element(s): ['C', 'H', 'N', 'O'] AFLOW prototype label: A3B8C3D3_mP68_14_3e_8e_3e_3e Parameter names: ['a', 'b/a', 'c/a', 'beta', 'x1', 'y1', 'z1', 'x2', 'y2', 'z2', 'x3', 'y3', 'z3', 'x4', 'y4', 'z4', 'x5', 'y5', 'z5', 'x6', 'y6', 'z6', 'x7', 'y7', 'z7', 'x8', 'y8', 'z8', 'x9', 'y9', 'z9', 'x10', 'y10', 'z10', 'x11', 'y11', 'z11', 'x12', 'y12', 'z12', 'x13', 'y13', 'z13', 'x14', 'y14', 'z14', 'x15', 'y15', 'z15', 'x16', 'y16', 'z16', 'x17', 'y17', 'z17'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['9.2116', '1.9234552', '0.99905554', '154.1618', '0.13517676', '0.4906335', '0.026290493', '0.71267006', '0.66201653', '0.30106414', '0.063777625', '0.55690857', '0.053716634', '0.41060855', '0.65684475', '0.21222961', '0.89689644', '0.76433778', '0.40092122', '0.040315763', '0.68647894', '0.43038048', '0.52739769', '0.74754239', '0.25837903', '0.79794444', '0.56829199', '0.25445774', '0.56592011', '0.55192808', '0.20356602', '0.72760697', '0.35248453', '0.58391288', '0.50584426', '0.39050277', '0.26238405', '0.71661073', '0.58719666', '0.2793369', '0.55113842', '0.68994604', '0.27001334', '0.87626797', '0.70844141', '0.35801942', '0.14631144', '0.62588102', '0.12509566', '0.30280431', '0.47883624', '0.062914503', '0.63842986', '0.34443171', '0.40385898'] model name: Sim_LAMMPS_reaxFF_FthenakisPetsalakisTozzini_2022_CHON__SM_198543900691_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['C', 'C', 'C', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'N', 'N', 'N', 'O', 'O', 'O'] representative atom coordinates = [[0.86482324 0.4906335 0.97370951] [0.28732994 0.66201653 0.69893586] [0.93622238 0.55690857 0.94628337] [0.58939145 0.65684475 0.78777039] [0.10310356 0.76433778 0.59907878] [0.95968424 0.68647894 0.56961952] [0.47260231 0.74754239 0.74162097] [0.20205556 0.56829199 0.74554226] [0.43407989 0.55192808 0.79643398] [0.27239303 0.35248453 0.41608712] [0.49415574 0.39050277 0.73761595] [0.28338927 0.58719666 0.7206631 ] [0.44886158 0.68994604 0.72998666] [0.12373203 0.70844141 0.64198058] [0.85368856 0.62588102 0.87490434] [0.69719569 0.47883624 0.9370855 ] [0.36157014 0.34443171 0.59614102]] spacegroup = 14 cell = [[9.2116, 0, 0], [0, 17.7181, 0], [-8.2828713244807, 0, 4.0109114964176]] ========================================= Step Time Energy fmax BFGS: 0 17:52:15 -301.212180 13.8752 BFGS: 1 17:52:15 -303.446928 7.2686 BFGS: 2 17:52:16 -307.843653 6.1626 BFGS: 3 17:52:17 -306.505329 18.0507 BFGS: 4 17:52:18 -308.728066 17.4736 BFGS: 5 17:52:19 -308.471982 18.6004 BFGS: 6 17:52:20 -305.361744 14.5759 BFGS: 7 17:52:22 -308.922866 6.2277 BFGS: 8 17:52:23 -308.889546 28.3994 BFGS: 9 17:52:24 -310.574827 6.1819 BFGS: 10 17:52:25 -311.057136 3.8611 BFGS: 11 17:52:26 -310.438643 18.9046 BFGS: 12 17:52:27 -311.636266 1.6087 BFGS: 13 17:52:29 -311.829200 1.9488 BFGS: 14 17:52:30 -312.031428 1.9318 BFGS: 15 17:52:30 -312.132909 3.5378 BFGS: 16 17:52:33 -312.292124 1.5860 BFGS: 17 17:52:35 -312.398162 1.5347 BFGS: 18 17:52:37 -312.480227 3.4837 BFGS: 19 17:52:39 -312.591620 1.8578 BFGS: 20 17:52:42 -312.641006 0.8803 BFGS: 21 17:52:44 -312.714445 1.3833 BFGS: 22 17:52:45 -312.805628 1.4346 BFGS: 23 17:52:47 -312.908764 1.2212 BFGS: 24 17:52:48 -312.980240 1.1210 BFGS: 25 17:52:50 -313.024859 0.7990 BFGS: 26 17:52:51 -313.093395 0.4025 BFGS: 27 17:52:52 -313.089134 0.2988 BFGS: 28 17:52:53 -313.129145 0.4692 BFGS: 29 17:52:55 -313.169599 0.5288 BFGS: 30 17:52:56 -313.202629 0.6478 BFGS: 31 17:52:58 -313.226252 0.3323 BFGS: 32 17:53:00 -313.246440 0.3579 BFGS: 33 17:53:01 -313.262680 0.3771 BFGS: 34 17:53:02 -313.283456 0.5668 BFGS: 35 17:53:03 -313.310986 0.3938 BFGS: 36 17:53:04 -313.333933 0.3082 BFGS: 37 17:53:06 -313.350013 0.4755 BFGS: 38 17:53:08 -313.369449 1.2087 BFGS: 39 17:53:09 -313.395332 0.3954 BFGS: 40 17:53:11 -313.471209 0.2320 BFGS: 41 17:53:13 -313.498551 0.5128 BFGS: 42 17:53:14 -313.520439 0.4153 BFGS: 43 17:53:16 -313.540367 0.4093 BFGS: 44 17:53:17 -313.553464 0.2221 BFGS: 45 17:53:18 -313.567418 0.1930 BFGS: 46 17:53:20 -313.583199 0.4905 BFGS: 47 17:53:22 -313.595736 0.4134 BFGS: 48 17:53:23 -313.615975 0.6858 BFGS: 49 17:53:25 -313.632407 0.5555 BFGS: 50 17:53:28 -313.655469 0.4513 BFGS: 51 17:53:30 -313.681588 0.4530 BFGS: 52 17:53:31 -313.706758 0.7177 BFGS: 53 17:53:33 -313.729087 1.2477 BFGS: 54 17:53:35 -313.747611 0.4694 BFGS: 55 17:53:37 -313.775321 0.7254 BFGS: 56 17:53:40 -313.795082 1.1133 BFGS: 57 17:53:42 -313.818182 1.3133 BFGS: 58 17:53:44 -313.838609 1.4533 BFGS: 59 17:53:46 -313.860812 1.5147 BFGS: 60 17:53:48 -313.879327 1.5750 BFGS: 61 17:53:50 -313.900930 1.5713 BFGS: 62 17:53:52 -313.918481 1.5817 BFGS: 63 17:53:55 -313.936964 1.5353 BFGS: 64 17:53:56 -313.953812 1.5105 BFGS: 65 17:53:59 -313.971591 1.4312 BFGS: 66 17:54:01 -313.987813 1.3802 BFGS: 67 17:54:04 -314.015347 1.2738 BFGS: 68 17:54:05 -314.030894 1.2132 BFGS: 69 17:54:06 -314.047614 1.0993 BFGS: 70 17:54:06 -314.062849 1.0161 BFGS: 71 17:54:07 -314.079002 0.8927 BFGS: 72 17:54:09 -314.086282 0.8058 BFGS: 73 17:54:09 -314.115541 0.7148 BFGS: 74 17:54:10 -314.129870 0.6137 BFGS: 75 17:54:11 -314.152058 0.5080 BFGS: 76 17:54:12 -314.167337 0.4205 BFGS: 77 17:54:13 -314.179649 0.2963 BFGS: 78 17:54:15 -314.192873 0.2518 BFGS: 79 17:54:16 -314.205408 0.2072 BFGS: 80 17:54:18 -314.218127 0.1536 BFGS: 81 17:54:20 -314.231749 0.1741 BFGS: 82 17:54:21 -314.243844 0.2300 BFGS: 83 17:54:22 -314.254794 0.2720 BFGS: 84 17:54:25 -314.267509 0.3461 BFGS: 85 17:54:26 -314.278346 0.3749 BFGS: 86 17:54:28 -314.289582 0.4244 BFGS: 87 17:54:28 -314.313969 0.4029 BFGS: 88 17:54:30 -314.327360 0.4883 BFGS: 89 17:54:31 -314.338070 0.5509 BFGS: 90 17:54:32 -314.348308 0.6054 BFGS: 91 17:54:33 -314.357884 0.6416 BFGS: 92 17:54:35 -314.367454 0.6772 BFGS: 93 17:54:35 -314.382569 0.7049 BFGS: 94 17:54:36 -314.390969 0.7188 BFGS: 95 17:54:38 -314.399562 0.7503 BFGS: 96 17:54:39 -314.407811 0.7558 BFGS: 97 17:54:40 -314.415940 0.7760 BFGS: 98 17:54:41 -314.423934 0.7806 BFGS: 99 17:54:42 -314.431819 0.7934 BFGS: 100 17:54:43 -314.439551 0.7921 BFGS: 101 17:54:44 -314.447730 0.8045 BFGS: 102 17:54:46 -314.455247 0.7982 BFGS: 103 17:54:46 -314.467559 0.7932 BFGS: 104 17:54:48 -314.475393 0.7682 BFGS: 105 17:54:49 -314.487882 0.7816 BFGS: 106 17:54:50 -314.495228 0.7419 BFGS: 107 17:54:51 -314.502929 0.7342 BFGS: 108 17:54:52 -314.516713 0.6695 BFGS: 109 17:54:54 -314.525256 0.6549 BFGS: 110 17:54:55 -314.546500 0.5078 BFGS: 111 17:54:56 -314.557232 0.5092 BFGS: 112 17:54:57 -314.570574 0.3023 BFGS: 113 17:55:00 -314.586025 0.1408 BFGS: 114 17:55:03 -314.594087 0.2628 BFGS: 115 17:55:06 -314.597835 0.3491 BFGS: 116 17:55:08 -314.606645 0.3594 BFGS: 117 17:55:09 -314.601983 0.3731 BFGS: 118 17:55:12 -314.610594 0.3483 BFGS: 119 17:55:13 -314.619633 0.3407 BFGS: 120 17:55:15 -314.626116 0.3192 BFGS: 121 17:55:15 -314.645063 0.3470 BFGS: 122 17:55:17 -314.650469 0.3369 BFGS: 123 17:55:18 -314.655704 0.3319 BFGS: 124 17:55:19 -314.663268 0.3286 BFGS: 125 17:55:20 -314.668190 0.3274 BFGS: 126 17:55:20 -314.673008 0.3219 BFGS: 127 17:55:22 -314.677702 0.3191 BFGS: 128 17:55:24 -314.689056 0.3028 BFGS: 129 17:55:26 -314.702371 0.2815 BFGS: 130 17:55:27 -314.706587 0.2844 BFGS: 131 17:55:28 -314.710821 0.2804 BFGS: 132 17:55:29 -314.714968 0.2774 BFGS: 133 17:55:30 -314.719076 0.2721 BFGS: 134 17:55:31 -314.723126 0.2672 BFGS: 135 17:55:31 -314.727137 0.2598 BFGS: 136 17:55:32 -314.732978 0.2528 BFGS: 137 17:55:33 -314.734752 0.2602 BFGS: 138 17:55:33 -314.740967 0.2580 BFGS: 139 17:55:35 -314.746035 0.2391 BFGS: 140 17:55:36 -314.749991 0.2256 BFGS: 141 17:55:38 -314.754524 0.2388 BFGS: 142 17:55:38 -314.759567 0.2159 BFGS: 143 17:55:39 -314.764159 0.1985 BFGS: 144 17:55:41 -314.770207 0.1798 BFGS: 145 17:55:42 -314.774315 0.1843 BFGS: 146 17:55:43 -314.780617 0.1768 BFGS: 147 17:55:45 -314.784872 0.1860 BFGS: 148 17:55:47 -314.789157 0.1905 BFGS: 149 17:55:48 -314.793570 0.1962 BFGS: 150 17:55:50 -314.796708 0.1994 BFGS: 151 17:55:51 -314.806710 0.2157 BFGS: 152 17:55:52 -314.811126 0.2190 BFGS: 153 17:55:53 -314.815665 0.2229 BFGS: 154 17:55:54 -314.820121 0.2253 BFGS: 155 17:55:56 -314.827994 0.2237 BFGS: 156 17:55:57 -314.837924 0.2288 BFGS: 157 17:55:59 -314.842651 0.2232 BFGS: 158 17:56:01 -314.847552 0.2338 BFGS: 159 17:56:02 -314.852600 0.2290 BFGS: 160 17:56:03 -314.857777 0.2387 BFGS: 161 17:56:04 -314.863099 0.2324 BFGS: 162 17:56:04 -314.868530 0.2439 BFGS: 163 17:56:06 -314.872777 0.2429 BFGS: 164 17:56:07 -314.879620 0.2518 BFGS: 165 17:56:07 -314.885350 0.2542 BFGS: 166 17:56:09 -314.891187 0.2614 BFGS: 167 17:56:10 -314.897139 0.2620 BFGS: 168 17:56:11 -314.901876 0.2719 BFGS: 169 17:56:11 -314.909231 0.2670 BFGS: 170 17:56:13 -314.918413 0.2795 BFGS: 171 17:56:14 -314.924680 0.2779 BFGS: 172 17:56:16 -314.944330 0.2873 BFGS: 173 17:56:17 -314.954991 0.2834 BFGS: 174 17:56:18 -314.961253 0.3015 BFGS: 175 17:56:18 -314.968073 0.3006 BFGS: 176 17:56:19 -314.975718 0.3250 BFGS: 177 17:56:21 -314.983349 0.3520 BFGS: 178 17:56:21 -314.989917 0.4047 BFGS: 179 17:56:23 -314.997072 0.4834 BFGS: 180 17:56:24 -315.004850 0.6632 BFGS: 181 17:56:25 -315.014297 1.8227 BFGS: 182 17:56:27 -315.028174 1.5092 BFGS: 183 17:56:28 -315.041347 1.2366 BFGS: 184 17:56:30 -315.053969 1.1114 BFGS: 185 17:56:30 -315.066326 0.9737 BFGS: 186 17:56:32 -315.080881 0.9277 BFGS: 187 17:56:34 -315.092125 0.8218 BFGS: 188 17:56:35 -315.103218 0.8183 BFGS: 189 17:56:37 -315.116383 0.7330 BFGS: 190 17:56:38 -315.137027 0.7298 BFGS: 191 17:56:40 -315.147813 0.6679 BFGS: 192 17:56:42 -315.158403 0.6621 BFGS: 193 17:56:43 -315.160246 0.6210 BFGS: 194 17:56:44 -315.170438 0.5972 BFGS: 195 17:56:46 -315.180436 0.5749 BFGS: 196 17:56:47 -315.188171 0.5468 BFGS: 197 17:56:48 -315.197609 0.5315 BFGS: 198 17:56:50 -315.206502 0.4600 BFGS: 199 17:56:52 -315.216601 0.4240 BFGS: 200 17:56:53 -315.224681 0.3758 BFGS: 201 17:56:56 -315.232552 0.3253 BFGS: 202 17:56:57 -315.240761 0.3006 BFGS: 203 17:56:59 -315.250236 0.2928 BFGS: 204 17:57:01 -315.252863 1.7150 BFGS: 205 17:57:03 -315.265525 0.3302 BFGS: 206 17:57:04 -315.272082 0.3578 BFGS: 207 17:57:05 -315.281518 0.3843 BFGS: 208 17:57:06 -315.293016 0.4149 BFGS: 209 17:57:08 -315.299022 0.4484 BFGS: 210 17:57:09 -315.304103 0.4760 BFGS: 211 17:57:10 -315.309820 0.5100 BFGS: 212 17:57:12 -315.322055 0.5407 BFGS: 213 17:57:14 -315.327570 0.5723 BFGS: 214 17:57:15 -315.332964 0.6002 BFGS: 215 17:57:16 -315.338147 0.6301 BFGS: 216 17:57:17 -315.343221 0.6591 BFGS: 217 17:57:17 -315.348200 0.6856 BFGS: 218 17:57:18 -315.353088 0.7136 BFGS: 219 17:57:19 -315.358246 0.7368 BFGS: 220 17:57:20 -315.363663 0.7618 BFGS: 221 17:57:20 -315.368373 0.7803 BFGS: 222 17:57:21 -315.371212 0.8010 BFGS: 223 17:57:22 -315.378372 0.8119 BFGS: 224 17:57:24 -315.388278 0.8309 BFGS: 225 17:57:25 -315.393428 0.8345 BFGS: 226 17:57:26 -315.397890 0.8487 BFGS: 227 17:57:28 -315.406799 0.8371 BFGS: 228 17:57:29 -315.411146 0.8453 BFGS: 229 17:57:30 -315.426832 0.7725 BFGS: 230 17:57:30 -315.425136 0.9720 BFGS: 231 17:57:32 -315.435122 0.8624 BFGS: 232 17:57:33 -315.448504 0.9066 BFGS: 233 17:57:34 -315.452623 0.9193 BFGS: 234 17:57:36 -315.459192 0.9483 BFGS: 235 17:57:38 -315.464450 0.9624 BFGS: 236 17:57:39 -315.468686 0.9825 BFGS: 237 17:57:40 -315.474105 0.9955 BFGS: 238 17:57:41 -315.478462 1.0105 BFGS: 239 17:57:42 -315.482873 1.0153 BFGS: 240 17:57:44 -315.487357 1.0198 BFGS: 241 17:57:45 -315.491891 1.0141 BFGS: 242 17:57:47 -315.496489 0.9983 BFGS: 243 17:57:49 -315.505435 0.9413 BFGS: 244 17:57:51 -315.504150 0.6102 BFGS: 245 17:57:52 -315.514579 1.0253 BFGS: 246 17:57:53 -315.519207 1.0357 BFGS: 247 17:57:54 -315.523967 1.0233 BFGS: 248 17:57:55 -315.529687 1.0068 BFGS: 249 17:57:56 -315.534352 0.9131 BFGS: 250 17:57:58 -315.535050 0.5416 BFGS: 251 17:57:59 -315.545593 1.0782 BFGS: 252 17:58:00 -315.550364 1.0662 BFGS: 253 17:58:02 -315.555175 1.0007 BFGS: 254 17:58:04 -315.555077 0.4945 BFGS: 255 17:58:06 -315.567921 1.1233 BFGS: 256 17:58:08 -315.574576 1.0161 BFGS: 257 17:58:09 -315.573794 0.4761 BFGS: 258 17:58:11 -315.584506 1.1390 BFGS: 259 17:58:12 -315.584982 0.4631 BFGS: 260 17:58:14 -315.595769 1.1476 BFGS: 261 17:58:16 -315.594720 0.4498 BFGS: 262 17:58:17 -315.602909 0.4393 BFGS: 263 17:58:18 -315.613556 1.0624 BFGS: 264 17:58:18 -315.612587 0.4203 BFGS: 265 17:58:19 -315.617432 0.4255 BFGS: 266 17:58:21 -315.622389 0.4069 BFGS: 267 17:58:22 -315.627300 0.4106 BFGS: 268 17:58:23 -315.635852 0.3940 BFGS: 269 17:58:24 -315.640755 0.3958 BFGS: 270 17:58:24 -315.645742 0.3831 BFGS: 271 17:58:26 -315.652227 0.3822 BFGS: 272 17:58:27 -315.657294 0.3879 BFGS: 273 17:58:29 -315.663071 0.3774 BFGS: 274 17:58:32 -315.668264 0.3840 BFGS: 275 17:58:33 -315.671155 0.3701 BFGS: 276 17:58:35 -315.676672 0.3814 BFGS: 277 17:58:37 -315.682100 0.3643 BFGS: 278 17:58:38 -315.687812 0.3647 BFGS: 279 17:58:40 -315.693646 0.3454 BFGS: 280 17:58:42 -315.699840 0.3330 BFGS: 281 17:58:44 -315.706429 0.3067 BFGS: 282 17:58:45 -315.704438 0.3752 BFGS: 283 17:58:46 -315.715808 0.4636 BFGS: 284 17:58:49 -315.725370 0.4693 BFGS: 285 17:58:51 -315.730894 0.5678 BFGS: 286 17:58:52 -315.736325 0.6086 BFGS: 287 17:58:53 -315.739730 0.6511 BFGS: 288 17:58:54 -315.745291 0.6842 BFGS: 289 17:58:57 -315.750860 0.7144 BFGS: 290 17:58:59 -315.766405 0.6634 BFGS: 291 17:59:01 -315.770691 0.6776 BFGS: 292 17:59:02 -315.770202 0.6896 BFGS: 293 17:59:04 -315.774772 0.6516 BFGS: 294 17:59:06 -315.780170 0.5833 BFGS: 295 17:59:07 -315.783902 0.5214 BFGS: 296 17:59:08 -315.787274 0.4695 BFGS: 297 17:59:09 -315.790461 0.4230 BFGS: 298 17:59:10 -315.796759 0.3800 BFGS: 299 17:59:13 -315.799606 0.3451 BFGS: 300 17:59:15 -315.789947 0.3685 BFGS: 301 17:59:16 -315.793249 0.3176 BFGS: 302 17:59:18 -315.795486 0.2665 BFGS: 303 17:59:20 -315.797554 0.2166 BFGS: 304 17:59:22 -315.799432 0.1683 BFGS: 305 17:59:24 -315.801142 0.1216 BFGS: 306 17:59:25 -315.802183 0.0913 BFGS: 307 17:59:27 -315.803607 0.0693 BFGS: 308 17:59:28 -315.790677 0.0962 BFGS: 309 17:59:29 -315.792102 0.1664 BFGS: 310 17:59:31 -315.806545 0.1603 BFGS: 311 17:59:32 -315.809576 0.1261 BFGS: 312 17:59:32 -315.811984 0.1794 BFGS: 313 17:59:34 -315.813937 0.2713 BFGS: 314 17:59:35 -315.815072 0.2497 BFGS: 315 17:59:38 -315.815895 0.2603 BFGS: 316 17:59:39 -315.820427 0.2509 BFGS: 317 17:59:41 -315.821288 0.2591 BFGS: 318 17:59:42 -315.824273 0.2664 BFGS: 319 17:59:45 -315.827319 0.2686 BFGS: 320 17:59:46 -315.827035 0.2663 BFGS: 321 17:59:48 -315.829910 0.2733 BFGS: 322 17:59:49 -315.837327 0.2825 BFGS: 323 17:59:50 -315.834524 1.5122 BFGS: 324 17:59:51 -315.835822 1.5940 BFGS: 325 17:59:54 -315.837638 1.5575 BFGS: 326 17:59:55 -315.838813 1.5071 BFGS: 327 17:59:56 -315.833213 0.1848 BFGS: 328 17:59:57 -315.842239 1.4805 BFGS: 329 17:59:59 -315.843287 1.5032 BFGS: 330 18:00:01 -315.839002 0.1647 BFGS: 331 18:00:02 -315.846714 1.4729 BFGS: 332 18:00:03 -315.851490 1.2936 BFGS: 333 18:00:04 -315.847651 0.2500 BFGS: 334 18:00:06 -315.851942 1.4034 BFGS: 335 18:00:07 -315.856267 1.4725 BFGS: 336 18:00:10 -315.857398 1.6042 BFGS: 337 18:00:11 -315.854455 1.5749 BFGS: 338 18:00:13 -315.858671 1.5500 BFGS: 339 18:00:15 -315.857271 1.4580 BFGS: 340 18:00:17 -315.858458 1.3990 BFGS: 341 18:00:19 -315.860412 1.3812 BFGS: 342 18:00:21 -315.862307 1.4043 BFGS: 343 18:00:22 -315.858256 0.1943 BFGS: 344 18:00:24 -315.865719 1.7119 BFGS: 345 18:00:25 -315.867316 1.7162 BFGS: 346 18:00:27 -315.867291 1.4123 BFGS: 347 18:00:28 -315.862143 0.2208 BFGS: 348 18:00:29 -315.862245 1.5531 BFGS: 349 18:00:30 -315.863142 1.4804 BFGS: 350 18:00:31 -315.856063 0.1191 BFGS: 351 18:00:33 -315.856544 0.1167 BFGS: 352 18:00:34 -315.856373 0.1259 BFGS: 353 18:00:35 -315.856920 0.1576 BFGS: 354 18:00:38 -315.863137 1.4792 BFGS: 355 18:00:39 -315.857717 0.1922 BFGS: 356 18:00:39 -315.858405 0.1907 BFGS: 357 18:00:41 -315.864752 1.4381 BFGS: 358 18:00:42 -315.855484 0.1526 BFGS: 359 18:00:43 -315.855777 0.1548 BFGS: 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0.1349 BFGS: 1809 18:26:26 -316.685786 0.1368 BFGS: 1810 18:26:26 -316.685656 0.1270 BFGS: 1811 18:26:27 -316.677826 0.1409 BFGS: 1812 18:26:28 -316.678699 0.1349 BFGS: 1813 18:26:29 -316.685787 0.1369 BFGS: 1814 18:26:30 -316.685656 0.1271 BFGS: 1815 18:26:31 -316.677830 0.1410 BFGS: 1816 18:26:32 -316.678702 0.1349 BFGS: 1817 18:26:33 -316.685788 0.1370 BFGS: 1818 18:26:34 -316.685656 0.1271 BFGS: 1819 18:26:35 -316.677833 0.1410 BFGS: 1820 18:26:36 -316.678704 0.1349 BFGS: 1821 18:26:36 -316.685789 0.1370 BFGS: 1822 18:26:37 -316.685657 0.1272 BFGS: 1823 18:26:38 -316.677836 0.1410 BFGS: 1824 18:26:39 -316.678707 0.1349 BFGS: 1825 18:26:40 -316.685790 0.1371 BFGS: 1826 18:26:41 -316.685657 0.1272 BFGS: 1827 18:26:42 -316.677840 0.1410 BFGS: 1828 18:26:43 -316.678709 0.1349 BFGS: 1829 18:26:44 -316.685791 0.1371 BFGS: 1830 18:26:45 -316.685658 0.1272 BFGS: 1831 18:26:45 -316.677843 0.1410 BFGS: 1832 18:26:45 -316.678711 0.1349 BFGS: 1833 18:26:46 -316.685792 0.1372 BFGS: 1834 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0.1410 BFGS: 1860 18:27:06 -316.678725 0.1348 BFGS: 1861 18:27:08 -316.685799 0.1375 BFGS: 1862 18:27:08 -316.685662 0.1275 BFGS: 1863 18:27:08 -316.677866 0.1410 BFGS: 1864 18:27:10 -316.678727 0.1348 BFGS: 1865 18:27:11 -316.685800 0.1376 BFGS: 1866 18:27:11 -316.685663 0.1275 BFGS: 1867 18:27:12 -316.677869 0.1410 BFGS: 1868 18:27:13 -316.678729 0.1348 BFGS: 1869 18:27:14 -316.685801 0.1376 BFGS: 1870 18:27:15 -316.685663 0.1275 BFGS: 1871 18:27:16 -316.677871 0.1410 BFGS: 1872 18:27:17 -316.678731 0.1348 BFGS: 1873 18:27:18 -316.685802 0.1377 BFGS: 1874 18:27:19 -316.685664 0.1275 BFGS: 1875 18:27:20 -316.677874 0.1410 BFGS: 1876 18:27:20 -316.678732 0.1348 BFGS: 1877 18:27:21 -316.685803 0.1377 BFGS: 1878 18:27:22 -316.685665 0.1276 BFGS: 1879 18:27:22 -316.677875 0.1409 BFGS: 1880 18:27:24 -316.678734 0.1348 BFGS: 1881 18:27:25 -316.685804 0.1377 BFGS: 1882 18:27:25 -316.685666 0.1276 BFGS: 1883 18:27:27 -316.677878 0.1410 BFGS: 1884 18:27:28 -316.678735 0.1348 BFGS: 1885 18:27:28 -316.685805 0.1378 BFGS: 1886 18:27:30 -316.685666 0.1276 BFGS: 1887 18:27:31 -316.677880 0.1410 BFGS: 1888 18:27:31 -316.678737 0.1348 BFGS: 1889 18:27:32 -316.685806 0.1378 BFGS: 1890 18:27:34 -316.685667 0.1276 BFGS: 1891 18:27:35 -316.677883 0.1410 BFGS: 1892 18:27:36 -316.678739 0.1348 BFGS: 1893 18:27:36 -316.685807 0.1379 BFGS: 1894 18:27:38 -316.685668 0.1277 BFGS: 1895 18:27:38 -316.677886 0.1410 BFGS: 1896 18:27:39 -316.678741 0.1348 BFGS: 1897 18:27:40 -316.685808 0.1379 BFGS: 1898 18:27:40 -316.685668 0.1277 BFGS: 1899 18:27:41 -316.677888 0.1410 BFGS: 1900 18:27:42 -316.678742 0.1348 BFGS: 1901 18:27:44 -316.685809 0.1379 BFGS: 1902 18:27:46 -316.685669 0.1277 BFGS: 1903 18:27:47 -316.677890 0.1410 BFGS: 1904 18:27:48 -316.678744 0.1347 BFGS: 1905 18:27:49 -316.685810 0.1380 BFGS: 1906 18:27:50 -316.685670 0.1277 BFGS: 1907 18:27:51 -316.677892 0.1410 BFGS: 1908 18:27:52 -316.678745 0.1347 BFGS: 1909 18:27:53 -316.685812 0.1380 BFGS: 1910 18:27:54 -316.685671 0.1277 BFGS: 1911 18:27:54 -316.677894 0.1410 BFGS: 1912 18:27:55 -316.678747 0.1347 BFGS: 1913 18:27:55 -316.685813 0.1380 BFGS: 1914 18:27:56 -316.685672 0.1278 BFGS: 1915 18:27:57 -316.677896 0.1409 BFGS: 1916 18:27:58 -316.678748 0.1347 BFGS: 1917 18:27:59 -316.685814 0.1381 BFGS: 1918 18:28:00 -316.685673 0.1278 BFGS: 1919 18:28:01 -316.677896 0.1409 BFGS: 1920 18:28:01 -316.678749 0.1347 BFGS: 1921 18:28:02 -316.685815 0.1381 BFGS: 1922 18:28:02 -316.685674 0.1278 BFGS: 1923 18:28:03 -316.677898 0.1409 BFGS: 1924 18:28:05 -316.678750 0.1347 BFGS: 1925 18:28:06 -316.685817 0.1381 BFGS: 1926 18:28:07 -316.685675 0.1278 BFGS: 1927 18:28:07 -316.677900 0.1409 BFGS: 1928 18:28:08 -316.678751 0.1347 BFGS: 1929 18:28:08 -316.685818 0.1381 BFGS: 1930 18:28:09 -316.685676 0.1278 BFGS: 1931 18:28:09 -316.677902 0.1409 BFGS: 1932 18:28:10 -316.678753 0.1347 BFGS: 1933 18:28:11 -316.685819 0.1381 BFGS: 1934 18:28:12 -316.685676 0.1278 BFGS: 1935 18:28:13 -316.677904 0.1409 BFGS: 1936 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0.1383 BFGS: 1962 18:28:34 -316.685682 0.1279 BFGS: 1963 18:28:35 -316.677917 0.1409 BFGS: 1964 18:28:37 -316.678763 0.1346 BFGS: 1965 18:28:38 -316.685827 0.1383 BFGS: 1966 18:28:39 -316.685683 0.1280 BFGS: 1967 18:28:41 -316.677918 0.1408 BFGS: 1968 18:28:42 -316.678764 0.1346 BFGS: 1969 18:28:43 -316.685828 0.1384 BFGS: 1970 18:28:43 -316.685684 0.1280 BFGS: 1971 18:28:45 -316.677919 0.1408 BFGS: 1972 18:28:45 -316.678765 0.1346 BFGS: 1973 18:28:46 -316.685830 0.1384 BFGS: 1974 18:28:47 -316.685685 0.1280 BFGS: 1975 18:28:47 -316.677921 0.1408 BFGS: 1976 18:28:47 -316.678766 0.1346 BFGS: 1977 18:28:47 -316.685831 0.1384 BFGS: 1978 18:28:47 -316.685686 0.1280 BFGS: 1979 18:28:49 -316.677922 0.1408 BFGS: 1980 18:28:50 -316.678767 0.1346 BFGS: 1981 18:28:50 -316.685832 0.1384 BFGS: 1982 18:28:51 -316.685687 0.1280 BFGS: 1983 18:28:52 -316.677923 0.1408 BFGS: 1984 18:28:52 -316.678768 0.1346 BFGS: 1985 18:28:53 -316.685833 0.1384 BFGS: 1986 18:28:53 -316.685688 0.1280 BFGS: 1987 18:28:54 -316.677925 0.1408 BFGS: 1988 18:28:55 -316.678769 0.1346 BFGS: 1989 18:28:55 -316.685834 0.1384 BFGS: 1990 18:28:57 -316.685689 0.1280 BFGS: 1991 18:28:57 -316.677926 0.1408 BFGS: 1992 18:28:59 -316.678770 0.1346 BFGS: 1993 18:29:00 -316.685836 0.1385 BFGS: 1994 18:29:01 -316.685690 0.1280 BFGS: 1995 18:29:01 -316.677927 0.1408 BFGS: 1996 18:29:02 -316.678771 0.1346 BFGS: 1997 18:29:03 -316.685837 0.1385 BFGS: 1998 18:29:04 -316.685691 0.1280 BFGS: 1999 18:29:05 -316.677929 0.1408 BFGS: 2000 18:29:05 -316.678772 0.1346 BFGS: 2001 18:29:07 -316.685838 0.1385 BFGS: 2002 18:29:07 -316.685693 0.1281 BFGS: 2003 18:29:08 -316.677930 0.1408 BFGS: 2004 18:29:08 -316.678773 0.1346 BFGS: 2005 18:29:09 -316.685839 0.1385 BFGS: 2006 18:29:10 -316.685694 0.1281 BFGS: 2007 18:29:12 -316.677931 0.1408 BFGS: 2008 18:29:12 -316.678774 0.1345 BFGS: 2009 18:29:13 -316.685840 0.1385 BFGS: 2010 18:29:14 -316.685695 0.1281 BFGS: 2011 18:29:15 -316.677933 0.1408 BFGS: 2012 18:29:16 -316.678775 0.1345 BFGS: 2013 18:29:17 -316.685841 0.1385 BFGS: 2014 18:29:18 -316.685696 0.1281 BFGS: 2015 18:29:18 -316.677934 0.1408 BFGS: 2016 18:29:19 -316.678776 0.1345 BFGS: 2017 18:29:19 -316.685843 0.1386 BFGS: 2018 18:29:21 -316.685697 0.1281 BFGS: 2019 18:29:22 -316.677935 0.1408 BFGS: 2020 18:29:23 -316.678777 0.1345 BFGS: 2021 18:29:24 -316.685844 0.1386 BFGS: 2022 18:29:24 -316.685698 0.1281 BFGS: 2023 18:29:26 -316.677936 0.1407 BFGS: 2024 18:29:27 -316.678778 0.1345 BFGS: 2025 18:29:27 -316.685845 0.1386 BFGS: 2026 18:29:28 -316.685699 0.1281 BFGS: 2027 18:29:29 -316.677937 0.1407 BFGS: 2028 18:29:29 -316.678778 0.1345 BFGS: 2029 18:29:30 -316.685846 0.1386 BFGS: 2030 18:29:31 -316.685700 0.1281 BFGS: 2031 18:29:32 -316.677938 0.1407 BFGS: 2032 18:29:32 -316.678779 0.1345 BFGS: 2033 18:29:33 -316.685847 0.1386 BFGS: 2034 18:29:33 -316.685701 0.1281 BFGS: 2035 18:29:35 -316.677940 0.1407 BFGS: 2036 18:29:35 -316.678780 0.1345 BFGS: 2037 18:29:36 -316.685849 0.1386 BFGS: 2038 18:29:37 -316.685702 0.1281 BFGS: 2039 18:29:38 -316.677941 0.1407 BFGS: 2040 18:29:39 -316.678781 0.1345 BFGS: 2041 18:29:41 -316.685850 0.1386 BFGS: 2042 18:29:42 -316.685703 0.1281 BFGS: 2043 18:29:44 -316.677942 0.1407 BFGS: 2044 18:29:44 -316.678782 0.1345 BFGS: 2045 18:29:45 -316.685851 0.1386 BFGS: 2046 18:29:45 -316.685704 0.1282 BFGS: 2047 18:29:46 -316.677943 0.1407 BFGS: 2048 18:29:47 -316.678782 0.1345 BFGS: 2049 18:29:48 -316.685852 0.1387 BFGS: 2050 18:29:49 -316.685706 0.1282 BFGS: 2051 18:29:50 -316.677944 0.1407 BFGS: 2052 18:29:51 -316.678783 0.1345 BFGS: 2053 18:29:51 -316.685854 0.1387 BFGS: 2054 18:29:52 -316.685707 0.1282 BFGS: 2055 18:29:53 -316.677945 0.1407 BFGS: 2056 18:29:53 -316.678784 0.1345 BFGS: 2057 18:29:55 -316.685855 0.1387 BFGS: 2058 18:29:55 -316.685708 0.1282 BFGS: 2059 18:29:56 -316.677946 0.1407 BFGS: 2060 18:29:57 -316.678785 0.1344 BFGS: 2061 18:29:57 -316.685856 0.1387 BFGS: 2062 18:29:58 -316.685709 0.1282 BFGS: 2063 18:29:59 -316.677947 0.1407 BFGS: 2064 18:30:00 -316.678785 0.1344 BFGS: 2065 18:30:00 -316.685857 0.1387 BFGS: 2066 18:30:01 -316.685710 0.1282 BFGS: 2067 18:30:03 -316.677948 0.1407 BFGS: 2068 18:30:03 -316.678786 0.1344 BFGS: 2069 18:30:04 -316.685859 0.1387 BFGS: 2070 18:30:06 -316.685711 0.1282 BFGS: 2071 18:30:06 -316.677949 0.1406 BFGS: 2072 18:30:07 -316.678787 0.1344 BFGS: 2073 18:30:08 -316.685860 0.1387 BFGS: 2074 18:30:10 -316.685712 0.1282 BFGS: 2075 18:30:11 -316.677950 0.1406 BFGS: 2076 18:30:13 -316.678788 0.1344 BFGS: 2077 18:30:14 -316.685861 0.1387 BFGS: 2078 18:30:15 -316.685714 0.1282 BFGS: 2079 18:30:16 -316.677951 0.1406 BFGS: 2080 18:30:17 -316.678788 0.1344 BFGS: 2081 18:30:18 -316.685863 0.1387 BFGS: 2082 18:30:19 -316.685715 0.1282 BFGS: 2083 18:30:19 -316.677952 0.1406 BFGS: 2084 18:30:21 -316.678789 0.1344 BFGS: 2085 18:30:21 -316.685864 0.1388 BFGS: 2086 18:30:22 -316.685716 0.1282 BFGS: 2087 18:30:23 -316.677952 0.1406 BFGS: 2088 18:30:23 -316.678790 0.1344 BFGS: 2089 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0.1292 BFGS: 2931 18:42:37 -316.678076 0.1386 BFGS: 2932 18:42:38 -316.679820 0.1327 BFGS: 2933 18:42:39 -316.686069 0.1392 BFGS: 2934 18:42:40 -316.680544 0.1277 BFGS: 2935 18:42:40 -316.686494 0.1346 BFGS: 2936 18:42:41 -316.686684 0.1315 BFGS: 2937 18:42:41 -316.678245 0.1386 BFGS: 2938 18:42:42 -316.679974 0.1320 BFGS: 2939 18:42:42 -316.685898 0.1418 BFGS: 2940 18:42:44 -316.686715 0.1313 BFGS: 2941 18:42:45 -316.678214 0.1381 BFGS: 2942 18:42:47 -316.679946 0.1320 BFGS: 2943 18:42:48 -316.685934 0.1411 BFGS: 2944 18:42:49 -316.686743 0.1310 BFGS: 2945 18:42:50 -316.678186 0.1380 BFGS: 2946 18:42:52 -316.679921 0.1321 BFGS: 2947 18:42:53 -316.685964 0.1406 BFGS: 2948 18:42:54 -316.686768 0.1306 BFGS: 2949 18:42:55 -316.678162 0.1381 BFGS: 2950 18:42:56 -316.679898 0.1322 BFGS: 2951 18:42:57 -316.685990 0.1402 BFGS: 2952 18:42:57 -316.686790 0.1303 BFGS: 2953 18:42:58 -316.678140 0.1381 BFGS: 2954 18:42:59 -316.679879 0.1323 BFGS: 2955 18:43:00 -316.686013 0.1400 BFGS: 2956 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0.1411 BFGS: 2982 18:43:26 -316.686752 0.1310 BFGS: 2983 18:43:26 -316.678189 0.1380 BFGS: 2984 18:43:27 -316.679923 0.1321 BFGS: 2985 18:43:28 -316.685972 0.1406 BFGS: 2986 18:43:28 -316.686777 0.1306 BFGS: 2987 18:43:29 -316.678164 0.1380 BFGS: 2988 18:43:30 -316.679901 0.1322 BFGS: 2989 18:43:30 -316.685998 0.1403 BFGS: 2990 18:43:31 -316.686799 0.1303 BFGS: 2991 18:43:32 -316.678143 0.1381 BFGS: 2992 18:43:33 -316.679881 0.1323 BFGS: 2993 18:43:35 -316.686021 0.1400 BFGS: 2994 18:43:36 -316.686818 0.1300 BFGS: 2995 18:43:36 -316.678124 0.1381 BFGS: 2996 18:43:37 -316.679864 0.1324 BFGS: 2997 18:43:39 -316.686041 0.1398 BFGS: 2998 18:43:40 -316.686835 0.1297 BFGS: 2999 18:43:41 -316.678107 0.1382 BFGS: 3000 18:43:42 -316.679849 0.1325 BFGS: 3001 18:43:43 -316.686058 0.1396 BFGS: 3002 18:43:43 -316.686849 0.1294 BFGS: 3003 18:43:44 -316.678093 0.1384 BFGS: 3004 18:43:45 -316.679836 0.1325 BFGS: 3005 18:43:46 -316.686073 0.1394 BFGS: 3006 18:43:47 -316.686862 0.1291 BFGS: 3007 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0.1300 BFGS: 3033 18:44:12 -316.678126 0.1381 BFGS: 3034 18:44:13 -316.679866 0.1323 BFGS: 3035 18:44:14 -316.686049 0.1398 BFGS: 3036 18:44:15 -316.686843 0.1297 BFGS: 3037 18:44:15 -316.678110 0.1382 BFGS: 3038 18:44:16 -316.679851 0.1324 BFGS: 3039 18:44:17 -316.686066 0.1396 BFGS: 3040 18:44:18 -316.686858 0.1294 BFGS: 3041 18:44:18 -316.678096 0.1383 BFGS: 3042 18:44:19 -316.679838 0.1325 BFGS: 3043 18:44:19 -316.686081 0.1395 BFGS: 3044 18:44:20 -316.680560 0.1275 BFGS: 3045 18:44:21 -316.686508 0.1347 BFGS: 3046 18:44:21 -316.686699 0.1316 BFGS: 3047 18:44:22 -316.678262 0.1381 BFGS: 3048 18:44:23 -316.679990 0.1318 BFGS: 3049 18:44:23 -316.685912 0.1421 BFGS: 3050 18:44:23 -316.686732 0.1315 BFGS: 3051 18:44:23 -316.678230 0.1378 BFGS: 3052 18:44:24 -316.679961 0.1318 BFGS: 3053 18:44:25 -316.685949 0.1412 BFGS: 3054 18:44:27 -316.686761 0.1311 BFGS: 3055 18:44:27 -316.678201 0.1377 BFGS: 3056 18:44:29 -316.679934 0.1320 BFGS: 3057 18:44:30 -316.685981 0.1407 BFGS: 3058 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0.1420 BFGS: 3084 18:44:57 -316.686737 0.1315 BFGS: 3085 18:44:58 -316.678235 0.1378 BFGS: 3086 18:44:58 -316.679965 0.1318 BFGS: 3087 18:45:00 -316.685954 0.1413 BFGS: 3088 18:45:00 -316.686766 0.1312 BFGS: 3089 18:45:02 -316.678206 0.1376 BFGS: 3090 18:45:03 -316.679938 0.1319 BFGS: 3091 18:45:04 -316.685985 0.1408 BFGS: 3092 18:45:05 -316.686793 0.1308 BFGS: 3093 18:45:06 -316.678180 0.1377 BFGS: 3094 18:45:07 -316.679915 0.1320 BFGS: 3095 18:45:08 -316.686013 0.1404 BFGS: 3096 18:45:08 -316.686816 0.1304 BFGS: 3097 18:45:09 -316.678157 0.1378 BFGS: 3098 18:45:11 -316.679894 0.1321 BFGS: 3099 18:45:11 -316.686037 0.1401 BFGS: 3100 18:45:13 -316.686836 0.1301 BFGS: 3101 18:45:14 -316.678137 0.1380 BFGS: 3102 18:45:15 -316.679876 0.1322 BFGS: 3103 18:45:16 -316.686057 0.1399 BFGS: 3104 18:45:16 -316.686853 0.1298 BFGS: 3105 18:45:17 -316.678120 0.1380 BFGS: 3106 18:45:18 -316.679860 0.1323 BFGS: 3107 18:45:19 -316.686075 0.1397 BFGS: 3108 18:45:20 -316.686868 0.1295 BFGS: 3109 18:45:21 -316.678105 0.1381 BFGS: 3110 18:45:21 -316.679847 0.1324 BFGS: 3111 18:45:22 -316.686091 0.1395 BFGS: 3112 18:45:22 -316.680568 0.1274 BFGS: 3113 18:45:22 -316.686519 0.1348 BFGS: 3114 18:45:23 -316.686710 0.1317 BFGS: 3115 18:45:23 -316.678271 0.1381 BFGS: 3116 18:45:24 -316.679998 0.1317 BFGS: 3117 18:45:25 -316.685923 0.1420 BFGS: 3118 18:45:26 -316.686743 0.1316 BFGS: 3119 18:45:27 -316.678238 0.1377 BFGS: 3120 18:45:28 -316.679968 0.1317 BFGS: 3121 18:45:30 -316.685960 0.1413 BFGS: 3122 18:45:30 -316.686773 0.1312 BFGS: 3123 18:45:31 -316.678209 0.1376 BFGS: 3124 18:45:31 -316.679941 0.1318 BFGS: 3125 18:45:32 -316.685992 0.1408 BFGS: 3126 18:45:33 -316.686799 0.1308 BFGS: 3127 18:45:34 -316.678183 0.1376 BFGS: 3128 18:45:36 -316.679917 0.1320 BFGS: 3129 18:45:36 -316.686019 0.1404 BFGS: 3130 18:45:37 -316.686822 0.1304 BFGS: 3131 18:45:38 -316.678160 0.1377 BFGS: 3132 18:45:39 -316.679896 0.1321 BFGS: 3133 18:45:41 -316.686043 0.1402 BFGS: 3134 18:45:42 -316.686843 0.1301 BFGS: 3135 18:45:43 -316.678140 0.1379 BFGS: 3136 18:45:43 -316.679878 0.1322 BFGS: 3137 18:45:44 -316.686064 0.1399 BFGS: 3138 18:45:45 -316.686860 0.1298 BFGS: 3139 18:45:46 -316.678122 0.1380 BFGS: 3140 18:45:46 -316.679862 0.1322 BFGS: 3141 18:45:47 -316.686082 0.1397 BFGS: 3142 18:45:48 -316.686876 0.1295 BFGS: 3143 18:45:48 -316.678107 0.1381 BFGS: 3144 18:45:49 -316.679849 0.1323 BFGS: 3145 18:45:50 -316.686098 0.1396 BFGS: 3146 18:45:51 -316.680569 0.1274 BFGS: 3147 18:45:53 -316.686526 0.1348 BFGS: 3148 18:45:53 -316.686717 0.1317 BFGS: 3149 18:45:54 -316.678273 0.1380 BFGS: 3150 18:45:55 -316.680000 0.1316 BFGS: 3151 18:45:55 -316.685930 0.1421 BFGS: 3152 18:45:55 -316.686750 0.1316 BFGS: 3153 18:45:55 -316.678240 0.1376 BFGS: 3154 18:45:55 -316.679970 0.1317 BFGS: 3155 18:45:56 -316.685967 0.1413 BFGS: 3156 18:45:56 -316.686780 0.1312 BFGS: 3157 18:45:58 -316.678211 0.1375 BFGS: 3158 18:45:58 -316.679943 0.1318 BFGS: 3159 18:45:59 -316.685999 0.1408 BFGS: 3160 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18:56:56 -316.679351 0.1349 BFGS: 3926 18:56:56 -316.680034 0.1308 BFGS: 3927 18:56:57 -316.686299 0.1394 BFGS: 3928 18:56:59 -316.680656 0.1265 BFGS: 3929 18:57:00 -316.686669 0.1349 BFGS: 3930 18:57:01 -316.686835 0.1323 BFGS: 3931 18:57:02 -316.679485 0.1351 BFGS: 3932 18:57:04 -316.680158 0.1301 BFGS: 3933 18:57:05 -316.686167 0.1413 BFGS: 3934 18:57:06 -316.686871 0.1320 BFGS: 3935 18:57:06 -316.679448 0.1347 BFGS: 3936 18:57:07 -316.680124 0.1303 BFGS: 3937 18:57:09 -316.686205 0.1407 BFGS: 3938 18:57:10 -316.686903 0.1315 BFGS: 3939 18:57:11 -316.679415 0.1346 BFGS: 3940 18:57:12 -316.680093 0.1304 BFGS: 3941 18:57:13 -316.686238 0.1402 BFGS: 3942 18:57:15 -316.686932 0.1311 BFGS: 3943 18:57:15 -316.679386 0.1348 BFGS: 3944 18:57:17 -316.680066 0.1306 BFGS: 3945 18:57:18 -316.686268 0.1398 BFGS: 3946 18:57:19 -316.686958 0.1306 BFGS: 3947 18:57:20 -316.679360 0.1349 BFGS: 3948 18:57:21 -316.680042 0.1307 BFGS: 3949 18:57:22 -316.686295 0.1395 BFGS: 3950 18:57:23 -316.680663 0.1265 BFGS: 3951 18:57:24 -316.686666 0.1350 BFGS: 3952 18:57:26 -316.686832 0.1324 BFGS: 3953 18:57:27 -316.679493 0.1352 BFGS: 3954 18:57:28 -316.680165 0.1300 BFGS: 3955 18:57:28 -316.686164 0.1414 BFGS: 3956 18:57:29 -316.686869 0.1321 BFGS: 3957 18:57:30 -316.679455 0.1346 BFGS: 3958 18:57:30 -316.680130 0.1302 BFGS: 3959 18:57:32 -316.686203 0.1408 BFGS: 3960 18:57:32 -316.686902 0.1316 BFGS: 3961 18:57:34 -316.679422 0.1345 BFGS: 3962 18:57:35 -316.680099 0.1304 BFGS: 3963 18:57:35 -316.686237 0.1403 BFGS: 3964 18:57:36 -316.686931 0.1311 BFGS: 3965 18:57:37 -316.679392 0.1347 BFGS: 3966 18:57:38 -316.680071 0.1305 BFGS: 3967 18:57:39 -316.686267 0.1399 BFGS: 3968 18:57:39 -316.686957 0.1307 BFGS: 3969 18:57:40 -316.679365 0.1348 BFGS: 3970 18:57:41 -316.680047 0.1307 BFGS: 3971 18:57:41 -316.686295 0.1396 BFGS: 3972 18:57:42 -316.680667 0.1264 BFGS: 3973 18:57:43 -316.686666 0.1351 BFGS: 3974 18:57:44 -316.686832 0.1325 BFGS: 3975 18:57:45 -316.679497 0.1350 BFGS: 3976 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0.1345 BFGS: 4002 18:58:13 -316.680135 0.1302 BFGS: 4003 18:58:14 -316.686206 0.1408 BFGS: 4004 18:58:15 -316.686905 0.1317 BFGS: 4005 18:58:16 -316.679427 0.1345 BFGS: 4006 18:58:17 -316.680104 0.1303 BFGS: 4007 18:58:18 -316.686241 0.1403 BFGS: 4008 18:58:19 -316.686935 0.1312 BFGS: 4009 18:58:19 -316.679397 0.1346 BFGS: 4010 18:58:20 -316.680076 0.1305 BFGS: 4011 18:58:21 -316.686271 0.1399 BFGS: 4012 18:58:22 -316.686962 0.1307 BFGS: 4013 18:58:22 -316.679370 0.1348 BFGS: 4014 18:58:23 -316.680051 0.1306 BFGS: 4015 18:58:24 -316.686299 0.1396 BFGS: 4016 18:58:25 -316.680671 0.1264 BFGS: 4017 18:58:26 -316.686670 0.1351 BFGS: 4018 18:58:27 -316.686837 0.1325 BFGS: 4019 18:58:28 -316.679502 0.1350 BFGS: 4020 18:58:30 -316.680172 0.1299 BFGS: 4021 18:58:31 -316.686170 0.1415 BFGS: 4022 18:58:32 -316.686874 0.1321 BFGS: 4023 18:58:32 -316.679463 0.1345 BFGS: 4024 18:58:33 -316.680137 0.1302 BFGS: 4025 18:58:34 -316.686209 0.1408 BFGS: 4026 18:58:36 -316.686908 0.1317 BFGS: 4027 18:58:37 -316.679429 0.1344 BFGS: 4028 18:58:38 -316.680105 0.1303 BFGS: 4029 18:58:39 -316.686244 0.1403 BFGS: 4030 18:58:39 -316.686938 0.1312 BFGS: 4031 18:58:40 -316.679398 0.1346 BFGS: 4032 18:58:41 -316.680077 0.1305 BFGS: 4033 18:58:41 -316.686275 0.1399 BFGS: 4034 18:58:42 -316.686965 0.1307 BFGS: 4035 18:58:43 -316.679371 0.1347 BFGS: 4036 18:58:44 -316.680052 0.1306 BFGS: 4037 18:58:45 -316.686302 0.1396 BFGS: 4038 18:58:46 -316.680672 0.1264 BFGS: 4039 18:58:46 -316.686674 0.1351 BFGS: 4040 18:58:47 -316.686840 0.1325 BFGS: 4041 18:58:48 -316.679503 0.1350 BFGS: 4042 18:58:49 -316.680173 0.1299 BFGS: 4043 18:58:49 -316.686173 0.1415 BFGS: 4044 18:58:51 -316.686878 0.1321 BFGS: 4045 18:58:52 -316.679464 0.1345 BFGS: 4046 18:58:53 -316.680137 0.1301 BFGS: 4047 18:58:53 -316.686212 0.1408 BFGS: 4048 18:58:54 -316.686912 0.1317 BFGS: 4049 18:58:55 -316.679430 0.1344 BFGS: 4050 18:58:55 -316.680106 0.1303 BFGS: 4051 18:58:56 -316.686248 0.1404 BFGS: 4052 18:58:57 -316.686942 0.1312 BFGS: 4053 18:58:59 -316.679399 0.1346 BFGS: 4054 18:58:59 -316.680078 0.1305 BFGS: 4055 18:58:59 -316.686279 0.1399 BFGS: 4056 18:59:00 -316.686969 0.1307 BFGS: 4057 18:59:01 -316.679372 0.1347 BFGS: 4058 18:59:02 -316.680052 0.1306 BFGS: 4059 18:59:03 -316.686306 0.1396 BFGS: 4060 18:59:04 -316.680672 0.1263 BFGS: 4061 18:59:05 -316.686677 0.1351 BFGS: 4062 18:59:05 -316.686844 0.1325 BFGS: 4063 18:59:07 -316.679503 0.1349 BFGS: 4064 18:59:08 -316.680173 0.1299 BFGS: 4065 18:59:08 -316.686177 0.1415 BFGS: 4066 18:59:09 -316.686882 0.1321 BFGS: 4067 18:59:11 -316.679465 0.1345 BFGS: 4068 18:59:11 -316.680138 0.1301 BFGS: 4069 18:59:12 -316.686216 0.1408 BFGS: 4070 18:59:13 -316.686915 0.1317 BFGS: 4071 18:59:13 -316.679430 0.1344 BFGS: 4072 18:59:14 -316.680106 0.1303 BFGS: 4073 18:59:15 -316.686251 0.1403 BFGS: 4074 18:59:15 -316.686946 0.1312 BFGS: 4075 18:59:17 -316.679400 0.1346 BFGS: 4076 18:59:18 -316.680078 0.1304 BFGS: 4077 18:59:19 -316.686282 0.1399 BFGS: 4078 18:59:20 -316.686972 0.1307 BFGS: 4079 18:59:21 -316.679372 0.1347 BFGS: 4080 18:59:22 -316.680053 0.1306 BFGS: 4081 18:59:22 -316.686310 0.1396 BFGS: 4082 18:59:23 -316.680672 0.1263 BFGS: 4083 18:59:23 -316.686681 0.1351 BFGS: 4084 18:59:24 -316.686848 0.1325 BFGS: 4085 18:59:26 -316.679504 0.1349 BFGS: 4086 18:59:26 -316.680174 0.1299 BFGS: 4087 18:59:27 -316.686181 0.1415 BFGS: 4088 18:59:28 -316.686885 0.1321 BFGS: 4089 18:59:28 -316.679465 0.1344 BFGS: 4090 18:59:30 -316.680138 0.1301 BFGS: 4091 18:59:31 -316.686220 0.1408 BFGS: 4092 18:59:32 -316.686919 0.1317 BFGS: 4093 18:59:32 -316.679431 0.1344 BFGS: 4094 18:59:34 -316.680106 0.1303 BFGS: 4095 18:59:35 -316.686255 0.1403 BFGS: 4096 18:59:35 -316.686949 0.1312 BFGS: 4097 18:59:35 -316.679400 0.1345 BFGS: 4098 18:59:36 -316.680078 0.1304 BFGS: 4099 18:59:37 -316.686287 0.1399 BFGS: 4100 18:59:38 -316.686976 0.1307 BFGS: 4101 18:59:39 -316.679373 0.1347 BFGS: 4102 18:59:40 -316.680053 0.1306 BFGS: 4103 18:59:40 -316.686314 0.1395 BFGS: 4104 18:59:41 -316.680672 0.1263 BFGS: 4105 18:59:43 -316.686685 0.1351 BFGS: 4106 18:59:44 -316.686851 0.1325 BFGS: 4107 18:59:45 -316.679505 0.1349 BFGS: 4108 18:59:46 -316.680174 0.1299 BFGS: 4109 18:59:47 -316.686185 0.1415 BFGS: 4110 18:59:47 -316.686889 0.1321 BFGS: 4111 18:59:48 -316.679466 0.1344 BFGS: 4112 18:59:49 -316.680139 0.1301 BFGS: 4113 18:59:50 -316.686224 0.1408 BFGS: 4114 18:59:51 -316.686923 0.1317 BFGS: 4115 18:59:51 -316.679431 0.1344 BFGS: 4116 18:59:52 -316.680107 0.1303 BFGS: 4117 18:59:52 -316.686259 0.1403 BFGS: 4118 18:59:52 -316.686953 0.1312 BFGS: 4119 18:59:52 -316.679401 0.1345 BFGS: 4120 18:59:53 -316.680079 0.1304 BFGS: 4121 18:59:53 -316.686291 0.1399 BFGS: 4122 18:59:54 -316.686980 0.1307 BFGS: 4123 18:59:54 -316.679373 0.1347 BFGS: 4124 18:59:55 -316.680054 0.1306 BFGS: 4125 18:59:56 -316.686318 0.1396 BFGS: 4126 18:59:56 -316.680673 0.1263 BFGS: 4127 18:59:57 -316.686689 0.1351 BFGS: 4128 18:59:57 -316.686855 0.1325 BFGS: 4129 18:59:58 -316.679505 0.1349 BFGS: 4130 18:59:59 -316.680174 0.1299 BFGS: 4131 19:00:00 -316.686189 0.1415 BFGS: 4132 19:00:01 -316.686893 0.1321 BFGS: 4133 19:00:02 -316.679466 0.1344 BFGS: 4134 19:00:03 -316.680139 0.1301 BFGS: 4135 19:00:04 -316.686228 0.1408 BFGS: 4136 19:00:05 -316.686927 0.1317 BFGS: 4137 19:00:05 -316.679432 0.1344 BFGS: 4138 19:00:06 -316.680107 0.1303 BFGS: 4139 19:00:07 -316.686263 0.1403 BFGS: 4140 19:00:08 -316.686957 0.1311 BFGS: 4141 19:00:09 -316.679401 0.1345 BFGS: 4142 19:00:11 -316.680079 0.1304 BFGS: 4143 19:00:12 -316.686295 0.1399 BFGS: 4144 19:00:13 -316.686984 0.1306 BFGS: 4145 19:00:14 -316.679374 0.1347 BFGS: 4146 19:00:15 -316.680054 0.1306 BFGS: 4147 19:00:17 -316.686322 0.1396 BFGS: 4148 19:00:17 -316.680673 0.1263 BFGS: 4149 19:00:18 -316.686693 0.1351 BFGS: 4150 19:00:19 -316.686859 0.1325 BFGS: 4151 19:00:20 -316.679506 0.1349 BFGS: 4152 19:00:21 -316.680175 0.1299 BFGS: 4153 19:00:22 -316.686193 0.1415 BFGS: 4154 19:00:22 -316.686897 0.1321 BFGS: 4155 19:00:24 -316.679467 0.1344 BFGS: 4156 19:00:24 -316.680139 0.1301 BFGS: 4157 19:00:24 -316.686232 0.1408 BFGS: 4158 19:00:25 -316.686931 0.1316 BFGS: 4159 19:00:27 -316.679432 0.1344 BFGS: 4160 19:00:27 -316.680107 0.1302 BFGS: 4161 19:00:28 -316.686267 0.1403 BFGS: 4162 19:00:28 -316.686961 0.1311 BFGS: 4163 19:00:30 -316.679402 0.1345 BFGS: 4164 19:00:30 -316.680079 0.1304 BFGS: 4165 19:00:31 -316.686299 0.1399 BFGS: 4166 19:00:32 -316.686988 0.1306 BFGS: 4167 19:00:33 -316.679374 0.1347 BFGS: 4168 19:00:34 -316.680054 0.1306 BFGS: 4169 19:00:34 -316.686326 0.1396 BFGS: 4170 19:00:36 -316.680673 0.1263 BFGS: 4171 19:00:37 -316.686697 0.1351 BFGS: 4172 19:00:38 -316.686863 0.1325 BFGS: 4173 19:00:39 -316.679506 0.1349 BFGS: 4174 19:00:40 -316.680175 0.1299 BFGS: 4175 19:00:41 -316.686197 0.1415 BFGS: 4176 19:00:42 -316.686901 0.1321 BFGS: 4177 19:00:43 -316.679467 0.1344 BFGS: 4178 19:00:44 -316.680139 0.1301 BFGS: 4179 19:00:45 -316.686236 0.1408 BFGS: 4180 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19:22:55 -316.686433 0.1405 BFGS: 5660 19:22:55 -316.680765 0.1251 BFGS: 5661 19:22:56 -316.686808 0.1359 BFGS: 5662 19:22:57 -316.686974 0.1334 BFGS: 5663 19:22:58 -316.679623 0.1336 BFGS: 5664 19:22:59 -316.680272 0.1287 BFGS: 5665 19:22:59 -316.686317 0.1423 BFGS: 5666 19:23:01 -316.687020 0.1329 BFGS: 5667 19:23:02 -316.679573 0.1331 BFGS: 5668 19:23:02 -316.680227 0.1290 BFGS: 5669 19:23:03 -316.686366 0.1415 BFGS: 5670 19:23:04 -316.687063 0.1323 BFGS: 5671 19:23:05 -316.679530 0.1332 BFGS: 5672 19:23:06 -316.680187 0.1292 BFGS: 5673 19:23:06 -316.686410 0.1409 BFGS: 5674 19:23:07 -316.687101 0.1315 BFGS: 5675 19:23:08 -316.679491 0.1334 BFGS: 5676 19:23:09 -316.680152 0.1294 BFGS: 5677 19:23:10 -316.686449 0.1404 BFGS: 5678 19:23:11 -316.680753 0.1252 BFGS: 5679 19:23:11 -316.686822 0.1357 BFGS: 5680 19:23:13 -316.686988 0.1332 BFGS: 5681 19:23:14 -316.679615 0.1337 BFGS: 5682 19:23:15 -316.680262 0.1288 BFGS: 5683 19:23:16 -316.686330 0.1422 BFGS: 5684 19:23:17 -316.687031 0.1328 BFGS: 5685 19:23:18 -316.679565 0.1332 BFGS: 5686 19:23:18 -316.680219 0.1291 BFGS: 5687 19:23:19 -316.686376 0.1414 BFGS: 5688 19:23:20 -316.687072 0.1322 BFGS: 5689 19:23:20 -316.679524 0.1333 BFGS: 5690 19:23:22 -316.680181 0.1293 BFGS: 5691 19:23:23 -316.686420 0.1408 BFGS: 5692 19:23:24 -316.680780 0.1250 BFGS: 5693 19:23:25 -316.686796 0.1361 BFGS: 5694 19:23:26 -316.686963 0.1336 BFGS: 5695 19:23:26 -316.679641 0.1335 BFGS: 5696 19:23:27 -316.680287 0.1286 BFGS: 5697 19:23:27 -316.686305 0.1425 BFGS: 5698 19:23:28 -316.687010 0.1331 BFGS: 5699 19:23:29 -316.679589 0.1330 BFGS: 5700 19:23:29 -316.680241 0.1289 BFGS: 5701 19:23:31 -316.686354 0.1417 BFGS: 5702 19:23:32 -316.687053 0.1325 BFGS: 5703 19:23:33 -316.679544 0.1331 BFGS: 5704 19:23:34 -316.680200 0.1291 BFGS: 5705 19:23:34 -316.686399 0.1411 BFGS: 5706 19:23:35 -316.687092 0.1318 BFGS: 5707 19:23:36 -316.679505 0.1333 BFGS: 5708 19:23:37 -316.680164 0.1293 BFGS: 5709 19:23:39 -316.686439 0.1405 BFGS: 5710 19:23:40 -316.680764 0.1251 BFGS: 5711 19:23:40 -316.686814 0.1359 BFGS: 5712 19:23:42 -316.686980 0.1334 BFGS: 5713 19:23:43 -316.679623 0.1335 BFGS: 5714 19:23:44 -316.680271 0.1287 BFGS: 5715 19:23:45 -316.686324 0.1422 BFGS: 5716 19:23:46 -316.687027 0.1329 BFGS: 5717 19:23:47 -316.679573 0.1331 BFGS: 5718 19:23:47 -316.680226 0.1290 BFGS: 5719 19:23:49 -316.686372 0.1415 BFGS: 5720 19:23:51 -316.687069 0.1323 BFGS: 5721 19:23:52 -316.679530 0.1332 BFGS: 5722 19:23:53 -316.680187 0.1292 BFGS: 5723 19:23:54 -316.686416 0.1409 BFGS: 5724 19:23:55 -316.680786 0.1249 BFGS: 5725 19:23:55 -316.686793 0.1362 BFGS: 5726 19:23:56 -316.686960 0.1337 BFGS: 5727 19:23:57 -316.679645 0.1334 BFGS: 5728 19:23:58 -316.680291 0.1286 BFGS: 5729 19:24:00 -316.686303 0.1425 BFGS: 5730 19:24:02 -316.687009 0.1332 BFGS: 5731 19:24:04 -316.679593 0.1330 BFGS: 5732 19:24:05 -316.680245 0.1289 BFGS: 5733 19:24:06 -316.686354 0.1417 BFGS: 5734 19:24:06 -316.687053 0.1325 BFGS: 5735 19:24:08 -316.679548 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0.1406 BFGS: 5838 19:25:55 -316.680769 0.1251 BFGS: 5839 19:25:56 -316.686823 0.1359 BFGS: 5840 19:25:58 -316.686989 0.1334 BFGS: 5841 19:25:58 -316.679629 0.1334 BFGS: 5842 19:25:59 -316.680276 0.1286 BFGS: 5843 19:26:00 -316.686334 0.1423 BFGS: 5844 19:26:00 -316.687036 0.1329 BFGS: 5845 19:26:01 -316.679579 0.1330 BFGS: 5846 19:26:03 -316.680231 0.1290 BFGS: 5847 19:26:04 -316.686382 0.1415 BFGS: 5848 19:26:05 -316.687078 0.1323 BFGS: 5849 19:26:06 -316.679536 0.1332 BFGS: 5850 19:26:07 -316.680191 0.1292 BFGS: 5851 19:26:08 -316.686426 0.1409 BFGS: 5852 19:26:09 -316.680789 0.1249 BFGS: 5853 19:26:10 -316.686803 0.1362 BFGS: 5854 19:26:11 -316.686970 0.1337 BFGS: 5855 19:26:12 -316.679650 0.1333 BFGS: 5856 19:26:12 -316.680295 0.1285 BFGS: 5857 19:26:14 -316.686314 0.1425 BFGS: 5858 19:26:15 -316.687019 0.1332 BFGS: 5859 19:26:16 -316.679598 0.1329 BFGS: 5860 19:26:17 -316.680248 0.1288 BFGS: 5861 19:26:19 -316.686365 0.1417 BFGS: 5862 19:26:20 -316.687064 0.1325 BFGS: 5863 19:26:20 -316.679553 0.1330 BFGS: 5864 19:26:21 -316.680207 0.1290 BFGS: 5865 19:26:22 -316.686411 0.1411 BFGS: 5866 19:26:22 -316.687103 0.1318 BFGS: 5867 19:26:23 -316.679512 0.1333 BFGS: 5868 19:26:28 -316.680170 0.1293 BFGS: 5869 19:26:30 -316.686452 0.1406 BFGS: 5870 19:26:32 -316.680769 0.1251 BFGS: 5871 19:26:34 -316.686826 0.1359 BFGS: 5872 19:26:35 -316.686992 0.1334 BFGS: 5873 19:26:36 -316.679630 0.1334 BFGS: 5874 19:26:36 -316.680276 0.1286 BFGS: 5875 19:26:38 -316.686337 0.1423 BFGS: 5876 19:26:38 -316.687039 0.1329 BFGS: 5877 19:26:40 -316.679580 0.1330 BFGS: 5878 19:26:40 -316.680231 0.1289 BFGS: 5879 19:26:41 -316.686386 0.1415 BFGS: 5880 19:26:43 -316.687082 0.1323 BFGS: 5881 19:26:44 -316.679537 0.1332 BFGS: 5882 19:26:44 -316.680192 0.1291 BFGS: 5883 19:26:45 -316.686430 0.1409 BFGS: 5884 19:26:46 -316.680789 0.1249 BFGS: 5885 19:26:47 -316.686806 0.1362 BFGS: 5886 19:26:48 -316.686973 0.1337 BFGS: 5887 19:26:49 -316.679651 0.1333 BFGS: 5888 19:26:49 -316.680296 0.1285 BFGS: 5889 19:26:51 -316.686318 0.1425 BFGS: 5890 19:26:53 -316.687022 0.1332 BFGS: 5891 19:26:53 -316.679599 0.1329 BFGS: 5892 19:26:54 -316.680249 0.1288 BFGS: 5893 19:26:54 -316.686368 0.1417 BFGS: 5894 19:26:55 -316.687067 0.1325 BFGS: 5895 19:26:57 -316.679553 0.1330 BFGS: 5896 19:26:59 -316.680207 0.1290 BFGS: 5897 19:27:00 -316.686414 0.1411 BFGS: 5898 19:27:01 -316.687106 0.1318 BFGS: 5899 19:27:02 -316.679513 0.1332 BFGS: 5900 19:27:03 -316.680170 0.1293 BFGS: 5901 19:27:04 -316.686455 0.1405 BFGS: 5902 19:27:05 -316.680769 0.1250 BFGS: 5903 19:27:06 -316.686829 0.1359 BFGS: 5904 19:27:07 -316.686995 0.1334 BFGS: 5905 19:27:08 -316.679630 0.1334 BFGS: 5906 19:27:09 -316.680277 0.1286 BFGS: 5907 19:27:10 -316.686341 0.1423 BFGS: 5908 19:27:10 -316.687042 0.1329 BFGS: 5909 19:27:11 -316.679581 0.1330 BFGS: 5910 19:27:11 -316.680232 0.1289 BFGS: 5911 19:27:12 -316.686389 0.1415 BFGS: 5912 19:27:14 -316.687085 0.1323 BFGS: 5913 19:27:15 -316.679537 0.1331 BFGS: 5914 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19:29:59 -316.686374 0.1419 BFGS: 6068 19:30:00 -316.687072 0.1327 BFGS: 6069 19:30:02 -316.679568 0.1329 BFGS: 6070 19:30:02 -316.680219 0.1289 BFGS: 6071 19:30:03 -316.686421 0.1412 BFGS: 6072 19:30:04 -316.687113 0.1319 BFGS: 6073 19:30:05 -316.679526 0.1331 BFGS: 6074 19:30:06 -316.680181 0.1292 BFGS: 6075 19:30:07 -316.686463 0.1406 BFGS: 6076 19:30:07 -316.680778 0.1249 BFGS: 6077 19:30:08 -316.686838 0.1360 BFGS: 6078 19:30:09 -316.687004 0.1335 BFGS: 6079 19:30:10 -316.679642 0.1333 BFGS: 6080 19:30:11 -316.680286 0.1285 BFGS: 6081 19:30:12 -316.686350 0.1424 BFGS: 6082 19:30:14 -316.687051 0.1330 BFGS: 6083 19:30:14 -316.679591 0.1329 BFGS: 6084 19:30:16 -316.680240 0.1289 BFGS: 6085 19:30:17 -316.686400 0.1416 BFGS: 6086 19:30:17 -316.687095 0.1323 BFGS: 6087 19:30:19 -316.679547 0.1330 BFGS: 6088 19:30:20 -316.680200 0.1290 BFGS: 6089 19:30:21 -316.686444 0.1409 BFGS: 6090 19:30:22 -316.680795 0.1248 BFGS: 6091 19:30:23 -316.686821 0.1362 BFGS: 6092 19:30:24 -316.686988 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19:30:49 -316.687102 0.1323 BFGS: 6119 19:30:50 -316.679544 0.1331 BFGS: 6120 19:30:51 -316.680197 0.1291 BFGS: 6121 19:30:53 -316.686452 0.1409 BFGS: 6122 19:30:54 -316.680792 0.1248 BFGS: 6123 19:30:55 -316.686828 0.1362 BFGS: 6124 19:30:56 -316.686994 0.1337 BFGS: 6125 19:30:57 -316.679657 0.1332 BFGS: 6126 19:30:58 -316.680300 0.1284 BFGS: 6127 19:31:00 -316.686340 0.1425 BFGS: 6128 19:31:01 -316.687043 0.1332 BFGS: 6129 19:31:02 -316.679605 0.1328 BFGS: 6130 19:31:03 -316.680253 0.1288 BFGS: 6131 19:31:04 -316.686391 0.1417 BFGS: 6132 19:31:05 -316.687088 0.1325 BFGS: 6133 19:31:06 -316.679559 0.1329 BFGS: 6134 19:31:07 -316.680211 0.1290 BFGS: 6135 19:31:08 -316.686437 0.1411 BFGS: 6136 19:31:09 -316.680805 0.1247 BFGS: 6137 19:31:09 -316.686815 0.1364 BFGS: 6138 19:31:10 -316.686982 0.1339 BFGS: 6139 19:31:11 -316.679671 0.1330 BFGS: 6140 19:31:12 -316.680312 0.1284 BFGS: 6141 19:31:13 -316.686328 0.1428 BFGS: 6142 19:31:14 -316.687032 0.1334 BFGS: 6143 19:31:15 -316.679617 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19:32:37 -316.687047 0.1333 BFGS: 6221 19:32:38 -316.679611 0.1327 BFGS: 6222 19:32:39 -316.680258 0.1287 BFGS: 6223 19:32:39 -316.686395 0.1418 BFGS: 6224 19:32:40 -316.687092 0.1326 BFGS: 6225 19:32:41 -316.679565 0.1329 BFGS: 6226 19:32:42 -316.680216 0.1289 BFGS: 6227 19:32:44 -316.686442 0.1411 BFGS: 6228 19:32:45 -316.680809 0.1247 BFGS: 6229 19:32:46 -316.686820 0.1364 BFGS: 6230 19:32:46 -316.686987 0.1339 BFGS: 6231 19:32:48 -316.679676 0.1330 BFGS: 6232 19:32:48 -316.680317 0.1283 BFGS: 6233 19:32:50 -316.686333 0.1427 BFGS: 6234 19:32:51 -316.687037 0.1334 BFGS: 6235 19:32:52 -316.679622 0.1326 BFGS: 6236 19:32:52 -316.680268 0.1286 BFGS: 6237 19:32:54 -316.686386 0.1419 BFGS: 6238 19:32:54 -316.687084 0.1327 BFGS: 6239 19:32:55 -316.679575 0.1328 BFGS: 6240 19:32:56 -316.680225 0.1288 BFGS: 6241 19:32:57 -316.686434 0.1412 BFGS: 6242 19:32:58 -316.687125 0.1319 BFGS: 6243 19:32:59 -316.679533 0.1330 BFGS: 6244 19:33:00 -316.680186 0.1291 BFGS: 6245 19:33:01 -316.686476 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19:35:39 -316.680221 0.1288 BFGS: 6425 19:35:40 -316.686458 0.1411 BFGS: 6426 19:35:41 -316.680812 0.1246 BFGS: 6427 19:35:41 -316.686835 0.1363 BFGS: 6428 19:35:42 -316.687002 0.1339 BFGS: 6429 19:35:43 -316.679683 0.1330 BFGS: 6430 19:35:44 -316.680321 0.1282 BFGS: 6431 19:35:45 -316.686350 0.1427 BFGS: 6432 19:35:46 -316.687052 0.1334 BFGS: 6433 19:35:48 -316.679628 0.1326 BFGS: 6434 19:35:49 -316.680272 0.1286 BFGS: 6435 19:35:50 -316.686403 0.1419 BFGS: 6436 19:35:51 -316.687099 0.1327 BFGS: 6437 19:35:52 -316.679581 0.1328 BFGS: 6438 19:35:54 -316.680229 0.1288 BFGS: 6439 19:35:55 -316.686451 0.1412 BFGS: 6440 19:35:55 -316.680820 0.1246 BFGS: 6441 19:35:57 -316.686829 0.1365 BFGS: 6442 19:35:58 -316.686995 0.1340 BFGS: 6443 19:35:59 -316.679690 0.1329 BFGS: 6444 19:35:59 -316.680328 0.1282 BFGS: 6445 19:36:01 -316.686343 0.1428 BFGS: 6446 19:36:01 -316.687047 0.1335 BFGS: 6447 19:36:03 -316.679635 0.1325 BFGS: 6448 19:36:04 -316.680278 0.1285 BFGS: 6449 19:36:04 -316.686397 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19:37:14 -316.680253 0.1287 BFGS: 6527 19:37:14 -316.686433 0.1416 BFGS: 6528 19:37:15 -316.687126 0.1323 BFGS: 6529 19:37:16 -316.679563 0.1329 BFGS: 6530 19:37:16 -316.680212 0.1289 BFGS: 6531 19:37:17 -316.686479 0.1410 BFGS: 6532 19:37:18 -316.680803 0.1247 BFGS: 6533 19:37:19 -316.686854 0.1362 BFGS: 6534 19:37:20 -316.687020 0.1337 BFGS: 6535 19:37:21 -316.679676 0.1330 BFGS: 6536 19:37:22 -316.680314 0.1283 BFGS: 6537 19:37:22 -316.686370 0.1426 BFGS: 6538 19:37:23 -316.687070 0.1333 BFGS: 6539 19:37:23 -316.679621 0.1326 BFGS: 6540 19:37:24 -316.680265 0.1286 BFGS: 6541 19:37:25 -316.686421 0.1418 BFGS: 6542 19:37:26 -316.687116 0.1325 BFGS: 6543 19:37:27 -316.679575 0.1328 BFGS: 6544 19:37:28 -316.680223 0.1288 BFGS: 6545 19:37:29 -316.686469 0.1411 BFGS: 6546 19:37:30 -316.680813 0.1246 BFGS: 6547 19:37:30 -316.686845 0.1363 BFGS: 6548 19:37:31 -316.687011 0.1339 BFGS: 6549 19:37:32 -316.679686 0.1329 BFGS: 6550 19:37:33 -316.680323 0.1282 BFGS: 6551 19:37:34 -316.686360 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20:08:21 -316.686584 0.1416 BFGS: 8618 20:08:22 -316.680854 0.1242 BFGS: 8619 20:08:23 -316.686957 0.1363 BFGS: 8620 20:08:24 -316.687120 0.1339 BFGS: 8621 20:08:25 -316.679759 0.1319 BFGS: 8622 20:08:26 -316.680375 0.1277 BFGS: 8623 20:08:27 -316.686482 0.1428 BFGS: 8624 20:08:27 -316.687171 0.1338 BFGS: 8625 20:08:28 -316.679695 0.1315 BFGS: 8626 20:08:28 -316.680322 0.1281 BFGS: 8627 20:08:30 -316.686535 0.1419 BFGS: 8628 20:08:31 -316.680896 0.1239 BFGS: 8629 20:08:32 -316.686911 0.1374 BFGS: 8630 20:08:33 -316.687077 0.1348 BFGS: 8631 20:08:35 -316.679791 0.1316 BFGS: 8632 20:08:37 -316.680410 0.1274 BFGS: 8633 20:08:38 -316.686440 0.1437 BFGS: 8634 20:08:39 -316.687137 0.1339 BFGS: 8635 20:08:40 -316.679735 0.1317 BFGS: 8636 20:08:40 -316.680356 0.1278 BFGS: 8637 20:08:41 -316.686502 0.1424 BFGS: 8638 20:08:42 -316.687190 0.1334 BFGS: 8639 20:08:43 -316.679680 0.1316 BFGS: 8640 20:08:44 -316.680306 0.1282 BFGS: 8641 20:08:47 -316.686553 0.1415 BFGS: 8642 20:08:48 -316.680881 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20:09:11 -316.680288 0.1281 BFGS: 8669 20:09:12 -316.686576 0.1416 BFGS: 8670 20:09:13 -316.680864 0.1241 BFGS: 8671 20:09:14 -316.686949 0.1365 BFGS: 8672 20:09:14 -316.687113 0.1341 BFGS: 8673 20:09:15 -316.679768 0.1318 BFGS: 8674 20:09:16 -316.680384 0.1277 BFGS: 8675 20:09:17 -316.686476 0.1430 BFGS: 8676 20:09:19 -316.687166 0.1338 BFGS: 8677 20:09:20 -316.679705 0.1315 BFGS: 8678 20:09:22 -316.680330 0.1280 BFGS: 8679 20:09:23 -316.686530 0.1420 BFGS: 8680 20:09:24 -316.687216 0.1326 BFGS: 8681 20:09:24 -316.679655 0.1321 BFGS: 8682 20:09:25 -316.680284 0.1280 BFGS: 8683 20:09:26 -316.686582 0.1416 BFGS: 8684 20:09:27 -316.680859 0.1241 BFGS: 8685 20:09:28 -316.686955 0.1364 BFGS: 8686 20:09:29 -316.687119 0.1340 BFGS: 8687 20:09:30 -316.679764 0.1318 BFGS: 8688 20:09:31 -316.680380 0.1277 BFGS: 8689 20:09:32 -316.686481 0.1429 BFGS: 8690 20:09:33 -316.687170 0.1338 BFGS: 8691 20:09:34 -316.679701 0.1315 BFGS: 8692 20:09:35 -316.680326 0.1281 BFGS: 8693 20:09:36 -316.686534 0.1420 BFGS: 8694 20:09:37 -316.687220 0.1324 BFGS: 8695 20:09:38 -316.679651 0.1322 BFGS: 8696 20:09:38 -316.680280 0.1280 BFGS: 8697 20:09:39 -316.686586 0.1416 BFGS: 8698 20:09:40 -316.680856 0.1242 BFGS: 8699 20:09:42 -316.686959 0.1363 BFGS: 8700 20:09:44 -316.687123 0.1339 BFGS: 8701 20:09:45 -316.679762 0.1319 BFGS: 8702 20:09:46 -316.680377 0.1277 BFGS: 8703 20:09:47 -316.686485 0.1429 BFGS: 8704 20:09:48 -316.687173 0.1338 BFGS: 8705 20:09:49 -316.679698 0.1315 BFGS: 8706 20:09:50 -316.680324 0.1281 BFGS: 8707 20:09:50 -316.686538 0.1419 BFGS: 8708 20:09:51 -316.680898 0.1239 BFGS: 8709 20:09:51 -316.686914 0.1374 BFGS: 8710 20:09:52 -316.687080 0.1348 BFGS: 8711 20:09:53 -316.679794 0.1316 BFGS: 8712 20:09:53 -316.680411 0.1274 BFGS: 8713 20:09:54 -316.686443 0.1437 BFGS: 8714 20:09:55 -316.687140 0.1339 BFGS: 8715 20:09:56 -316.679737 0.1317 BFGS: 8716 20:09:57 -316.680358 0.1278 BFGS: 8717 20:09:59 -316.686505 0.1424 BFGS: 8718 20:10:01 -316.687193 0.1334 BFGS: 8719 20:10:02 -316.679682 0.1316 BFGS: 8720 20:10:03 -316.680308 0.1282 BFGS: 8721 20:10:04 -316.686557 0.1415 BFGS: 8722 20:10:05 -316.680882 0.1239 BFGS: 8723 20:10:06 -316.686932 0.1370 BFGS: 8724 20:10:07 -316.687097 0.1345 BFGS: 8725 20:10:08 -316.679782 0.1317 BFGS: 8726 20:10:09 -316.680399 0.1275 BFGS: 8727 20:10:10 -316.686460 0.1433 BFGS: 8728 20:10:11 -316.687154 0.1339 BFGS: 8729 20:10:12 -316.679722 0.1316 BFGS: 8730 20:10:13 -316.680345 0.1279 BFGS: 8731 20:10:14 -316.686519 0.1422 BFGS: 8732 20:10:15 -316.687206 0.1331 BFGS: 8733 20:10:16 -316.679669 0.1318 BFGS: 8734 20:10:17 -316.680297 0.1281 BFGS: 8735 20:10:17 -316.686571 0.1416 BFGS: 8736 20:10:18 -316.680871 0.1240 BFGS: 8737 20:10:19 -316.686945 0.1367 BFGS: 8738 20:10:20 -316.687109 0.1342 BFGS: 8739 20:10:20 -316.679774 0.1317 BFGS: 8740 20:10:21 -316.680390 0.1276 BFGS: 8741 20:10:22 -316.686472 0.1432 BFGS: 8742 20:10:23 -316.687163 0.1339 BFGS: 8743 20:10:24 -316.679713 0.1315 BFGS: 8744 20:10:24 -316.680337 0.1280 BFGS: 8745 20:10:26 -316.686528 0.1421 BFGS: 8746 20:10:26 -316.687214 0.1328 BFGS: 8747 20:10:27 -316.679661 0.1320 BFGS: 8748 20:10:27 -316.680289 0.1280 BFGS: 8749 20:10:28 -316.686580 0.1416 BFGS: 8750 20:10:29 -316.680864 0.1241 BFGS: 8751 20:10:30 -316.686953 0.1365 BFGS: 8752 20:10:32 -316.687117 0.1341 BFGS: 8753 20:10:32 -316.679769 0.1318 BFGS: 8754 20:10:33 -316.680385 0.1276 BFGS: 8755 20:10:34 -316.686480 0.1430 BFGS: 8756 20:10:35 -316.687170 0.1338 BFGS: 8757 20:10:36 -316.679706 0.1315 BFGS: 8758 20:10:37 -316.680331 0.1280 BFGS: 8759 20:10:38 -316.686534 0.1420 BFGS: 8760 20:10:38 -316.687220 0.1326 BFGS: 8761 20:10:40 -316.679655 0.1321 BFGS: 8762 20:10:40 -316.680284 0.1280 BFGS: 8763 20:10:41 -316.686586 0.1416 BFGS: 8764 20:10:42 -316.680859 0.1241 BFGS: 8765 20:10:43 -316.686959 0.1364 BFGS: 8766 20:10:44 -316.687123 0.1340 BFGS: 8767 20:10:44 -316.679765 0.1318 BFGS: 8768 20:10:45 -316.680381 0.1277 BFGS: 8769 20:10:46 -316.686486 0.1429 BFGS: 8770 20:10:46 -316.687174 0.1338 BFGS: 8771 20:10:47 -316.679702 0.1315 BFGS: 8772 20:10:47 -316.680327 0.1280 BFGS: 8773 20:10:48 -316.686539 0.1420 BFGS: 8774 20:10:49 -316.680900 0.1239 BFGS: 8775 20:10:50 -316.686915 0.1374 BFGS: 8776 20:10:50 -316.687081 0.1348 BFGS: 8777 20:10:51 -316.679797 0.1315 BFGS: 8778 20:10:52 -316.680414 0.1274 BFGS: 8779 20:10:53 -316.686444 0.1437 BFGS: 8780 20:10:54 -316.687142 0.1340 BFGS: 8781 20:10:55 -316.679739 0.1317 BFGS: 8782 20:10:55 -316.680360 0.1278 BFGS: 8783 20:10:56 -316.686507 0.1425 BFGS: 8784 20:10:57 -316.687195 0.1334 BFGS: 8785 20:10:58 -316.679684 0.1316 BFGS: 8786 20:10:59 -316.680310 0.1282 BFGS: 8787 20:11:00 -316.686559 0.1416 BFGS: 8788 20:11:01 -316.680884 0.1238 BFGS: 8789 20:11:02 -316.686934 0.1370 BFGS: 8790 20:11:03 -316.687099 0.1345 BFGS: 8791 20:11:04 -316.679784 0.1316 BFGS: 8792 20:11:05 -316.680401 0.1275 BFGS: 8793 20:11:06 -316.686463 0.1434 BFGS: 8794 20:11:06 -316.687156 0.1339 BFGS: 8795 20:11:07 -316.679724 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20:11:30 -316.686483 0.1430 BFGS: 8822 20:11:31 -316.687173 0.1339 BFGS: 8823 20:11:32 -316.679707 0.1315 BFGS: 8824 20:11:33 -316.680332 0.1280 BFGS: 8825 20:11:34 -316.686537 0.1420 BFGS: 8826 20:11:34 -316.687223 0.1326 BFGS: 8827 20:11:35 -316.679657 0.1321 BFGS: 8828 20:11:36 -316.680285 0.1280 BFGS: 8829 20:11:37 -316.686590 0.1416 BFGS: 8830 20:11:38 -316.680860 0.1241 BFGS: 8831 20:11:38 -316.686963 0.1364 BFGS: 8832 20:11:39 -316.687126 0.1340 BFGS: 8833 20:11:40 -316.679767 0.1318 BFGS: 8834 20:11:40 -316.680381 0.1277 BFGS: 8835 20:11:41 -316.686489 0.1429 BFGS: 8836 20:11:42 -316.687178 0.1338 BFGS: 8837 20:11:43 -316.679703 0.1315 BFGS: 8838 20:11:43 -316.680328 0.1280 BFGS: 8839 20:11:44 -316.686542 0.1420 BFGS: 8840 20:11:45 -316.680901 0.1239 BFGS: 8841 20:11:46 -316.686919 0.1374 BFGS: 8842 20:11:47 -316.687084 0.1349 BFGS: 8843 20:11:47 -316.679797 0.1315 BFGS: 8844 20:11:48 -316.680414 0.1274 BFGS: 8845 20:11:49 -316.686448 0.1437 BFGS: 8846 20:11:50 -316.687145 0.1339 BFGS: 8847 20:11:51 -316.679740 0.1317 BFGS: 8848 20:11:51 -316.680361 0.1278 BFGS: 8849 20:11:52 -316.686511 0.1425 BFGS: 8850 20:11:53 -316.687198 0.1334 BFGS: 8851 20:11:53 -316.679685 0.1316 BFGS: 8852 20:11:54 -316.680311 0.1282 BFGS: 8853 20:11:54 -316.686563 0.1415 BFGS: 8854 20:11:55 -316.680884 0.1238 BFGS: 8855 20:11:56 -316.686938 0.1371 BFGS: 8856 20:11:57 -316.687102 0.1345 BFGS: 8857 20:11:57 -316.679785 0.1316 BFGS: 8858 20:11:58 -316.680401 0.1275 BFGS: 8859 20:11:58 -316.686466 0.1434 BFGS: 8860 20:11:59 -316.687160 0.1339 BFGS: 8861 20:12:00 -316.679725 0.1316 BFGS: 8862 20:12:01 -316.680347 0.1279 BFGS: 8863 20:12:01 -316.686525 0.1422 BFGS: 8864 20:12:02 -316.687212 0.1331 BFGS: 8865 20:12:02 -316.679672 0.1318 BFGS: 8866 20:12:03 -316.680298 0.1281 BFGS: 8867 20:12:04 -316.686577 0.1416 BFGS: 8868 20:12:04 -316.680873 0.1240 BFGS: 8869 20:12:05 -316.686951 0.1367 BFGS: 8870 20:12:06 -316.687115 0.1342 BFGS: 8871 20:12:07 -316.679776 0.1317 BFGS: 8872 20:12:08 -316.680392 0.1276 BFGS: 8873 20:12:09 -316.686479 0.1432 BFGS: 8874 20:12:10 -316.687170 0.1339 BFGS: 8875 20:12:12 -316.679715 0.1315 BFGS: 8876 20:12:13 -316.680338 0.1279 BFGS: 8877 20:12:14 -316.686535 0.1421 BFGS: 8878 20:12:15 -316.687221 0.1328 BFGS: 8879 20:12:16 -316.679663 0.1320 BFGS: 8880 20:12:17 -316.680290 0.1280 BFGS: 8881 20:12:18 -316.686587 0.1416 BFGS: 8882 20:12:19 -316.680865 0.1241 BFGS: 8883 20:12:20 -316.686960 0.1365 BFGS: 8884 20:12:21 -316.687124 0.1341 BFGS: 8885 20:12:21 -316.679771 0.1317 BFGS: 8886 20:12:22 -316.680386 0.1276 BFGS: 8887 20:12:23 -316.686487 0.1430 BFGS: 8888 20:12:24 -316.687177 0.1338 BFGS: 8889 20:12:24 -316.679708 0.1315 BFGS: 8890 20:12:25 -316.680332 0.1280 BFGS: 8891 20:12:26 -316.686541 0.1420 BFGS: 8892 20:12:26 -316.680904 0.1238 BFGS: 8893 20:12:27 -316.686918 0.1374 BFGS: 8894 20:12:28 -316.687084 0.1349 BFGS: 8895 20:12:29 -316.679803 0.1315 BFGS: 8896 20:12:30 -316.680419 0.1273 BFGS: 8897 20:12:31 -316.686447 0.1437 BFGS: 8898 20:12:32 -316.687144 0.1341 BFGS: 8899 20:12:33 -316.679744 0.1316 BFGS: 8900 20:12:33 -316.680364 0.1277 BFGS: 8901 20:12:33 -316.686510 0.1425 BFGS: 8902 20:12:34 -316.687198 0.1334 BFGS: 8903 20:12:35 -316.679688 0.1316 BFGS: 8904 20:12:36 -316.680314 0.1281 BFGS: 8905 20:12:37 -316.686563 0.1417 BFGS: 8906 20:12:38 -316.680887 0.1238 BFGS: 8907 20:12:39 -316.686938 0.1370 BFGS: 8908 20:12:40 -316.687103 0.1345 BFGS: 8909 20:12:41 -316.679789 0.1316 BFGS: 8910 20:12:41 -316.680404 0.1274 BFGS: 8911 20:12:42 -316.686467 0.1434 BFGS: 8912 20:12:43 -316.687160 0.1340 BFGS: 8913 20:12:44 -316.679728 0.1315 BFGS: 8914 20:12:44 -316.680350 0.1278 BFGS: 8915 20:12:46 -316.686525 0.1423 BFGS: 8916 20:12:47 -316.687212 0.1331 BFGS: 8917 20:12:47 -316.679674 0.1318 BFGS: 8918 20:12:48 -316.680301 0.1280 BFGS: 8919 20:12:49 -316.686578 0.1416 BFGS: 8920 20:12:50 -316.680875 0.1240 BFGS: 8921 20:12:51 -316.686952 0.1367 BFGS: 8922 20:12:52 -316.687116 0.1342 BFGS: 8923 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0.1351 BFGS: 9663 20:20:45 -316.679813 0.1313 BFGS: 9664 20:20:46 -316.680429 0.1271 BFGS: 9665 20:20:47 -316.686475 0.1439 BFGS: 9666 20:20:48 -316.687176 0.1339 BFGS: 9667 20:20:48 -316.679755 0.1317 BFGS: 9668 20:20:49 -316.680374 0.1275 BFGS: 9669 20:20:49 -316.686540 0.1426 BFGS: 9670 20:20:50 -316.687230 0.1335 BFGS: 9671 20:20:51 -316.679699 0.1313 BFGS: 9672 20:20:52 -316.680323 0.1280 BFGS: 9673 20:20:53 -316.686595 0.1415 BFGS: 9674 20:20:53 -316.680895 0.1237 BFGS: 9675 20:20:54 -316.686971 0.1372 BFGS: 9676 20:20:54 -316.687136 0.1346 BFGS: 9677 20:20:55 -316.679795 0.1314 BFGS: 9678 20:20:55 -316.680410 0.1273 BFGS: 9679 20:20:55 -316.686500 0.1434 BFGS: 9680 20:20:56 -316.687196 0.1338 BFGS: 9681 20:20:58 -316.679736 0.1316 BFGS: 9682 20:20:58 -316.680356 0.1276 BFGS: 9683 20:20:59 -316.686561 0.1423 BFGS: 9684 20:20:59 -316.680924 0.1234 BFGS: 9685 20:21:00 -316.686940 0.1374 BFGS: 9686 20:21:01 -316.687106 0.1349 BFGS: 9687 20:21:02 -316.679836 0.1311 BFGS: 9688 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0.1368 BFGS: 9714 20:21:20 -316.687145 0.1343 BFGS: 9715 20:21:20 -316.679800 0.1313 BFGS: 9716 20:21:21 -316.680409 0.1274 BFGS: 9717 20:21:22 -316.686507 0.1431 BFGS: 9718 20:21:22 -316.687198 0.1342 BFGS: 9719 20:21:23 -316.679731 0.1310 BFGS: 9720 20:21:23 -316.680353 0.1277 BFGS: 9721 20:21:24 -316.686564 0.1421 BFGS: 9722 20:21:24 -316.680923 0.1237 BFGS: 9723 20:21:25 -316.686942 0.1378 BFGS: 9724 20:21:25 -316.687108 0.1352 BFGS: 9725 20:21:25 -316.679815 0.1313 BFGS: 9726 20:21:26 -316.680433 0.1271 BFGS: 9727 20:21:26 -316.686473 0.1440 BFGS: 9728 20:21:27 -316.687175 0.1339 BFGS: 9729 20:21:27 -316.679760 0.1318 BFGS: 9730 20:21:28 -316.680378 0.1275 BFGS: 9731 20:21:28 -316.686539 0.1426 BFGS: 9732 20:21:29 -316.687230 0.1336 BFGS: 9733 20:21:29 -316.679703 0.1312 BFGS: 9734 20:21:30 -316.680326 0.1280 BFGS: 9735 20:21:30 -316.686594 0.1415 BFGS: 9736 20:21:31 -316.680898 0.1237 BFGS: 9737 20:21:31 -316.686970 0.1373 BFGS: 9738 20:21:32 -316.687135 0.1347 BFGS: 9739 20:21:33 -316.679796 0.1314 BFGS: 9740 20:21:33 -316.680412 0.1273 BFGS: 9741 20:21:34 -316.686500 0.1435 BFGS: 9742 20:21:34 -316.687197 0.1337 BFGS: 9743 20:21:35 -316.679738 0.1317 BFGS: 9744 20:21:35 -316.680358 0.1276 BFGS: 9745 20:21:36 -316.686562 0.1423 BFGS: 9746 20:21:36 -316.680926 0.1233 BFGS: 9747 20:21:36 -316.686941 0.1374 BFGS: 9748 20:21:37 -316.687107 0.1349 BFGS: 9749 20:21:38 -316.679840 0.1311 BFGS: 9750 20:21:38 -316.680446 0.1271 BFGS: 9751 20:21:39 -316.686468 0.1436 BFGS: 9752 20:21:39 -316.687164 0.1348 BFGS: 9753 20:21:40 -316.679768 0.1307 BFGS: 9754 20:21:40 -316.680387 0.1274 BFGS: 9755 20:21:41 -316.686529 0.1426 BFGS: 9756 20:21:41 -316.687221 0.1333 BFGS: 9757 20:21:42 -316.679711 0.1317 BFGS: 9758 20:21:42 -316.680334 0.1274 BFGS: 9759 20:21:43 -316.686587 0.1423 BFGS: 9760 20:21:44 -316.680904 0.1236 BFGS: 9761 20:21:44 -316.686965 0.1370 BFGS: 9762 20:21:45 -316.687130 0.1345 BFGS: 9763 20:21:46 -316.679818 0.1312 BFGS: 9764 20:21:46 -316.680426 0.1272 BFGS: 9765 20:21:47 -316.686491 0.1434 BFGS: 9766 20:21:47 -316.687184 0.1345 BFGS: 9767 20:21:48 -316.679748 0.1308 BFGS: 9768 20:21:49 -316.680368 0.1276 BFGS: 9769 20:21:49 -316.686549 0.1424 BFGS: 9770 20:21:50 -316.687240 0.1329 BFGS: 9771 20:21:50 -316.679693 0.1319 BFGS: 9772 20:21:51 -316.680317 0.1275 BFGS: 9773 20:21:51 -316.686605 0.1421 BFGS: 9774 20:21:52 -316.680889 0.1238 BFGS: 9775 20:21:52 -316.686982 0.1368 BFGS: 9776 20:21:53 -316.687146 0.1343 BFGS: 9777 20:21:53 -316.679802 0.1313 BFGS: 9778 20:21:54 -316.680411 0.1274 BFGS: 9779 20:21:54 -316.686508 0.1431 BFGS: 9780 20:21:54 -316.687199 0.1343 BFGS: 9781 20:21:55 -316.679733 0.1309 BFGS: 9782 20:21:55 -316.680354 0.1277 BFGS: 9783 20:21:56 -316.686565 0.1422 BFGS: 9784 20:21:56 -316.680924 0.1237 BFGS: 9785 20:21:57 -316.686943 0.1378 BFGS: 9786 20:21:57 -316.687109 0.1352 BFGS: 9787 20:21:57 -316.679816 0.1313 BFGS: 9788 20:21:58 -316.680434 0.1271 BFGS: 9789 20:21:58 -316.686474 0.1440 BFGS: 9790 20:21:59 -316.687177 0.1338 BFGS: 9791 20:21:59 -316.679760 0.1319 BFGS: 9792 20:22:00 -316.680379 0.1275 BFGS: 9793 20:22:01 -316.686540 0.1426 BFGS: 9794 20:22:01 -316.687232 0.1336 BFGS: 9795 20:22:01 -316.679703 0.1312 BFGS: 9796 20:22:02 -316.680327 0.1280 BFGS: 9797 20:22:03 -316.686596 0.1415 BFGS: 9798 20:22:03 -316.680899 0.1237 BFGS: 9799 20:22:04 -316.686972 0.1373 BFGS: 9800 20:22:04 -316.687137 0.1347 BFGS: 9801 20:22:05 -316.679796 0.1314 BFGS: 9802 20:22:05 -316.680413 0.1273 BFGS: 9803 20:22:06 -316.686502 0.1435 BFGS: 9804 20:22:06 -316.687199 0.1337 BFGS: 9805 20:22:07 -316.679739 0.1317 BFGS: 9806 20:22:07 -316.680359 0.1276 BFGS: 9807 20:22:08 -316.686564 0.1423 BFGS: 9808 20:22:08 -316.680927 0.1233 BFGS: 9809 20:22:09 -316.686944 0.1374 BFGS: 9810 20:22:09 -316.687110 0.1349 BFGS: 9811 20:22:09 -316.679840 0.1311 BFGS: 9812 20:22:09 -316.680447 0.1271 BFGS: 9813 20:22:09 -316.686470 0.1436 BFGS: 9814 20:22:09 -316.687167 0.1348 BFGS: 9815 20:22:10 -316.679769 0.1307 BFGS: 9816 20:22:10 -316.680387 0.1274 BFGS: 9817 20:22:11 -316.686531 0.1427 BFGS: 9818 20:22:11 -316.687224 0.1333 BFGS: 9819 20:22:12 -316.679712 0.1317 BFGS: 9820 20:22:13 -316.680334 0.1274 BFGS: 9821 20:22:13 -316.686589 0.1423 BFGS: 9822 20:22:13 -316.680905 0.1236 BFGS: 9823 20:22:14 -316.686967 0.1371 BFGS: 9824 20:22:14 -316.687132 0.1346 BFGS: 9825 20:22:15 -316.679818 0.1311 BFGS: 9826 20:22:16 -316.680426 0.1272 BFGS: 9827 20:22:16 -316.686493 0.1434 BFGS: 9828 20:22:17 -316.687187 0.1345 BFGS: 9829 20:22:17 -316.679748 0.1308 BFGS: 9830 20:22:18 -316.680368 0.1275 BFGS: 9831 20:22:19 -316.686552 0.1424 BFGS: 9832 20:22:19 -316.687242 0.1329 BFGS: 9833 20:22:20 -316.679693 0.1319 BFGS: 9834 20:22:20 -316.680317 0.1276 BFGS: 9835 20:22:21 -316.686608 0.1421 BFGS: 9836 20:22:21 -316.680890 0.1237 BFGS: 9837 20:22:22 -316.686984 0.1368 BFGS: 9838 20:22:22 -316.687149 0.1343 BFGS: 9839 20:22:23 -316.679801 0.1313 BFGS: 9840 20:22:24 -316.680411 0.1273 BFGS: 9841 20:22:24 -316.686510 0.1431 BFGS: 9842 20:22:25 -316.687202 0.1342 BFGS: 9843 20:22:26 -316.679733 0.1309 BFGS: 9844 20:22:26 -316.680355 0.1277 BFGS: 9845 20:22:26 -316.686568 0.1422 BFGS: 9846 20:22:27 -316.680925 0.1237 BFGS: 9847 20:22:27 -316.686946 0.1378 BFGS: 9848 20:22:28 -316.687112 0.1352 BFGS: 9849 20:22:28 -316.679817 0.1313 BFGS: 9850 20:22:29 -316.680435 0.1271 BFGS: 9851 20:22:29 -316.686477 0.1440 BFGS: 9852 20:22:30 -316.687179 0.1339 BFGS: 9853 20:22:30 -316.679760 0.1318 BFGS: 9854 20:22:31 -316.680379 0.1275 BFGS: 9855 20:22:31 -316.686543 0.1426 BFGS: 9856 20:22:32 -316.687234 0.1335 BFGS: 9857 20:22:33 -316.679704 0.1313 BFGS: 9858 20:22:34 -316.680328 0.1279 BFGS: 9859 20:22:34 -316.686598 0.1415 BFGS: 9860 20:22:34 -316.680899 0.1237 BFGS: 9861 20:22:35 -316.686975 0.1373 BFGS: 9862 20:22:35 -316.687140 0.1347 BFGS: 9863 20:22:36 -316.679798 0.1314 BFGS: 9864 20:22:37 -316.680414 0.1273 BFGS: 9865 20:22:37 -316.686504 0.1435 BFGS: 9866 20:22:38 -316.687201 0.1337 BFGS: 9867 20:22:38 -316.679739 0.1316 BFGS: 9868 20:22:38 -316.680359 0.1276 BFGS: 9869 20:22:38 -316.686566 0.1423 BFGS: 9870 20:22:39 -316.680928 0.1233 BFGS: 9871 20:22:39 -316.686946 0.1375 BFGS: 9872 20:22:39 -316.687112 0.1350 BFGS: 9873 20:22:40 -316.679839 0.1310 BFGS: 9874 20:22:40 -316.680447 0.1271 BFGS: 9875 20:22:41 -316.686473 0.1436 BFGS: 9876 20:22:41 -316.687170 0.1347 BFGS: 9877 20:22:42 -316.679770 0.1308 BFGS: 9878 20:22:42 -316.680388 0.1274 BFGS: 9879 20:22:43 -316.686534 0.1427 BFGS: 9880 20:22:44 -316.687227 0.1333 BFGS: 9881 20:22:44 -316.679713 0.1316 BFGS: 9882 20:22:45 -316.680335 0.1275 BFGS: 9883 20:22:45 -316.686592 0.1422 BFGS: 9884 20:22:46 -316.680906 0.1236 BFGS: 9885 20:22:46 -316.686970 0.1371 BFGS: 9886 20:22:47 -316.687135 0.1346 BFGS: 9887 20:22:48 -316.679817 0.1311 BFGS: 9888 20:22:48 -316.680426 0.1272 BFGS: 9889 20:22:49 -316.686496 0.1434 BFGS: 9890 20:22:49 -316.687191 0.1344 BFGS: 9891 20:22:50 -316.679749 0.1309 BFGS: 9892 20:22:50 -316.680368 0.1275 BFGS: 9893 20:22:51 -316.686555 0.1424 BFGS: 9894 20:22:51 -316.687246 0.1329 BFGS: 9895 20:22:52 -316.679694 0.1318 BFGS: 9896 20:22:52 -316.680318 0.1276 BFGS: 9897 20:22:53 -316.686611 0.1420 BFGS: 9898 20:22:53 -316.680890 0.1237 BFGS: 9899 20:22:54 -316.686987 0.1369 BFGS: 9900 20:22:54 -316.687152 0.1343 BFGS: 9901 20:22:55 -316.679801 0.1313 BFGS: 9902 20:22:55 -316.680411 0.1273 BFGS: 9903 20:22:56 -316.686514 0.1431 BFGS: 9904 20:22:56 -316.687206 0.1342 BFGS: 9905 20:22:57 -316.679734 0.1310 BFGS: 9906 20:22:57 -316.680355 0.1276 BFGS: 9907 20:22:58 -316.686571 0.1422 BFGS: 9908 20:22:58 -316.680924 0.1236 BFGS: 9909 20:22:58 -316.686950 0.1377 BFGS: 9910 20:22:59 -316.687116 0.1352 BFGS: 9911 20:23:00 -316.679819 0.1313 BFGS: 9912 20:23:01 -316.680436 0.1271 BFGS: 9913 20:23:01 -316.686480 0.1439 BFGS: 9914 20:23:02 -316.687182 0.1340 BFGS: 9915 20:23:02 -316.679761 0.1317 BFGS: 9916 20:23:03 -316.680380 0.1275 BFGS: 9917 20:23:03 -316.686545 0.1426 BFGS: 9918 20:23:04 -316.687237 0.1335 BFGS: 9919 20:23:04 -316.679705 0.1313 BFGS: 9920 20:23:05 -316.680328 0.1279 BFGS: 9921 20:23:05 -316.686601 0.1416 BFGS: 9922 20:23:06 -316.680900 0.1237 BFGS: 9923 20:23:06 -316.686978 0.1373 BFGS: 9924 20:23:07 -316.687143 0.1347 BFGS: 9925 20:23:07 -316.679800 0.1313 BFGS: 9926 20:23:08 -316.680415 0.1273 BFGS: 9927 20:23:08 -316.686507 0.1434 BFGS: 9928 20:23:09 -316.687204 0.1338 BFGS: 9929 20:23:09 -316.679740 0.1315 BFGS: 9930 20:23:10 -316.680360 0.1276 BFGS: 9931 20:23:10 -316.686568 0.1423 BFGS: 9932 20:23:11 -316.680929 0.1234 BFGS: 9933 20:23:11 -316.686948 0.1375 BFGS: 9934 20:23:12 -316.687114 0.1350 BFGS: 9935 20:23:12 -316.679839 0.1310 BFGS: 9936 20:23:13 -316.680447 0.1271 BFGS: 9937 20:23:13 -316.686475 0.1437 BFGS: 9938 20:23:14 -316.687173 0.1346 BFGS: 9939 20:23:14 -316.679770 0.1308 BFGS: 9940 20:23:16 -316.680388 0.1274 BFGS: 9941 20:23:17 -316.686537 0.1427 BFGS: 9942 20:23:17 -316.687230 0.1334 BFGS: 9943 20:23:18 -316.679713 0.1316 BFGS: 9944 20:23:19 -316.680335 0.1275 BFGS: 9945 20:23:20 -316.686595 0.1421 BFGS: 9946 20:23:20 -316.680906 0.1236 BFGS: 9947 20:23:21 -316.686973 0.1371 BFGS: 9948 20:23:22 -316.687138 0.1346 BFGS: 9949 20:23:22 -316.679817 0.1311 BFGS: 9950 20:23:23 -316.680426 0.1272 BFGS: 9951 20:23:23 -316.686500 0.1434 BFGS: 9952 20:23:24 -316.687194 0.1343 BFGS: 9953 20:23:24 -316.679749 0.1309 BFGS: 9954 20:23:25 -316.680369 0.1275 BFGS: 9955 20:23:25 -316.686559 0.1424 BFGS: 9956 20:23:26 -316.687249 0.1329 BFGS: 9957 20:23:26 -316.679694 0.1317 BFGS: 9958 20:23:27 -316.680318 0.1276 BFGS: 9959 20:23:27 -316.686614 0.1419 BFGS: 9960 20:23:28 -316.680890 0.1237 BFGS: 9961 20:23:28 -316.686990 0.1369 BFGS: 9962 20:23:29 -316.687155 0.1343 BFGS: 9963 20:23:29 -316.679800 0.1313 BFGS: 9964 20:23:30 -316.680411 0.1273 BFGS: 9965 20:23:31 -316.686518 0.1431 BFGS: 9966 20:23:32 -316.687210 0.1341 BFGS: 9967 20:23:32 -316.679734 0.1310 BFGS: 9968 20:23:33 -316.680355 0.1276 BFGS: 9969 20:23:33 -316.686575 0.1422 BFGS: 9970 20:23:34 -316.680924 0.1236 BFGS: 9971 20:23:34 -316.686954 0.1377 BFGS: 9972 20:23:34 -316.687120 0.1351 BFGS: 9973 20:23:35 -316.679821 0.1312 BFGS: 9974 20:23:35 -316.680436 0.1271 BFGS: 9975 20:23:36 -316.686484 0.1439 BFGS: 9976 20:23:37 -316.687185 0.1340 BFGS: 9977 20:23:37 -316.679762 0.1316 BFGS: 9978 20:23:37 -316.680380 0.1275 BFGS: 9979 20:23:38 -316.686549 0.1426 BFGS: 9980 20:23:39 -316.687240 0.1335 BFGS: 9981 20:23:39 -316.679706 0.1313 BFGS: 9982 20:23:40 -316.680329 0.1278 BFGS: 9983 20:23:41 -316.686605 0.1416 BFGS: 9984 20:23:41 -316.680900 0.1237 BFGS: 9985 20:23:41 -316.686981 0.1372 BFGS: 9986 20:23:42 -316.687146 0.1346 BFGS: 9987 20:23:42 -316.679802 0.1313 BFGS: 9988 20:23:43 -316.680416 0.1273 BFGS: 9989 20:23:44 -316.686510 0.1434 BFGS: 9990 20:23:44 -316.687206 0.1338 BFGS: 9991 20:23:45 -316.679742 0.1314 BFGS: 9992 20:23:45 -316.680361 0.1276 BFGS: 9993 20:23:46 -316.686571 0.1423 BFGS: 9994 20:23:46 -316.680929 0.1234 BFGS: 9995 20:23:47 -316.686951 0.1375 BFGS: 9996 20:23:48 -316.687117 0.1350 BFGS: 9997 20:23:49 -316.679839 0.1310 BFGS: 9998 20:23:49 -316.680447 0.1271 BFGS: 9999 20:23:50 -316.686479 0.1437 BFGS: 10000 20:23:50 -316.687176 0.1346 Minimization converged after hitting the maximum of 10000 steps. Maximum force component: 0.10748257269248195 eV/Angstrom Maximum stress component: 0.0021843046302272504 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'C', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'N', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O', 'O'] basis = [[0.80189684 0.49607856 0.91745745] [0.19810316 0.99607856 0.58254255] [0.19810316 0.50392144 0.08254255] [0.80189684 0.00392144 0.41745745] [0.25775726 0.67818872 0.52976088] [0.74224274 0.17818872 0.97023912] [0.74224274 0.32181128 0.47023912] [0.25775726 0.82181128 0.02976088] [0.97528832 0.5584317 0.94390596] [0.02471168 0.0584317 0.55609404] [0.02471168 0.4415683 0.05609404] [0.97528832 0.9415683 0.44390596] [0.67606457 0.65178482 0.78995796] [0.32393543 0.15178482 0.71004204] [0.32393543 0.34821518 0.21004204] [0.67606457 0.84821518 0.28995796] [0.11226695 0.78955132 0.3975584 ] [0.88773305 0.28955132 0.1024416 ] [0.88773305 0.21044868 0.6024416 ] [0.11226695 0.71044868 0.8975584 ] [0.87252739 0.70701682 0.27911452] [0.12747261 0.20701682 0.22088548] [0.12747261 0.29298318 0.72088548] [0.87252739 0.79298318 0.77911452] [0.51460762 0.75945497 0.60714426] [0.48539238 0.25945497 0.89285574] [0.48539238 0.24054503 0.39285574] [0.51460762 0.74054503 0.10714426] [0.01394713 0.5934513 0.46002959] [0.98605287 0.0934513 0.03997041] [0.98605287 0.4065487 0.53997041] [0.01394713 0.9065487 0.96002959] [0.40839503 0.56451045 0.68927903] [0.59160497 0.06451045 0.81072097] [0.59160497 0.43548955 0.31072097] [0.40839503 0.93548955 0.18927903] [0.3467624 0.34845451 0.59107743] [0.6532376 0.84845451 0.90892257] [0.6532376 0.65154549 0.40892257] [0.3467624 0.15154549 0.09107743] [0.50645266 0.40074275 0.8893471 ] [0.49354734 0.90074275 0.6106529 ] [0.49354734 0.59925725 0.1106529 ] [0.50645266 0.09925725 0.3893471 ] [0.20713405 0.60568862 0.55461835] [0.79286595 0.10568862 0.94538165] [0.79286595 0.39431138 0.44538165] [0.20713405 0.89431138 0.05461835] [0.4992164 0.70153655 0.64809203] [0.5007836 0.20153655 0.85190797] [0.5007836 0.29846345 0.35190797] [0.4992164 0.79846345 0.14809203] [0.05821239 0.73026634 0.38110417] [0.94178761 0.23026634 0.11889583] [0.94178761 0.26973366 0.61889583] [0.05821239 0.76973366 0.88110417] [0.94786321 0.63257421 0.88168719] [0.05213679 0.13257421 0.61831281] [0.05213679 0.36742579 0.11831281] [0.94786321 0.86742579 0.38168719] [0.55185119 0.48864416 0.80593772] [0.44814881 0.98864416 0.69406228] [0.44814881 0.51135584 0.19406228] [0.55185119 0.01135584 0.30593772] [0.38182809 0.35150514 0.79515375] [0.61817191 0.85150514 0.70484625] [0.61817191 0.64849486 0.20484625] [0.38182809 0.14849486 0.29515375]] cellpar = Cell([[6.176604720233455, -5.455668248536053e-19, 1.4268102397532438], [6.43273856618931e-18, 17.659324686456088, -2.6143895977169346e-17], [-4.059574131508422, -2.3705830613201932e-18, 3.618584783375333]]) forces = [[ 0.01835616 0.0016966 -0.00679976] [-0.01835616 0.0016966 0.00679976] [-0.01835616 -0.0016966 0.00679976] [ 0.01835616 -0.0016966 -0.00679976] [-0.02383841 0.02533793 0.05688657] [ 0.02383841 0.02533793 -0.05688657] [ 0.02383841 -0.02533793 -0.05688657] [-0.02383841 -0.02533793 0.05688657] [-0.00527751 0.01930179 0.00420152] [ 0.00527751 0.01930179 -0.00420152] [ 0.00527751 -0.01930179 -0.00420152] [-0.00527751 -0.01930179 0.00420152] [-0.00068875 0.00128719 -0.00047785] [ 0.00068875 0.00128719 0.00047785] [ 0.00068875 -0.00128719 0.00047785] [-0.00068875 -0.00128719 -0.00047785] [ 0.00115424 -0.00233496 0.00041946] [-0.00115424 -0.00233496 -0.00041946] [-0.00115424 0.00233496 -0.00041946] [ 0.00115424 0.00233496 0.00041946] [ 0.00447676 -0.00132681 0.00527369] [-0.00447676 -0.00132681 -0.00527369] [-0.00447676 0.00132681 -0.00527369] [ 0.00447676 0.00132681 0.00527369] [-0.00751419 -0.00928587 -0.00507944] [ 0.00751419 -0.00928587 0.00507944] [ 0.00751419 0.00928587 0.00507944] [-0.00751419 0.00928587 -0.00507944] [ 0.00964008 0.00992959 0.0036736 ] [-0.00964008 0.00992959 -0.0036736 ] [-0.00964008 -0.00992959 -0.0036736 ] [ 0.00964008 -0.00992959 0.0036736 ] [-0.00012462 0.00254648 -0.00016124] [ 0.00012462 0.00254648 0.00016124] [ 0.00012462 -0.00254648 0.00016124] [-0.00012462 -0.00254648 -0.00016124] [ 0.00024987 -0.00450943 0.0051329 ] [-0.00024987 -0.00450943 -0.0051329 ] [-0.00024987 0.00450943 -0.0051329 ] [ 0.00024987 0.00450943 0.0051329 ] [ 0.00130401 -0.00145421 -0.00078612] [-0.00130401 -0.00145421 0.00078612] [-0.00130401 0.00145421 0.00078612] [ 0.00130401 0.00145421 -0.00078612] [ 0.02854293 0.10748257 0.00192228] [-0.02854293 0.10748257 -0.00192228] [-0.02854293 -0.10748257 -0.00192228] [ 0.02854293 -0.10748257 0.00192228] [-0.08326915 -0.03607486 -0.06394033] [ 0.08326915 -0.03607486 0.06394033] [ 0.08326915 0.03607486 0.06394033] [-0.08326915 0.03607486 -0.06394033] [ 0.0526207 -0.0746826 0.0676878 ] [-0.0526207 -0.0746826 -0.0676878 ] [-0.0526207 0.0746826 -0.0676878 ] [ 0.0526207 0.0746826 0.0676878 ] [ 0.02542736 -0.0364579 -0.07020549] [-0.02542736 -0.0364579 0.07020549] [-0.02542736 0.0364579 0.07020549] [ 0.02542736 0.0364579 -0.07020549] [-0.00886432 -0.0031683 -0.00077158] [ 0.00886432 -0.0031683 0.00077158] [ 0.00886432 0.0031683 0.00077158] [-0.00886432 0.0031683 -0.00077158] [-0.00151964 0.00349374 -0.00161477] [ 0.00151964 0.00349374 0.00161477] [ 0.00151964 -0.00349374 0.00161477] [-0.00151964 -0.00349374 -0.00161477]] stress = [ 1.18447605e-03 2.18430463e-03 -7.10936127e-04 2.15766839e-21 1.35188817e-03 4.37140623e-21] energy per atom = -4.6051765944897065 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0