iteration: 92 O2 QME: -6.069 MME: -5.750 (0.319) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.578 (0.118) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.179 (0.009) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.444 (0.355) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.196 (0.008) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.239 (0.618) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.827 (0.118) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.789 -0.202 1.647} (2.440 D) Ratio: 1.36 Current objective value: 30.704463 ( En: 15.954463 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.003 O2 -0.626 HO2 0.407 Iteration: 93 O2 QME: -6.069 MME: -5.750 (0.319) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.578 (0.118) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.179 (0.009) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.444 (0.355) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.196 (0.008) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.239 (0.618) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.827 (0.118) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.789 -0.202 1.647} (2.440 D) Ratio: 1.36 Current objective value: 30.704463 ( En: 15.954463 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.227 C2 -0.029 O2 -0.624 HO2 0.430 Iteration: 94 O2 QME: -6.069 MME: -5.700 (0.369) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.634 (0.062) 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: -0.436 (0.364) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.086 (0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.096 (0.761) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.488 (-0.543) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.705 -0.395 1.706} (2.444 D) Ratio: 1.36 Current objective value: 43.851275 ( En: 29.101275 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.227 C2 -0.029 O2 -0.624 HO2 0.430 Iteration: 95 O2 QME: -6.069 MME: -5.700 (0.369) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.634 (0.062) 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: -0.436 (0.364) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.086 (0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.096 (0.761) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.488 (-0.543) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.705 -0.395 1.706} (2.444 D) Ratio: 1.36 Current objective value: 43.851275 ( En: 29.101275 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.248 C2 0.023 O2 -0.647 HO2 0.423 Iteration: 96 O2 QME: -6.069 MME: -5.888 (0.181) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.567 (0.129) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.143 (0.045) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.391 (0.408) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.264 (-0.060) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.267 (0.591) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.164 (-0.219) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.739 -0.171 1.711} (2.445 D) Ratio: 1.36 Current objective value: 30.213195 ( En: 15.463195 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.217 C2 0.003 O2 -0.686 HO2 0.450 Iteration: 97 O2 QME: -6.069 MME: -6.392 (-0.323) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.744 (-0.048) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.279 (-0.091) 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: -1.190 (0.014) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.139 (0.718) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.614 (-0.669) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.999 -0.326 1.807} (2.714 D) Ratio: 1.51 Current objective value: 42.468322 ( En: 29.398592 Dist: 13.000000 Dipole: 0.069730 ) Current test charges: C1 -0.217 C2 0.003 O2 -0.686 HO2 0.450 Iteration: 98 O2 QME: -6.069 MME: -6.392 (-0.323) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.744 (-0.048) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.279 (-0.091) 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: -1.190 (0.014) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.139 (0.718) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.614 (-0.669) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.999 -0.326 1.807} (2.714 D) Ratio: 1.51 Current objective value: 42.468322 ( En: 29.398592 Dist: 13.000000 Dipole: 0.069730 ) Current test charges: C1 -0.239 C2 0.031 O2 -0.677 HO2 0.435 Iteration: 99 O2 QME: -6.069 MME: -6.238 (-0.169) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.641 (0.055) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.224 (-0.036) 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: -1.289 (-0.085) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.259 (0.598) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.295 (-0.351) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.896 -0.175 1.766} (2.597 D) Ratio: 1.44 Current objective value: 31.219262 ( En: 16.469262 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 -0.001 O2 -0.597 HO2 0.386 Iteration: 100 O2 QME: -6.069 MME: -5.471 (0.598) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.515 (0.181) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.155 (0.033) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.444 (0.355) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.185 (0.019) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.278 (0.580) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.392 (0.553) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.731 -0.152 1.565} (2.338 D) Ratio: 1.30 Current objective value: 43.986171 ( En: 28.986171 Dist: 15.000000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 -0.001 O2 -0.597 HO2 0.386 Iteration: 101 O2 QME: -6.069 MME: -5.471 (0.598) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.515 (0.181) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.155 (0.033) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.444 (0.355) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.185 (0.019) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.278 (0.580) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.392 (0.553) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.731 -0.152 1.565} (2.338 D) Ratio: 1.30 Current objective value: 43.986171 ( En: 28.986171 Dist: 15.000000 Dipole: 0.000000 ) Current test charges: C1 -0.246 C2 0.024 O2 -0.629 HO2 0.402 Iteration: 102 O2 QME: -6.069 MME: -5.754 (0.315) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.533 (0.163) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.165 (0.023) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.416 (0.384) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.267 (-0.063) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.314 (0.544) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.671 (0.274) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.766 -0.106 1.639} (2.411 D) Ratio: 1.34 Current objective value: 28.709725 ( En: 16.209725 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.140 C2 -0.141 O2 -0.592 HO2 0.423 Iteration: 103 O2 QME: -6.069 MME: -5.734 (0.335) 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: -1.365 (-0.177) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.722 (0.077) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.708 (0.496) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.219 (1.077) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.285 (-0.340) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.097 -0.808 1.633} (2.778 D) Ratio: 1.55 Current objective value: 68.839088 ( En: 42.868361 Dist: 24.500000 Dipole: 1.470727 ) Current test charges: C1 -0.140 C2 -0.141 O2 -0.592 HO2 0.423 Iteration: 104 O2 QME: -6.069 MME: -5.734 (0.335) 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: -1.365 (-0.177) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.722 (0.077) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.708 (0.496) QMD: 2.796 MMDistDelta: 0.200 H22 QME: -0.857 MME: 0.219 (1.077) QMD: 2.752 MMDistDelta: 0.400 HO2 QME: -5.945 MME: -6.285 (-0.340) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.097 -0.808 1.633} (2.778 D) Ratio: 1.55 Current objective value: 68.839088 ( En: 42.868361 Dist: 24.500000 Dipole: 1.470727 ) Current test charges: C1 -0.190 C2 -0.059 O2 -0.620 HO2 0.420 Iteration: 105 O2 QME: -6.069 MME: -5.847 (0.222) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.746 (-0.049) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.280 (-0.092) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.575 (0.225) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -0.981 (0.223) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.022 (0.836) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.118 (-0.174) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.963 -0.480 1.663} (2.617 D) Ratio: 1.46 Current objective value: 37.975132 ( En: 22.225132 Dist: 15.750000 Dipole: 0.000000 ) Current test charges: C1 -0.216 C2 -0.018 O2 -0.634 HO2 0.418 Iteration: 106 O2 QME: -6.069 MME: -5.904 (0.165) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.666 (0.030) 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: -0.501 (0.299) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.120 (0.084) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.148 (0.709) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.035 (-0.090) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.896 -0.316 1.678} (2.552 D) Ratio: 1.42 Current objective value: 28.957839 ( En: 15.957839 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.232 C2 -0.010 O2 -0.592 HO2 0.385 Iteration: 107 O2 QME: -6.069 MME: -5.446 (0.623) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.531 (0.166) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.164 (0.024) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.461 (0.339) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.152 (0.052) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.250 (0.607) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.391 (0.554) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.744 -0.188 1.557} (2.346 D) Ratio: 1.31 Current objective value: 45.219861 ( En: 30.219861 Dist: 15.000000 Dipole: 0.000000 ) Current test charges: C1 -0.232 C2 -0.010 O2 -0.592 HO2 0.385 Iteration: 108 O2 QME: -6.069 MME: -5.446 (0.623) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.531 (0.166) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.164 (0.024) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.461 (0.339) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.152 (0.052) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.250 (0.607) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.391 (0.554) QMD: 2.031 MMDistDelta: 0.050 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.744 -0.188 1.557} (2.346 D) Ratio: 1.31 Current objective value: 45.219861 ( En: 30.219861 Dist: 15.000000 Dipole: 0.000000 ) Current test charges: C1 -0.234 C2 0.001 O2 -0.616 HO2 0.399 Iteration: 109 O2 QME: -6.069 MME: -5.670 (0.399) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.562 (0.135) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.181 (0.007) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.452 (0.348) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.191 (0.013) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.253 (0.605) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.642 (0.302) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.787 -0.184 1.616} (2.416 D) Ratio: 1.34 Current objective value: 33.648337 ( En: 18.898337 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.007 O2 -0.628 HO2 0.406 Iteration: 110 O2 QME: -6.069 MME: -5.782 (0.287) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.577 (0.119) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.189 (-0.001) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.447 (0.352) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.210 (-0.006) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.254 (0.604) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.771 (0.174) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.808 -0.182 1.646} (2.452 D) Ratio: 1.36 Current objective value: 30.136202 ( En: 15.386202 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.028 O2 -0.660 HO2 0.420 Iteration: 111 O2 QME: -6.069 MME: -6.094 (-0.025) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.085) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.226 (-0.038) 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: -1.279 (-0.075) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.283 (0.575) QMD: 2.752 MMDistDelta: 0.250 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: {1.891 -0.142 1.711} (2.554 D) Ratio: 1.42 Current objective value: 26.601719 ( En: 11.851719 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.028 O2 -0.660 HO2 0.420 Iteration: 112 O2 QME: -6.069 MME: -6.094 (-0.025) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.085) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.226 (-0.038) 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: -1.279 (-0.075) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.283 (0.575) QMD: 2.752 MMDistDelta: 0.250 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: {1.891 -0.142 1.711} (2.554 D) Ratio: 1.42 Current objective value: 26.601719 ( En: 11.851719 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.215 C2 0.005 O2 -0.639 HO2 0.399 Iteration: 113 O2 QME: -6.069 MME: -6.011 (0.058) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.647 (0.050) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.311 (-0.123) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.535 (0.264) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.198 (0.006) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.254 (0.604) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.440 (0.505) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.027 -0.170 1.628} (2.605 D) Ratio: 1.45 Current objective value: 30.746404 ( En: 17.746404 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.215 C2 0.005 O2 -0.639 HO2 0.399 Iteration: 114 O2 QME: -6.069 MME: -6.011 (0.058) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.647 (0.050) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.311 (-0.123) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.535 (0.264) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.198 (0.006) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.254 (0.604) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.440 (0.505) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.027 -0.170 1.628} (2.605 D) Ratio: 1.45 Current objective value: 30.746404 ( En: 17.746404 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.225 C2 0.010 O2 -0.641 HO2 0.406 Iteration: 115 O2 QME: -6.069 MME: -5.976 (0.093) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.624 (0.072) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.264 (-0.076) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.494 (0.306) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.216 (-0.012) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.257 (0.600) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.645 (0.300) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.945 -0.170 1.652} (2.558 D) Ratio: 1.42 Current objective value: 27.076103 ( En: 14.076103 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.026 O2 -0.669 HO2 0.421 Iteration: 116 O2 QME: -6.069 MME: -6.238 (-0.169) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.655 (0.042) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.286 (-0.098) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.483 (0.317) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.271 (-0.067) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.273 (0.585) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.893 (0.051) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.999 -0.150 1.716} (2.639 D) Ratio: 1.47 Current objective value: 25.237573 ( En: 12.237573 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.026 O2 -0.669 HO2 0.421 Iteration: 117 O2 QME: -6.069 MME: -6.238 (-0.169) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.655 (0.042) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.286 (-0.098) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.483 (0.317) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.271 (-0.067) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.273 (0.585) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.893 (0.051) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.999 -0.150 1.716} (2.639 D) Ratio: 1.47 Current objective value: 25.237573 ( En: 12.237573 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.259 C2 0.080 O2 -0.677 HO2 0.406 Iteration: 118 O2 QME: -6.069 MME: -6.233 (-0.164) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.534 (0.162) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.405 (0.394) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.457 (-0.253) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.473 (0.384) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.485 (0.460) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.932 0.101 1.691} (2.570 D) Ratio: 1.43 Current objective value: 27.618787 ( En: 15.868787 Dist: 11.750000 Dipole: 0.000000 ) Current test charges: C1 -0.259 C2 0.080 O2 -0.677 HO2 0.406 Iteration: 119 O2 QME: -6.069 MME: -6.233 (-0.164) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.534 (0.162) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.057) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.405 (0.394) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.457 (-0.253) QMD: 2.796 MMDistDelta: 0.050 H22 QME: -0.857 MME: -0.473 (0.384) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.485 (0.460) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.932 0.101 1.691} (2.570 D) Ratio: 1.43 Current objective value: 27.618787 ( En: 15.868787 Dist: 11.750000 Dipole: 0.000000 ) Current test charges: C1 -0.224 C2 0.051 O2 -0.706 HO2 0.429 Iteration: 120 O2 QME: -6.069 MME: -6.664 (-0.595) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.708 (-0.011) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.377 (-0.189) 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: -1.352 (-0.148) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.324 (0.534) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.872 (0.072) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.178 -0.076 1.766} (2.805 D) Ratio: 1.56 Current objective value: 32.713746 ( En: 19.614202 Dist: 10.500000 Dipole: 2.599544 ) Current test charges: C1 -0.224 C2 0.051 O2 -0.706 HO2 0.429 Iteration: 121 O2 QME: -6.069 MME: -6.664 (-0.595) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.708 (-0.011) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.377 (-0.189) 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: -1.352 (-0.148) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.324 (0.534) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.872 (0.072) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.178 -0.076 1.766} (2.805 D) Ratio: 1.56 Current objective value: 32.713746 ( En: 19.614202 Dist: 10.500000 Dipole: 2.599544 ) Current test charges: C1 -0.231 C2 0.043 O2 -0.684 HO2 0.421 Iteration: 122 O2 QME: -6.069 MME: -6.396 (-0.327) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.658 (0.038) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.317 (-0.129) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.485 (0.315) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.328 (-0.124) 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: -5.816 (0.129) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.062 -0.085 1.730} (2.693 D) Ratio: 1.50 Current objective value: 24.106942 ( En: 13.606942 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.195 C2 -0.038 O2 -0.647 HO2 0.431 Iteration: 123 O2 QME: -6.069 MME: -6.100 (-0.031) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.765 (-0.069) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.305 (-0.117) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.563 (0.237) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.048 (0.156) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.057 (0.801) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.266 (-0.322) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.022 -0.431 1.716} (2.687 D) Ratio: 1.49 Current objective value: 36.868284 ( En: 21.118284 Dist: 15.750000 Dipole: 0.000000 ) Current test charges: C1 -0.195 C2 -0.038 O2 -0.647 HO2 0.431 Iteration: 124 O2 QME: -6.069 MME: -6.100 (-0.031) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.765 (-0.069) QMD: 2.737 MMDistDelta: 0.100 H12 QME: -1.188 MME: -1.305 (-0.117) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.563 (0.237) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.048 (0.156) QMD: 2.796 MMDistDelta: 0.150 H22 QME: -0.857 MME: -0.057 (0.801) QMD: 2.752 MMDistDelta: 0.300 HO2 QME: -5.945 MME: -6.266 (-0.322) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.022 -0.431 1.716} (2.687 D) Ratio: 1.49 Current objective value: 36.868284 ( En: 21.118284 Dist: 15.750000 Dipole: 0.000000 ) Current test charges: C1 -0.213 C2 -0.005 O2 -0.656 HO2 0.424 Iteration: 125 O2 QME: -6.069 MME: -6.138 (-0.069) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.699 (-0.002) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.288 (-0.100) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.518 (0.282) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.163 (0.041) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.172 (0.686) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -6.046 (-0.101) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.996 -0.281 1.709} (2.643 D) Ratio: 1.47 Current objective value: 27.409581 ( En: 14.409581 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.222 C2 0.012 O2 -0.660 HO2 0.420 Iteration: 126 O2 QME: -6.069 MME: -6.157 (-0.088) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.666 (0.030) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.280 (-0.092) 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: -1.221 (-0.017) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.230 (0.628) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.935 (0.010) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.984 -0.206 1.705} (2.624 D) Ratio: 1.46 Current objective value: 25.596878 ( En: 12.596878 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.053 O2 -0.702 HO2 0.438 Iteration: 127 O2 QME: -6.069 MME: -6.527 (-0.458) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.666 (0.030) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.288 (-0.101) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.446 (0.354) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.362 (-0.158) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.316 (0.541) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.192 (-0.247) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.022 -0.095 1.792} (2.704 D) Ratio: 1.50 Current objective value: 28.635546 ( En: 18.121744 Dist: 10.500000 Dipole: 0.013802 ) Current test charges: C1 -0.238 C2 0.053 O2 -0.702 HO2 0.438 Iteration: 128 O2 QME: -6.069 MME: -6.527 (-0.458) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.666 (0.030) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.288 (-0.101) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.446 (0.354) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.362 (-0.158) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.316 (0.541) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.192 (-0.247) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.022 -0.095 1.792} (2.704 D) Ratio: 1.50 Current objective value: 28.635546 ( En: 18.121744 Dist: 10.500000 Dipole: 0.013802 ) Current test charges: C1 -0.235 C2 0.041 O2 -0.685 HO2 0.429 Iteration: 129 O2 QME: -6.069 MME: -6.364 (-0.296) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.654 (0.042) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.281 (-0.094) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.340) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.321 (-0.117) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.299 (0.558) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -6.038 (-0.093) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.001 -0.116 1.752} (2.662 D) Ratio: 1.48 Current objective value: 24.437425 ( En: 13.687425 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.220 C2 0.035 O2 -0.689 HO2 0.423 Iteration: 130 O2 QME: -6.069 MME: -6.493 (-0.424) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.702 (-0.005) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.362 (-0.174) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.524 (0.276) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.299 (-0.095) 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: -5.802 (0.143) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.143 -0.120 1.734} (2.760 D) Ratio: 1.54 Current objective value: 29.579280 ( En: 15.946315 Dist: 12.750000 Dipole: 0.882965 ) Current test charges: C1 -0.220 C2 0.035 O2 -0.689 HO2 0.423 Iteration: 131 O2 QME: -6.069 MME: -6.493 (-0.424) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.702 (-0.005) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.362 (-0.174) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.524 (0.276) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.299 (-0.095) 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: -5.802 (0.143) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.143 -0.120 1.734} (2.760 D) Ratio: 1.54 Current objective value: 29.579280 ( En: 15.946315 Dist: 12.750000 Dipole: 0.882965 ) Current test charges: C1 -0.225 C2 0.033 O2 -0.681 HO2 0.422 Iteration: 132 O2 QME: -6.069 MME: -6.377 (-0.308) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.676 (0.020) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.324 (-0.136) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.500 (0.299) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.293 (-0.090) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.288 (0.570) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.849 (0.095) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.072 -0.126 1.728} (2.701 D) Ratio: 1.50 Current objective value: 26.628803 ( En: 13.623628 Dist: 13.000000 Dipole: 0.005175 ) Current test charges: C1 -0.227 C2 0.032 O2 -0.677 HO2 0.422 Iteration: 133 O2 QME: -6.069 MME: -6.321 (-0.252) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.664 (0.033) 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: -0.488 (0.311) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.291 (-0.087) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.287 (0.571) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.873 (0.072) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.036 -0.129 1.724} (2.671 D) Ratio: 1.49 Current objective value: 25.836474 ( En: 12.836474 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.229 C2 0.032 O2 -0.675 HO2 0.422 Iteration: 134 O2 QME: -6.069 MME: -6.293 (-0.224) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.657 (0.039) 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: -0.482 (0.317) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.289 (-0.085) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.286 (0.571) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.885 (0.060) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.019 -0.131 1.723} (2.657 D) Ratio: 1.48 Current objective value: 25.524006 ( En: 12.524006 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.243 C2 0.066 O2 -0.696 HO2 0.423 Iteration: 135 O2 QME: -6.069 MME: -6.477 (-0.408) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.626 (0.070) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.300 (-0.112) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.406 (-0.203) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.388 (0.470) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.823 (0.122) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.039 -0.003 1.749} (2.686 D) Ratio: 1.49 Current objective value: 25.107815 ( En: 14.607815 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.243 C2 0.066 O2 -0.696 HO2 0.423 Iteration: 136 O2 QME: -6.069 MME: -6.477 (-0.408) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.626 (0.070) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.300 (-0.112) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.406 (-0.203) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.388 (0.470) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.823 (0.122) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.039 -0.003 1.749} (2.686 D) Ratio: 1.49 Current objective value: 25.107815 ( En: 14.607815 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.055 O2 -0.687 HO2 0.423 Iteration: 137 O2 QME: -6.069 MME: -6.374 (-0.305) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.624 (0.072) 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: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.371 (-0.168) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.359 (0.499) QMD: 2.752 MMDistDelta: 0.200 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: {2.003 -0.041 1.739} (2.653 D) Ratio: 1.48 Current objective value: 25.135570 ( En: 12.885570 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.055 O2 -0.687 HO2 0.423 Iteration: 138 O2 QME: -6.069 MME: -6.374 (-0.305) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.624 (0.072) 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: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.371 (-0.168) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.359 (0.499) QMD: 2.752 MMDistDelta: 0.200 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: {2.003 -0.041 1.739} (2.653 D) Ratio: 1.48 Current objective value: 25.135570 ( En: 12.885570 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.249 C2 0.076 O2 -0.702 HO2 0.425 Iteration: 139 O2 QME: -6.069 MME: -6.517 (-0.448) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.613 (0.083) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.293 (-0.105) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.430 (0.369) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.442 (-0.238) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.417 (0.440) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.834 (0.111) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.029 0.033 1.759} (2.686 D) Ratio: 1.49 Current objective value: 27.695892 ( En: 15.445892 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.249 C2 0.076 O2 -0.702 HO2 0.425 Iteration: 140 O2 QME: -6.069 MME: -6.517 (-0.448) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.613 (0.083) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.293 (-0.105) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.430 (0.369) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.442 (-0.238) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.417 (0.440) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.834 (0.111) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.029 0.033 1.759} (2.686 D) Ratio: 1.49 Current objective value: 27.695892 ( En: 15.445892 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.243 C2 0.062 O2 -0.693 HO2 0.424 Iteration: 141 O2 QME: -6.069 MME: -6.436 (-0.367) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.625 (0.072) 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: -0.445 (0.355) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.393 (-0.190) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.376 (0.481) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.851 (0.094) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.021 -0.018 1.747} (2.671 D) Ratio: 1.49 Current objective value: 26.057628 ( En: 13.807628 Dist: 12.250000 Dipole: 0.000000 ) Current test charges: C1 -0.240 C2 0.055 O2 -0.688 HO2 0.423 Iteration: 142 O2 QME: -6.069 MME: -6.395 (-0.326) QMD: 2.978 MMDistDelta: 0.000 H11 QME: -1.696 MME: -1.631 (0.066) 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: -0.452 (0.347) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.369 (-0.165) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.356 (0.502) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.859 (0.086) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.017 -0.044 1.741} (2.664 D) Ratio: 1.48 Current objective value: 23.699368 ( En: 13.199368 Dist: 10.500000 Dipole: 0.000000 ) Current test charges: C1 -0.231 C2 0.038 O2 -0.680 HO2 0.422 Iteration: 143 O2 QME: -6.069 MME: -6.341 (-0.272) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.656 (0.041) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.301 (-0.113) 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: -1.310 (-0.106) 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: -5.876 (0.069) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.031 -0.109 1.729} (2.670 D) Ratio: 1.49 Current objective value: 23.611224 ( En: 12.861224 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.231 C2 0.038 O2 -0.680 HO2 0.422 Iteration: 144 O2 QME: -6.069 MME: -6.341 (-0.272) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.656 (0.041) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.301 (-0.113) 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: -1.310 (-0.106) 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: -5.876 (0.069) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.031 -0.109 1.729} (2.670 D) Ratio: 1.49 Current objective value: 23.611224 ( En: 12.861224 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.222 C2 0.011 O2 -0.660 HO2 0.421 Iteration: 145 O2 QME: -6.069 MME: -6.156 (-0.087) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.667 (0.030) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.278 (-0.090) 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: -1.220 (-0.016) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.228 (0.629) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.949 (-0.004) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.208 1.707} (2.623 D) Ratio: 1.46 Current objective value: 25.654332 ( En: 12.654332 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.222 C2 0.011 O2 -0.660 HO2 0.421 Iteration: 146 O2 QME: -6.069 MME: -6.156 (-0.087) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.667 (0.030) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.278 (-0.090) 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: -1.220 (-0.016) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.228 (0.629) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.949 (-0.004) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.981 -0.208 1.707} (2.623 D) Ratio: 1.46 Current objective value: 25.654332 ( En: 12.654332 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.228 C2 0.027 O2 -0.670 HO2 0.422 Iteration: 147 O2 QME: -6.069 MME: -6.245 (-0.176) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.655 (0.041) 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: -0.481 (0.319) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.273 (-0.069) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.272 (0.585) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.914 (0.031) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.997 -0.150 1.719} (2.639 D) Ratio: 1.47 Current objective value: 25.288924 ( En: 12.288924 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.231 C2 0.034 O2 -0.675 HO2 0.422 Iteration: 148 O2 QME: -6.069 MME: -6.289 (-0.220) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.650 (0.047) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.287 (-0.099) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.474 (0.325) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.299 (-0.095) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.294 (0.563) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.896 (0.049) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.005 -0.121 1.725} (2.648 D) Ratio: 1.47 Current objective value: 25.372948 ( En: 12.372948 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.038 O2 -0.678 HO2 0.422 Iteration: 149 O2 QME: -6.069 MME: -6.311 (-0.242) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.647 (0.050) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.289 (-0.101) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.471 (0.329) 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: -0.306 (0.552) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.887 (0.058) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.010 -0.106 1.728} (2.652 D) Ratio: 1.48 Current objective value: 23.221831 ( En: 12.471831 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.043 O2 -0.671 HO2 0.411 Iteration: 150 O2 QME: -6.069 MME: -6.269 (-0.200) 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: -1.306 (-0.118) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.483 (0.316) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.328 (-0.124) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.344 (0.514) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.601 (0.344) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.035 -0.056 1.691} (2.646 D) Ratio: 1.47 Current objective value: 24.647504 ( En: 13.897504 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.043 O2 -0.671 HO2 0.411 Iteration: 151 O2 QME: -6.069 MME: -6.269 (-0.200) 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: -1.306 (-0.118) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.483 (0.316) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.328 (-0.124) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.344 (0.514) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.601 (0.344) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.035 -0.056 1.691} (2.646 D) Ratio: 1.47 Current objective value: 24.647504 ( En: 13.897504 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.042 O2 -0.675 HO2 0.416 Iteration: 152 O2 QME: -6.069 MME: -6.296 (-0.227) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.635 (0.062) 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: -0.476 (0.323) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.326 (-0.122) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.331 (0.526) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.724 (0.220) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {2.025 -0.073 1.709} (2.651 D) Ratio: 1.47 Current objective value: 23.555489 ( En: 12.805489 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.039 O2 -0.668 HO2 0.418 Iteration: 153 O2 QME: -6.069 MME: -6.182 (-0.113) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.611 (0.086) 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: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.316 (-0.112) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.320 (0.537) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.848 (0.097) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.938 -0.092 1.710} (2.587 D) Ratio: 1.44 Current objective value: 23.975855 ( En: 11.475855 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.239 C2 0.039 O2 -0.668 HO2 0.418 Iteration: 154 O2 QME: -6.069 MME: -6.182 (-0.113) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.611 (0.086) 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: -0.447 (0.353) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.316 (-0.112) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.320 (0.537) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.848 (0.097) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.938 -0.092 1.710} (2.587 D) Ratio: 1.44 Current objective value: 23.975855 ( En: 11.475855 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.237 C2 0.040 O2 -0.672 HO2 0.419 Iteration: 155 O2 QME: -6.069 MME: -6.242 (-0.173) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.624 (0.072) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.270 (-0.082) 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: -1.320 (-0.116) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.321 (0.537) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.839 (0.106) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.973 -0.090 1.716} (2.616 D) Ratio: 1.46 Current objective value: 22.553393 ( En: 11.803393 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.225 C2 0.017 O2 -0.656 HO2 0.414 Iteration: 156 O2 QME: -6.069 MME: -6.115 (-0.046) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.644 (0.053) 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: -0.491 (0.309) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.240 (-0.036) 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: -5.782 (0.163) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.977 -0.165 1.685} (2.603 D) Ratio: 1.45 Current objective value: 25.305901 ( En: 12.305901 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.225 C2 0.017 O2 -0.656 HO2 0.414 Iteration: 157 O2 QME: -6.069 MME: -6.115 (-0.046) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.644 (0.053) 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: -0.491 (0.309) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.240 (-0.036) 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: -5.782 (0.163) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.977 -0.165 1.685} (2.603 D) Ratio: 1.45 Current objective value: 25.305901 ( En: 12.305901 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.230 C2 0.028 O2 -0.665 HO2 0.417 Iteration: 158 O2 QME: -6.069 MME: -6.194 (-0.125) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.640 (0.056) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.281 (-0.093) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.480 (0.320) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.277 (-0.073) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.287 (0.571) QMD: 2.752 MMDistDelta: 0.250 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: {1.988 -0.131 1.701} (2.620 D) Ratio: 1.46 Current objective value: 25.009196 ( En: 12.009196 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.232 C2 0.033 O2 -0.669 HO2 0.418 Iteration: 159 O2 QME: -6.069 MME: -6.233 (-0.164) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.638 (0.058) 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: -0.474 (0.325) 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: -0.300 (0.557) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.814 (0.130) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.994 -0.114 1.709} (2.628 D) Ratio: 1.46 Current objective value: 22.775363 ( En: 12.025363 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.037 O2 -0.662 HO2 0.413 Iteration: 160 O2 QME: -6.069 MME: -6.134 (-0.065) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.603 (0.094) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.255 (-0.067) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.454 (0.346) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.311 (-0.107) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.327 (0.531) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.731 (0.214) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.941 -0.083 1.691} (2.575 D) Ratio: 1.43 Current objective value: 24.400738 ( En: 11.900738 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.037 O2 -0.662 HO2 0.413 Iteration: 161 O2 QME: -6.069 MME: -6.134 (-0.065) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.603 (0.094) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.255 (-0.067) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.454 (0.346) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.311 (-0.107) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.327 (0.531) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.731 (0.214) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.941 -0.083 1.691} (2.575 D) Ratio: 1.43 Current objective value: 24.400738 ( En: 11.900738 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.037 O2 -0.667 HO2 0.415 Iteration: 162 O2 QME: -6.069 MME: -6.193 (-0.124) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.618 (0.079) 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: -0.461 (0.339) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.310 (-0.107) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.320 (0.538) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.772 (0.173) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.966 -0.090 1.702} (2.602 D) Ratio: 1.45 Current objective value: 22.571134 ( En: 11.821134 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.029 O2 -0.664 HO2 0.421 Iteration: 163 O2 QME: -6.069 MME: -6.146 (-0.077) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.623 (0.074) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.243 (-0.055) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.450 (0.349) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.283 (-0.079) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.285 (0.573) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.950 (-0.005) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.922 -0.138 1.714} (2.579 D) Ratio: 1.44 Current objective value: 26.511568 ( En: 11.761568 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.029 O2 -0.664 HO2 0.421 Iteration: 164 O2 QME: -6.069 MME: -6.146 (-0.077) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.623 (0.074) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.243 (-0.055) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.450 (0.349) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.283 (-0.079) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.285 (0.573) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.950 (-0.005) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.922 -0.138 1.714} (2.579 D) Ratio: 1.44 Current objective value: 26.511568 ( En: 11.761568 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.033 O2 -0.667 HO2 0.419 Iteration: 165 O2 QME: -6.069 MME: -6.188 (-0.119) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.626 (0.070) 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: -0.458 (0.342) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.295 (-0.091) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.298 (0.560) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.886 (0.058) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.951 -0.119 1.713} (2.599 D) Ratio: 1.45 Current objective value: 26.406773 ( En: 11.656773 Dist: 14.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.035 O2 -0.669 HO2 0.419 Iteration: 166 O2 QME: -6.069 MME: -6.209 (-0.140) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.628 (0.069) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.267 (-0.079) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.461 (0.338) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.301 (-0.097) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.304 (0.553) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.854 (0.090) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.966 -0.110 1.712} (2.609 D) Ratio: 1.45 Current objective value: 22.468815 ( En: 11.718815 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.033 O2 -0.656 HO2 0.411 Iteration: 167 O2 QME: -6.069 MME: -6.078 (-0.009) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.598 (0.098) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.058) 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: -1.296 (-0.092) 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: -5.724 (0.221) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.922 -0.096 1.682} (2.556 D) Ratio: 1.42 Current objective value: 24.561146 ( En: 12.061146 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.033 O2 -0.656 HO2 0.411 Iteration: 168 O2 QME: -6.069 MME: -6.078 (-0.009) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.598 (0.098) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.058) 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: -1.296 (-0.092) 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: -5.724 (0.221) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.922 -0.096 1.682} (2.556 D) Ratio: 1.42 Current objective value: 24.561146 ( En: 12.061146 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.034 O2 -0.663 HO2 0.414 Iteration: 169 O2 QME: -6.069 MME: -6.144 (-0.075) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.612 (0.085) 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: -0.458 (0.341) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.300 (-0.096) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.314 (0.544) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.770 (0.175) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.947 -0.099 1.695} (2.583 D) Ratio: 1.44 Current objective value: 24.246448 ( En: 11.746448 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.035 O2 -0.666 HO2 0.416 Iteration: 170 O2 QME: -6.069 MME: -6.177 (-0.108) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.619 (0.078) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.264 (-0.076) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.461 (0.339) 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: -0.312 (0.545) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.793 (0.152) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.959 -0.100 1.702} (2.597 D) Ratio: 1.44 Current objective value: 22.466381 ( En: 11.716381 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.040 O2 -0.666 HO2 0.416 Iteration: 171 O2 QME: -6.069 MME: -6.154 (-0.085) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.600 (0.096) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.057) 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: -1.322 (-0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.330 (0.528) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.808 (0.136) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.926 -0.080 1.704} (2.573 D) Ratio: 1.43 Current objective value: 23.956484 ( En: 11.456484 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.241 C2 0.040 O2 -0.666 HO2 0.416 Iteration: 172 O2 QME: -6.069 MME: -6.154 (-0.085) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.600 (0.096) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.245 (-0.057) 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: -1.322 (-0.118) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.330 (0.528) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.808 (0.136) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.926 -0.080 1.704} (2.573 D) Ratio: 1.43 Current objective value: 23.956484 ( En: 11.456484 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.238 C2 0.038 O2 -0.667 HO2 0.416 Iteration: 173 O2 QME: -6.069 MME: -6.176 (-0.107) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.611 (0.085) QMD: 2.737 MMDistDelta: 0.150 H12 QME: -1.188 MME: -1.256 (-0.068) 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: -1.314 (-0.110) 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: -5.810 (0.135) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.945 -0.090 1.705} (2.588 D) Ratio: 1.44 Current objective value: 24.060796 ( En: 11.560796 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.237 C2 0.037 O2 -0.667 HO2 0.417 Iteration: 174 O2 QME: -6.069 MME: -6.188 (-0.119) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.616 (0.080) 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: -0.456 (0.344) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.310 (-0.106) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.317 (0.540) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.811 (0.134) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.955 -0.094 1.706} (2.596 D) Ratio: 1.44 Current objective value: 24.130484 ( En: 11.630484 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.037 O2 -0.667 HO2 0.417 Iteration: 175 O2 QME: -6.069 MME: -6.193 (-0.124) 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: -1.264 (-0.076) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.458 (0.342) QMD: 2.751 MMDistDelta: 0.200 H21 QME: -1.204 MME: -1.308 (-0.105) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.315 (0.542) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.811 (0.133) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.960 -0.097 1.706} (2.600 D) Ratio: 1.45 Current objective value: 24.169711 ( En: 11.669711 Dist: 12.500000 Dipole: 0.000000 ) Current test charges: C1 -0.236 C2 0.037 O2 -0.668 HO2 0.417 Iteration: 176 O2 QME: -6.069 MME: -6.196 (-0.127) 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: -1.265 (-0.077) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.459 (0.340) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.308 (-0.104) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.314 (0.544) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.812 (0.133) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.962 -0.098 1.706} (2.602 D) Ratio: 1.45 Current objective value: 22.439901 ( En: 11.689901 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.034 O2 -0.669 HO2 0.420 Iteration: 177 O2 QME: -6.069 MME: -6.208 (-0.139) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.628 (0.068) 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: -0.459 (0.341) 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: -0.301 (0.556) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.882 (0.063) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.960 -0.114 1.715} (2.607 D) Ratio: 1.45 Current objective value: 22.462356 ( En: 11.712356 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.034 O2 -0.669 HO2 0.420 Iteration: 178 O2 QME: -6.069 MME: -6.208 (-0.139) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.628 (0.068) 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: -0.459 (0.341) 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: -0.301 (0.556) QMD: 2.752 MMDistDelta: 0.200 HO2 QME: -5.945 MME: -5.882 (0.063) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.960 -0.114 1.715} (2.607 D) Ratio: 1.45 Current objective value: 22.462356 ( En: 11.712356 Dist: 10.750000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.028 O2 -0.660 HO2 0.415 Iteration: 179 O2 QME: -6.069 MME: -6.128 (-0.059) 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: -1.257 (-0.070) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.464 (0.335) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.279 (-0.075) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.292 (0.566) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.815 (0.130) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.945 -0.127 1.696} (2.584 D) Ratio: 1.44 Current objective value: 24.719801 ( En: 11.719801 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.233 C2 0.028 O2 -0.660 HO2 0.415 Iteration: 180 O2 QME: -6.069 MME: -6.128 (-0.059) 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: -1.257 (-0.070) QMD: 2.778 MMDistDelta: 0.100 H13 QME: -0.799 MME: -0.464 (0.335) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.279 (-0.075) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.292 (0.566) QMD: 2.752 MMDistDelta: 0.250 HO2 QME: -5.945 MME: -5.815 (0.130) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.945 -0.127 1.696} (2.584 D) Ratio: 1.44 Current objective value: 24.719801 ( En: 11.719801 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.234 C2 0.032 O2 -0.664 HO2 0.416 Iteration: 181 O2 QME: -6.069 MME: -6.160 (-0.091) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.622 (0.074) 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: -0.462 (0.337) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.291 (-0.087) QMD: 2.796 MMDistDelta: 0.100 H22 QME: -0.857 MME: -0.300 (0.558) QMD: 2.752 MMDistDelta: 0.250 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: {1.953 -0.116 1.702} (2.593 D) Ratio: 1.44 Current objective value: 24.667446 ( En: 11.667446 Dist: 13.000000 Dipole: 0.000000 ) Current test charges: C1 -0.235 C2 0.033 O2 -0.665 HO2 0.417 Iteration: 182 O2 QME: -6.069 MME: -6.177 (-0.108) QMD: 2.978 MMDistDelta: 0.050 H11 QME: -1.696 MME: -1.623 (0.074) 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: -0.461 (0.338) QMD: 2.751 MMDistDelta: 0.150 H21 QME: -1.204 MME: -1.296 (-0.092) 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: -5.825 (0.120) QMD: 2.031 MMDistDelta: 0.000 Dipole -- QM: {1.238 -0.180 1.290} (1.797 D) MM: {1.957 -0.111 1.704} (2.598 D) Ratio: 1.45 Current objective value: 22.412176 ( En: 11.662176 Dist: 10.750000 Dipole: 0.000000 ) FINAL CHARGES C1 -0.235 C2 0.033 O2 -0.665 HO2 0.417 END Be sure to check sum of charges for rounding errors!