element(s): ['B', 'H', 'N'] AFLOW prototype label: A3B12C_oC64_63_cf_2f2gh_c Parameter names: ['a', 'b/a', 'c/a', 'y1', 'y2', 'y3', 'z3', 'y4', 'z4', 'y5', 'z5', 'x6', 'y6', 'x7', 'y7', 'x8', 'y8', 'z8'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['7.294', '1.1413628', '1.171785', '0.89843611', '0.3198217', '0.28561857', '0.64491064', '0.14691893', '0.58406442', '0.60907057', '0.65118382', '0.86040837', '0.97671376', '0.61535453', '0.74803599', '0.64049161', '0.844744', '0.59480754'] model name: LJ_ElliottAkerson_2015_Universal__MO_959249795837_003 ==== Building ASE atoms object with: ==== representative atom symbols = ['B', 'B', 'H', 'H', 'H', 'H', 'H', 'N'] representative atom coordinates = [[0. 0.89843611 0.25 ] [0. 0.28561857 0.64491064] [0. 0.14691893 0.58406442] [0. 0.60907057 0.65118382] [0.86040837 0.97671376 0.25 ] [0.61535453 0.74803599 0.25 ] [0.64049161 0.844744 0.59480754] [0. 0.3198217 0.25 ]] spacegroup = 63 cell = [[7.294, 0, 0], [0, 8.3251, 0], [0, 0, 8.547]] ========================================= Step Time Energy fmax BFGS: 0 16:09:51 -268.169553 10.8595 BFGS: 1 16:09:51 -277.644114 8.7500 BFGS: 2 16:09:51 -282.986560 8.1173 BFGS: 3 16:09:51 -287.561928 8.4299 BFGS: 4 16:09:52 -291.307222 8.6116 BFGS: 5 16:09:52 -294.130878 7.4559 BFGS: 6 16:09:52 -296.005149 6.0559 BFGS: 7 16:09:52 -295.361722 19.8657 BFGS: 8 16:09:52 -297.752896 6.7323 BFGS: 9 16:09:52 -298.455913 2.0542 BFGS: 10 16:09:52 -298.617759 0.6676 BFGS: 11 16:09:52 -298.649461 0.5036 BFGS: 12 16:09:52 -298.679411 0.3912 BFGS: 13 16:09:52 -298.845105 0.9714 BFGS: 14 16:09:52 -299.007240 1.5809 BFGS: 15 16:09:52 -299.172353 2.0450 BFGS: 16 16:09:52 -299.334526 2.4096 BFGS: 17 16:09:52 -299.485419 2.7108 BFGS: 18 16:09:52 -299.618241 2.9708 BFGS: 19 16:09:52 -299.730853 3.1993 BFGS: 20 16:09:52 -299.827695 3.4166 BFGS: 21 16:09:53 -299.915966 3.5922 BFGS: 22 16:09:53 -300.010423 3.7372 BFGS: 23 16:09:53 -300.113277 3.8713 BFGS: 24 16:09:53 -300.230824 4.1058 BFGS: 25 16:09:53 -300.362932 4.3095 BFGS: 26 16:09:53 -300.505059 4.4955 BFGS: 27 16:09:53 -300.657310 4.6641 BFGS: 28 16:09:53 -300.818784 4.8220 BFGS: 29 16:09:53 -300.989195 4.9690 BFGS: 30 16:09:54 -301.167015 5.1093 BFGS: 31 16:09:54 -301.353221 5.2407 BFGS: 32 16:09:54 -301.545351 5.3734 BFGS: 33 16:09:54 -301.746817 5.4976 BFGS: 34 16:09:54 -301.950379 5.6261 BFGS: 35 16:09:55 -302.158809 5.7465 BFGS: 36 16:09:55 -302.372275 5.8673 BFGS: 37 16:09:55 -302.591277 5.9838 BFGS: 38 16:09:55 -302.816306 6.0983 BFGS: 39 16:09:55 -303.047782 6.2384 BFGS: 40 16:09:56 -303.286013 6.3860 BFGS: 41 16:09:56 -303.531184 6.5275 BFGS: 42 16:09:56 -303.783349 6.6635 BFGS: 43 16:09:56 -304.042442 6.7945 BFGS: 44 16:09:56 -304.308278 6.9210 BFGS: 45 16:09:56 -304.580563 7.0438 BFGS: 46 16:09:56 -304.858993 7.1634 BFGS: 47 16:09:57 -305.142809 7.2806 BFGS: 48 16:09:57 -305.431466 7.3990 BFGS: 49 16:09:57 -305.724218 7.5130 BFGS: 50 16:09:57 -306.020392 7.6259 BFGS: 51 16:09:57 -306.318952 7.7380 BFGS: 52 16:09:58 -306.618096 7.8491 BFGS: 53 16:09:58 -306.919702 7.9570 BFGS: 54 16:09:58 -307.226280 8.0668 BFGS: 55 16:09:58 -307.538617 8.1749 BFGS: 56 16:09:58 -307.857384 8.2808 BFGS: 57 16:09:59 -308.185696 8.3841 BFGS: 58 16:09:59 -308.528846 8.4841 BFGS: 59 16:09:59 -308.888589 8.5809 BFGS: 60 16:09:59 -309.270438 8.6794 BFGS: 61 16:09:59 -309.683613 8.7686 BFGS: 62 16:10:00 -310.132493 8.8547 BFGS: 63 16:10:00 -310.628185 8.9377 BFGS: 64 16:10:00 -311.186324 9.0177 BFGS: 65 16:10:00 -311.831791 9.0951 BFGS: 66 16:10:01 -312.597592 9.2159 BFGS: 67 16:10:01 -313.540224 9.3749 BFGS: 68 16:10:01 -314.764255 9.5448 BFGS: 69 16:10:02 -316.484891 9.7415 BFGS: 70 16:10:02 -319.237613 9.9741 BFGS: 71 16:10:02 -324.741671 11.0781 BFGS: 72 16:10:03 -333.580382 15.2455 BFGS: 73 16:10:03 -347.927057 19.9638 BFGS: 74 16:10:04 -347.850910 59.8652 BFGS: 75 16:10:04 -357.882798 11.1903 BFGS: 76 16:10:04 -360.991758 11.8861 BFGS: 77 16:10:05 -366.518408 12.7883 BFGS: 78 16:10:05 -374.116071 13.5348 BFGS: 79 16:10:05 -383.258009 12.8354 BFGS: 80 16:10:05 -392.148245 12.1972 BFGS: 81 16:10:05 -399.007799 16.0749 BFGS: 82 16:10:05 -412.819604 22.9073 BFGS: 83 16:10:06 -427.634545 30.4277 BFGS: 84 16:10:06 -442.359101 26.8161 BFGS: 85 16:10:06 -442.737267 42.0850 BFGS: 86 16:10:06 -448.164506 17.6510 BFGS: 87 16:10:06 -452.018435 18.4405 BFGS: 88 16:10:06 -455.908106 19.9539 BFGS: 89 16:10:07 -459.687377 21.3381 BFGS: 90 16:10:07 -463.350919 22.6137 BFGS: 91 16:10:07 -466.713551 22.9936 BFGS: 92 16:10:08 -469.929906 22.0109 BFGS: 93 16:10:08 -474.117515 20.0519 BFGS: 94 16:10:08 -478.654385 20.2842 BFGS: 95 16:10:09 -486.508926 29.4689 BFGS: 96 16:10:09 -484.399423 72.9479 BFGS: 97 16:10:10 -491.556997 16.3159 BFGS: 98 16:10:10 -493.246680 14.0774 BFGS: 99 16:10:10 -494.907200 10.4134 BFGS: 100 16:10:10 -495.755016 9.6049 BFGS: 101 16:10:11 -496.420192 8.8655 BFGS: 102 16:10:11 -497.055177 9.4329 BFGS: 103 16:10:11 -497.654949 9.6259 BFGS: 104 16:10:12 -498.214263 10.0341 BFGS: 105 16:10:12 -498.747022 10.5578 BFGS: 106 16:10:12 -499.264480 11.2504 BFGS: 107 16:10:13 -499.775573 11.9075 BFGS: 108 16:10:13 -500.284731 12.5241 BFGS: 109 16:10:13 -500.796314 13.0954 BFGS: 110 16:10:13 -501.311423 13.6163 BFGS: 111 16:10:13 -501.830939 14.0929 BFGS: 112 16:10:14 -502.355154 14.5289 BFGS: 113 16:10:14 -502.884108 14.9293 BFGS: 114 16:10:14 -503.417656 15.2980 BFGS: 115 16:10:14 -503.955569 15.6388 BFGS: 116 16:10:14 -504.497572 15.9552 BFGS: 117 16:10:14 -505.043374 16.2497 BFGS: 118 16:10:15 -505.592684 16.5251 BFGS: 119 16:10:15 -506.145221 16.7833 BFGS: 120 16:10:15 -506.700716 17.0262 BFGS: 121 16:10:15 -507.258987 17.2554 BFGS: 122 16:10:15 -507.819238 17.4719 BFGS: 123 16:10:15 -508.382138 17.6783 BFGS: 124 16:10:15 -508.947115 17.8742 BFGS: 125 16:10:16 -509.513962 18.0609 BFGS: 126 16:10:16 -510.082470 18.2391 BFGS: 127 16:10:16 -510.652469 18.4094 BFGS: 128 16:10:16 -511.223816 18.5726 BFGS: 129 16:10:16 -511.796283 18.7286 BFGS: 130 16:10:16 -512.369789 18.8788 BFGS: 131 16:10:16 -512.944375 19.0231 BFGS: 132 16:10:16 -513.518669 19.1638 BFGS: 133 16:10:17 -514.094197 19.2977 BFGS: 134 16:10:17 -514.669629 19.4266 BFGS: 135 16:10:17 -515.245881 19.5512 BFGS: 136 16:10:17 -515.821694 19.6709 BFGS: 137 16:10:17 -516.397875 19.7872 BFGS: 138 16:10:17 -516.974365 19.9047 BFGS: 139 16:10:17 -517.551391 20.0102 BFGS: 140 16:10:17 -518.127858 20.1150 BFGS: 141 16:10:17 -518.704433 20.2166 BFGS: 142 16:10:17 -519.280763 20.3151 BFGS: 143 16:10:17 -519.856171 20.4140 BFGS: 144 16:10:17 -520.432574 20.5048 BFGS: 145 16:10:17 -521.009009 20.5922 BFGS: 146 16:10:18 -521.584851 20.6748 BFGS: 147 16:10:18 -522.160067 20.7532 BFGS: 148 16:10:18 -522.734685 20.8276 BFGS: 149 16:10:18 -523.308605 20.8984 BFGS: 150 16:10:18 -523.881803 20.9659 BFGS: 151 16:10:18 -524.454247 21.0304 BFGS: 152 16:10:18 -525.025916 21.0922 BFGS: 153 16:10:18 -525.596794 21.1513 BFGS: 154 16:10:18 -526.167146 21.2082 BFGS: 155 16:10:18 -526.738026 21.2715 BFGS: 156 16:10:18 -527.310339 21.3196 BFGS: 157 16:10:18 -527.881113 21.3681 BFGS: 158 16:10:18 -528.451127 21.4147 BFGS: 159 16:10:18 -529.020451 21.4603 BFGS: 160 16:10:19 -529.589296 21.5055 BFGS: 161 16:10:19 -530.157830 21.5508 BFGS: 162 16:10:19 -530.726214 21.5967 BFGS: 163 16:10:19 -531.294537 21.6436 BFGS: 164 16:10:19 -531.862825 21.6914 BFGS: 165 16:10:19 -532.431087 21.7399 BFGS: 166 16:10:19 -532.999327 21.7893 BFGS: 167 16:10:19 -533.567551 21.8394 BFGS: 168 16:10:19 -534.135823 21.8983 BFGS: 169 16:10:19 -534.705034 21.9459 BFGS: 170 16:10:19 -535.275442 22.0006 BFGS: 171 16:10:19 -535.846294 22.0715 BFGS: 172 16:10:19 -536.420883 22.1236 BFGS: 173 16:10:19 -536.994976 22.1808 BFGS: 174 16:10:19 -537.568421 22.2431 BFGS: 175 16:10:19 -538.143443 22.2981 BFGS: 176 16:10:20 -538.718723 22.3537 BFGS: 177 16:10:20 -539.295201 22.4093 BFGS: 178 16:10:20 -539.871765 22.4658 BFGS: 179 16:10:20 -540.448733 22.5218 BFGS: 180 16:10:20 -541.026300 22.5770 BFGS: 181 16:10:20 -541.604868 22.6307 BFGS: 182 16:10:20 -542.185148 22.6818 BFGS: 183 16:10:20 -542.768590 22.7278 BFGS: 184 16:10:20 -543.358915 22.7618 BFGS: 185 16:10:20 -543.968548 22.7508 BFGS: 186 16:10:20 -544.651763 22.7469 BFGS: 187 16:10:20 -545.325656 22.7509 BFGS: 188 16:10:20 -545.998988 22.7587 BFGS: 189 16:10:20 -546.673859 22.7680 BFGS: 190 16:10:20 -547.352417 22.7772 BFGS: 191 16:10:20 -548.036876 22.7855 BFGS: 192 16:10:21 -548.729633 22.7924 BFGS: 193 16:10:21 -549.433422 22.7973 BFGS: 194 16:10:21 -550.151490 22.7997 BFGS: 195 16:10:21 -550.887814 22.7991 BFGS: 196 16:10:21 -551.647385 22.7949 BFGS: 197 16:10:21 -552.436577 22.7865 BFGS: 198 16:10:21 -553.263677 22.7735 BFGS: 199 16:10:21 -554.140377 22.7553 BFGS: 200 16:10:21 -555.079524 22.7305 BFGS: 201 16:10:22 -556.102287 22.7018 BFGS: 202 16:10:22 -557.235589 22.6681 BFGS: 203 16:10:22 -558.514818 22.6324 BFGS: 204 16:10:22 -559.989495 22.5989 BFGS: 205 16:10:22 -561.725570 22.5766 BFGS: 206 16:10:22 -563.806644 22.5759 BFGS: 207 16:10:22 -566.344956 22.6370 BFGS: 208 16:10:22 -569.466683 22.7495 BFGS: 209 16:10:22 -573.363289 22.9678 BFGS: 210 16:10:22 -578.256282 23.3374 BFGS: 211 16:10:23 -584.442696 23.9202 BFGS: 212 16:10:23 -592.415443 26.0288 BFGS: 213 16:10:23 -602.816479 30.3152 BFGS: 214 16:10:23 -616.406892 34.6873 BFGS: 215 16:10:23 -633.639361 36.5418 BFGS: 216 16:10:23 -652.486419 31.6274 BFGS: 217 16:10:23 -658.064892 32.2524 BFGS: 218 16:10:23 -660.649049 32.4862 BFGS: 219 16:10:23 -662.724373 32.6851 BFGS: 220 16:10:23 -664.576206 32.8675 BFGS: 221 16:10:23 -666.270170 33.0356 BFGS: 222 16:10:23 -667.848496 33.1918 BFGS: 223 16:10:24 -669.335841 33.3372 BFGS: 224 16:10:24 -670.750612 33.4719 BFGS: 225 16:10:24 -672.106037 33.5964 BFGS: 226 16:10:24 -673.412416 33.7113 BFGS: 227 16:10:24 -674.677537 33.8175 BFGS: 228 16:10:24 -675.907469 33.9160 BFGS: 229 16:10:24 -677.107113 34.0076 BFGS: 230 16:10:24 -678.278823 34.0955 BFGS: 231 16:10:24 -679.427620 34.1752 BFGS: 232 16:10:24 -680.552340 34.2501 BFGS: 233 16:10:24 -681.656282 34.3176 BFGS: 234 16:10:24 -682.737145 34.3803 BFGS: 235 16:10:24 -683.798047 34.4340 BFGS: 236 16:10:24 -684.836262 34.4817 BFGS: 237 16:10:25 -685.854045 34.5187 BFGS: 238 16:10:25 -686.848371 34.5483 BFGS: 239 16:10:25 -687.821560 34.5653 BFGS: 240 16:10:25 -688.770429 34.5743 BFGS: 241 16:10:25 -689.697958 34.5690 BFGS: 242 16:10:25 -690.600910 34.5558 BFGS: 243 16:10:25 -691.481380 34.5351 BFGS: 244 16:10:25 -692.340611 34.4991 BFGS: 245 16:10:25 -693.178160 34.4513 BFGS: 246 16:10:25 -693.995211 34.3916 BFGS: 247 16:10:25 -694.792030 34.3222 BFGS: 248 16:10:25 -695.570342 34.2420 BFGS: 249 16:10:25 -696.330286 34.1540 BFGS: 250 16:10:25 -697.074144 34.0558 BFGS: 251 16:10:26 -697.801325 33.9531 BFGS: 252 16:10:26 -698.515335 33.8387 BFGS: 253 16:10:26 -699.213627 33.7241 BFGS: 254 16:10:26 -699.902177 33.5953 BFGS: 255 16:10:26 -700.575316 33.4724 BFGS: 256 16:10:26 -701.242752 33.3297 BFGS: 257 16:10:26 -701.893497 33.2030 BFGS: 258 16:10:26 -702.544096 33.0452 BFGS: 259 16:10:26 -703.174597 32.9204 BFGS: 260 16:10:26 -703.811824 32.7479 BFGS: 261 16:10:26 -704.425748 32.6218 BFGS: 262 16:10:26 -705.049213 32.4433 BFGS: 263 16:10:26 -705.652008 32.3069 BFGS: 264 16:10:26 -706.260915 32.1321 BFGS: 265 16:10:26 -706.855650 31.9827 BFGS: 266 16:10:26 -707.452238 31.8113 BFGS: 267 16:10:27 -708.039753 31.6525 BFGS: 268 16:10:27 -708.626814 31.4818 BFGS: 269 16:10:27 -709.207882 31.3169 BFGS: 270 16:10:27 -709.787952 31.1451 BFGS: 271 16:10:27 -710.364001 30.9757 BFGS: 272 16:10:27 -710.938466 30.8026 BFGS: 273 16:10:27 -711.510212 30.6301 BFGS: 274 16:10:27 -712.080703 30.4552 BFGS: 275 16:10:27 -712.649428 30.2801 BFGS: 276 16:10:27 -713.217377 30.1033 BFGS: 277 16:10:27 -713.784382 29.9263 BFGS: 278 16:10:27 -714.351179 29.7479 BFGS: 279 16:10:27 -714.917797 29.5692 BFGS: 280 16:10:27 -715.484836 29.3896 BFGS: 281 16:10:27 -716.052448 29.2097 BFGS: 282 16:10:28 -716.621158 29.0294 BFGS: 283 16:10:28 -717.191198 28.8489 BFGS: 284 16:10:28 -717.763058 28.6683 BFGS: 285 16:10:28 -718.337327 28.4907 BFGS: 286 16:10:28 -718.912073 28.3137 BFGS: 287 16:10:28 -719.491579 28.1329 BFGS: 288 16:10:28 -720.073163 27.9554 BFGS: 289 16:10:28 -720.660015 27.7765 BFGS: 290 16:10:28 -721.248742 27.6087 BFGS: 291 16:10:28 -721.842839 27.4363 BFGS: 292 16:10:28 -722.442169 27.2628 BFGS: 293 16:10:28 -723.046970 27.0903 BFGS: 294 16:10:28 -723.657268 26.9198 BFGS: 295 16:10:28 -724.274116 26.7509 BFGS: 296 16:10:29 -724.897131 26.5849 BFGS: 297 16:10:29 -725.527661 26.4207 BFGS: 298 16:10:29 -726.164572 26.2603 BFGS: 299 16:10:29 -726.809518 26.1020 BFGS: 300 16:10:29 -727.461449 25.9475 BFGS: 301 16:10:29 -728.121780 25.7956 BFGS: 302 16:10:29 -728.789598 25.6478 BFGS: 303 16:10:29 -729.466350 25.5001 BFGS: 304 16:10:29 -730.149850 25.3594 BFGS: 305 16:10:29 -730.842598 25.2217 BFGS: 306 16:10:29 -731.542235 25.0866 BFGS: 307 16:10:29 -732.251057 24.9565 BFGS: 308 16:10:29 -732.965406 24.8322 BFGS: 309 16:10:29 -733.688541 24.7108 BFGS: 310 16:10:30 -734.415698 24.5949 BFGS: 311 16:10:30 -735.151329 24.4828 BFGS: 312 16:10:30 -735.889899 24.3768 BFGS: 313 16:10:30 -736.635765 24.2744 BFGS: 314 16:10:30 -737.383339 24.1783 BFGS: 315 16:10:30 -738.135840 24.0871 BFGS: 316 16:10:30 -738.889712 24.0027 BFGS: 317 16:10:30 -739.647458 23.9254 BFGS: 318 16:10:30 -740.370731 23.9365 BFGS: 319 16:10:30 -741.148594 23.5159 BFGS: 320 16:10:30 -741.872718 22.9586 BFGS: 321 16:10:30 -742.702629 22.7326 BFGS: 322 16:10:30 -743.560341 22.6246 BFGS: 323 16:10:30 -744.452677 22.5626 BFGS: 324 16:10:31 -745.391699 22.5336 BFGS: 325 16:10:31 -746.382257 22.5333 BFGS: 326 16:10:31 -747.434008 22.5637 BFGS: 327 16:10:31 -748.554198 22.6243 BFGS: 328 16:10:31 -749.753448 22.7173 BFGS: 329 16:10:31 -751.043951 22.8422 BFGS: 330 16:10:31 -752.437077 23.0044 BFGS: 331 16:10:31 -753.950468 23.2056 BFGS: 332 16:10:31 -755.605178 23.4468 BFGS: 333 16:10:31 -757.421850 23.7345 BFGS: 334 16:10:31 -759.429724 24.0715 BFGS: 335 16:10:31 -761.659690 24.4588 BFGS: 336 16:10:32 -764.142776 24.8953 BFGS: 337 16:10:32 -766.903335 25.3718 BFGS: 338 16:10:32 -769.940433 25.8634 BFGS: 339 16:10:32 -773.201031 26.3202 BFGS: 340 16:10:32 -776.533352 26.6452 BFGS: 341 16:10:32 -779.460855 26.4450 BFGS: 342 16:10:32 -782.041075 25.9916 BFGS: 343 16:10:32 -784.244320 25.1634 BFGS: 344 16:10:32 -786.147540 24.0930 BFGS: 345 16:10:32 -787.790281 22.7635 BFGS: 346 16:10:32 -789.225539 21.3501 BFGS: 347 16:10:32 -790.482471 19.7526 BFGS: 348 16:10:32 -791.597431 18.2968 BFGS: 349 16:10:33 -792.581408 16.4942 BFGS: 350 16:10:33 -793.365378 15.5731 BFGS: 351 16:10:33 -794.151940 13.6057 BFGS: 352 16:10:33 -794.720334 12.9197 BFGS: 353 16:10:33 -795.183500 12.0596 BFGS: 354 16:10:33 -795.701916 11.2923 BFGS: 355 16:10:33 -796.045244 10.8261 BFGS: 356 16:10:33 -796.420786 10.3455 BFGS: 357 16:10:33 -796.744911 9.9857 BFGS: 358 16:10:33 -797.065829 9.6576 BFGS: 359 16:10:33 -797.370662 9.3727 BFGS: 360 16:10:33 -797.669591 9.1139 BFGS: 361 16:10:33 -797.960712 8.8765 BFGS: 362 16:10:34 -798.246736 8.6554 BFGS: 363 16:10:34 -798.527695 8.4467 BFGS: 364 16:10:34 -798.804453 8.2485 BFGS: 365 16:10:34 -799.077072 8.0580 BFGS: 366 16:10:34 -799.345899 7.8745 BFGS: 367 16:10:34 -799.610945 7.6962 BFGS: 368 16:10:34 -799.872331 7.5228 BFGS: 369 16:10:34 -800.130028 7.3532 BFGS: 370 16:10:34 -800.384113 7.1872 BFGS: 371 16:10:34 -800.634289 7.0218 BFGS: 372 16:10:34 -800.880781 6.8631 BFGS: 373 16:10:34 -801.123475 6.7054 BFGS: 374 16:10:34 -801.362403 6.6285 BFGS: 375 16:10:35 -801.597432 6.5571 BFGS: 376 16:10:35 -801.828603 6.4823 BFGS: 377 16:10:35 -802.055828 6.4065 BFGS: 378 16:10:35 -802.279129 6.3285 BFGS: 379 16:10:35 -802.498460 6.2498 BFGS: 380 16:10:35 -802.713839 6.1699 BFGS: 381 16:10:35 -802.925266 6.0897 BFGS: 382 16:10:35 -803.133525 6.0136 BFGS: 383 16:10:35 -803.336921 5.9299 BFGS: 384 16:10:35 -803.536719 5.8597 BFGS: 385 16:10:35 -803.732591 5.7755 BFGS: 386 16:10:35 -803.924775 5.7000 BFGS: 387 16:10:35 -804.113235 5.6208 BFGS: 388 16:10:36 -804.297937 5.5451 BFGS: 389 16:10:36 -804.479211 5.4686 BFGS: 390 16:10:36 -804.656755 5.4002 BFGS: 391 16:10:36 -804.830723 5.3243 BFGS: 392 16:10:36 -805.001243 5.2538 BFGS: 393 16:10:36 -805.168371 5.1830 BFGS: 394 16:10:36 -805.332146 5.1147 BFGS: 395 16:10:36 -805.492788 5.0475 BFGS: 396 16:10:36 -805.649868 4.9847 BFGS: 397 16:10:36 -805.804235 4.9191 BFGS: 398 16:10:36 -805.955395 4.8601 BFGS: 399 16:10:37 -806.103750 4.7989 BFGS: 400 16:10:37 -806.249231 4.7428 BFGS: 401 16:10:37 -806.391773 4.6853 BFGS: 402 16:10:37 -806.531986 4.7014 BFGS: 403 16:10:37 -806.669766 4.8644 BFGS: 404 16:10:37 -806.804974 5.0309 BFGS: 405 16:10:37 -806.937820 5.1977 BFGS: 406 16:10:37 -807.068413 5.3664 BFGS: 407 16:10:37 -807.196775 5.5335 BFGS: 408 16:10:37 -807.323032 5.7015 BFGS: 409 16:10:37 -807.447193 5.8690 BFGS: 410 16:10:38 -807.569390 6.0362 BFGS: 411 16:10:38 -807.689681 6.2029 BFGS: 412 16:10:38 -807.808160 6.3689 BFGS: 413 16:10:38 -807.924902 6.5341 BFGS: 414 16:10:38 -808.039989 6.6985 BFGS: 415 16:10:38 -808.153496 6.8619 BFGS: 416 16:10:38 -808.265533 7.0243 BFGS: 417 16:10:38 -808.376050 7.1846 BFGS: 418 16:10:38 -808.485282 7.3445 BFGS: 419 16:10:38 -808.593224 7.5032 BFGS: 420 16:10:38 -808.699952 7.6609 BFGS: 421 16:10:38 -808.805534 7.8172 BFGS: 422 16:10:38 -808.910027 7.9722 BFGS: 423 16:10:38 -809.013499 8.1258 BFGS: 424 16:10:39 -809.116006 8.2780 BFGS: 425 16:10:39 -809.217609 8.4289 BFGS: 426 16:10:39 -809.318363 8.5784 BFGS: 427 16:10:39 -809.418324 8.7264 BFGS: 428 16:10:39 -809.517542 8.8730 BFGS: 429 16:10:39 -809.616070 9.0182 BFGS: 430 16:10:39 -809.713954 9.1620 BFGS: 431 16:10:39 -809.811242 9.3043 BFGS: 432 16:10:39 -809.907977 9.4452 BFGS: 433 16:10:39 -810.004204 9.5847 BFGS: 434 16:10:39 -810.099961 9.7228 BFGS: 435 16:10:39 -810.195289 9.8595 BFGS: 436 16:10:40 -810.290409 9.9872 BFGS: 437 16:10:40 -810.384848 10.1280 BFGS: 438 16:10:40 -810.479191 10.2606 BFGS: 439 16:10:40 -810.573317 10.3919 BFGS: 440 16:10:40 -810.667205 10.5220 BFGS: 441 16:10:40 -810.760855 10.6509 BFGS: 442 16:10:40 -810.854314 10.7784 BFGS: 443 16:10:40 -810.947586 10.9047 BFGS: 444 16:10:40 -811.040710 11.0296 BFGS: 445 16:10:40 -811.133697 11.1534 BFGS: 446 16:10:41 -811.226577 11.2759 BFGS: 447 16:10:41 -811.319364 11.3972 BFGS: 448 16:10:41 -811.412082 11.5174 BFGS: 449 16:10:41 -811.504744 11.6364 BFGS: 450 16:10:41 -811.597468 11.7528 BFGS: 451 16:10:41 -811.689980 11.8705 BFGS: 452 16:10:41 -811.782650 11.9858 BFGS: 453 16:10:41 -811.875245 12.1006 BFGS: 454 16:10:41 -811.967921 12.2141 BFGS: 455 16:10:41 -812.060815 12.3313 BFGS: 456 16:10:41 -812.153491 12.4399 BFGS: 457 16:10:41 -812.246386 12.5500 BFGS: 458 16:10:41 -812.339263 12.6601 BFGS: 459 16:10:42 -812.432280 12.7693 BFGS: 460 16:10:42 -812.525329 12.8778 BFGS: 461 16:10:42 -812.618494 12.9854 BFGS: 462 16:10:42 -812.711726 13.0923 BFGS: 463 16:10:42 -812.805117 13.1983 BFGS: 464 16:10:42 -812.898322 13.3035 BFGS: 465 16:10:42 -812.991834 13.4066 BFGS: 466 16:10:42 -813.085351 13.5107 BFGS: 467 16:10:42 -813.179070 13.6137 BFGS: 468 16:10:42 -813.272853 13.7164 BFGS: 469 16:10:42 -813.366796 13.8182 BFGS: 470 16:10:42 -813.460835 13.9196 BFGS: 471 16:10:43 -813.555018 14.0203 BFGS: 472 16:10:43 -813.649315 14.1204 BFGS: 473 16:10:43 -813.743748 14.2200 BFGS: 474 16:10:43 -813.838302 14.3191 BFGS: 475 16:10:43 -813.932986 14.4176 BFGS: 476 16:10:43 -814.027794 14.5156 BFGS: 477 16:10:43 -814.122728 14.6131 BFGS: 478 16:10:43 -814.217781 14.7102 BFGS: 479 16:10:43 -814.312951 14.8068 BFGS: 480 16:10:43 -814.408232 14.9031 BFGS: 481 16:10:43 -814.503615 14.9989 BFGS: 482 16:10:43 -814.599087 15.0944 BFGS: 483 16:10:43 -814.694623 15.1895 BFGS: 484 16:10:44 -814.790310 15.2846 BFGS: 485 16:10:44 -814.886390 15.3809 BFGS: 486 16:10:44 -814.982672 15.4754 BFGS: 487 16:10:44 -815.079126 15.5693 BFGS: 488 16:10:44 -815.175833 15.6627 BFGS: 489 16:10:44 -815.272796 15.7556 BFGS: 490 16:10:44 -815.370063 15.8480 BFGS: 491 16:10:44 -815.467647 15.9398 BFGS: 492 16:10:44 -815.565586 16.0310 BFGS: 493 16:10:44 -815.663910 16.1204 BFGS: 494 16:10:44 -815.763165 16.2100 BFGS: 495 16:10:45 -815.863715 16.2914 BFGS: 496 16:10:45 -815.964267 16.3817 BFGS: 497 16:10:45 -816.065642 16.4680 BFGS: 498 16:10:45 -816.167239 16.5560 BFGS: 499 16:10:45 -816.269594 16.6415 BFGS: 500 16:10:45 -816.372322 16.7277 BFGS: 501 16:10:45 -816.475791 16.8119 BFGS: 502 16:10:45 -816.579750 16.8962 BFGS: 503 16:10:45 -816.684459 16.9789 BFGS: 504 16:10:45 -816.789756 17.0614 BFGS: 505 16:10:45 -816.895828 17.1424 BFGS: 506 16:10:45 -817.002575 17.2230 BFGS: 507 16:10:46 -817.110139 17.3024 BFGS: 508 16:10:46 -817.219096 17.3796 BFGS: 509 16:10:46 -817.328607 17.4587 BFGS: 510 16:10:46 -817.439122 17.5350 BFGS: 511 16:10:46 -817.550396 17.6114 BFGS: 512 16:10:46 -817.662682 17.6859 BFGS: 513 16:10:46 -817.775837 17.7601 BFGS: 514 16:10:46 -817.890038 17.8327 BFGS: 515 16:10:46 -818.005201 17.9049 BFGS: 516 16:10:46 -818.121468 17.9751 BFGS: 517 16:10:46 -818.238997 18.0455 BFGS: 518 16:10:46 -818.357604 18.1145 BFGS: 519 16:10:47 -818.477373 18.1823 BFGS: 520 16:10:47 -818.598319 18.2490 BFGS: 521 16:10:47 -818.720494 18.3147 BFGS: 522 16:10:47 -818.843946 18.3793 BFGS: 523 16:10:47 -818.968661 18.4499 BFGS: 524 16:10:47 -819.095175 18.5050 BFGS: 525 16:10:47 -819.222583 18.5690 BFGS: 526 16:10:47 -819.351825 18.6268 BFGS: 527 16:10:47 -819.482270 18.6879 BFGS: 528 16:10:47 -819.614989 18.7481 BFGS: 529 16:10:47 -819.749361 18.8015 BFGS: 530 16:10:47 -819.886079 18.8574 BFGS: 531 16:10:48 -820.024319 18.9145 BFGS: 532 16:10:48 -820.164320 18.9678 BFGS: 533 16:10:48 -820.305881 19.0212 BFGS: 534 16:10:48 -820.449306 19.0721 BFGS: 535 16:10:48 -820.594419 19.1230 BFGS: 536 16:10:48 -820.741473 19.1718 BFGS: 537 16:10:48 -820.890339 19.2204 BFGS: 538 16:10:48 -821.041231 19.2670 BFGS: 539 16:10:48 -821.194058 19.3134 BFGS: 540 16:10:48 -821.349004 19.3579 BFGS: 541 16:10:48 -821.506012 19.4020 BFGS: 542 16:10:49 -821.665439 19.4433 BFGS: 543 16:10:49 -821.827553 19.4849 BFGS: 544 16:10:49 -821.991992 19.5249 BFGS: 545 16:10:49 -822.158770 19.5642 BFGS: 546 16:10:49 -822.328275 19.6020 BFGS: 547 16:10:49 -822.500288 19.6388 BFGS: 548 16:10:49 -822.674860 19.6743 BFGS: 549 16:10:49 -822.852059 19.7088 BFGS: 550 16:10:49 -823.031969 19.7422 BFGS: 551 16:10:49 -823.214683 19.7745 BFGS: 552 16:10:50 -823.400042 19.8023 BFGS: 553 16:10:50 -823.588762 19.8300 BFGS: 554 16:10:50 -823.780520 19.8580 BFGS: 555 16:10:50 -823.975501 19.8852 BFGS: 556 16:10:50 -824.173652 19.9122 BFGS: 557 16:10:50 -824.375179 19.9335 BFGS: 558 16:10:50 -824.580348 19.9616 BFGS: 559 16:10:50 -824.790027 19.9788 BFGS: 560 16:10:50 -825.002799 20.0083 BFGS: 561 16:10:50 -825.220291 20.0252 BFGS: 562 16:10:51 -825.440923 20.0516 BFGS: 563 16:10:51 -825.666212 20.0668 BFGS: 564 16:10:51 -825.895059 20.0899 BFGS: 565 16:10:51 -826.129093 20.1026 BFGS: 566 16:10:51 -826.366859 20.1250 BFGS: 567 16:10:51 -826.609988 20.1347 BFGS: 568 16:10:51 -826.857096 20.1552 BFGS: 569 16:10:51 -827.109972 20.1623 BFGS: 570 16:10:51 -827.367222 20.1817 BFGS: 571 16:10:51 -827.630841 20.1849 BFGS: 572 16:10:51 -827.898930 20.2039 BFGS: 573 16:10:52 -828.173952 20.2031 BFGS: 574 16:10:52 -828.453479 20.2238 BFGS: 575 16:10:52 -828.741013 20.2153 BFGS: 576 16:10:52 -829.032552 20.2445 BFGS: 577 16:10:52 -829.334922 20.2101 BFGS: 578 16:10:52 -829.631760 20.3637 BFGS: 579 16:10:52 -829.934100 20.4504 BFGS: 580 16:10:52 -830.259656 20.4451 BFGS: 581 16:10:52 -830.586334 20.4536 BFGS: 582 16:10:53 -830.925260 20.4528 BFGS: 583 16:10:53 -831.269954 20.4524 BFGS: 584 16:10:53 -831.625233 20.4508 BFGS: 585 16:10:53 -831.988479 20.4483 BFGS: 586 16:10:53 -832.362161 20.4453 BFGS: 587 16:10:53 -832.745307 20.4414 BFGS: 588 16:10:53 -833.139357 20.4371 BFGS: 589 16:10:53 -833.544271 20.4319 BFGS: 590 16:10:53 -833.961217 20.4257 BFGS: 591 16:10:53 -834.390060 20.4199 BFGS: 592 16:10:53 -834.831803 20.4130 BFGS: 593 16:10:54 -835.286760 20.4056 BFGS: 594 16:10:54 -835.756110 20.4002 BFGS: 595 16:10:54 -836.241752 20.3985 BFGS: 596 16:10:54 -836.742614 20.3907 BFGS: 597 16:10:54 -837.260015 20.3837 BFGS: 598 16:10:54 -837.794830 20.3717 BFGS: 599 16:10:54 -838.347783 20.3651 BFGS: 600 16:10:54 -838.919901 20.3552 BFGS: 601 16:10:54 -839.512270 20.3459 BFGS: 602 16:10:55 -840.125943 20.3360 BFGS: 603 16:10:55 -840.762116 20.3262 BFGS: 604 16:10:55 -841.421997 20.3163 BFGS: 605 16:10:55 -842.106902 20.3067 BFGS: 606 16:10:55 -842.818187 20.2972 BFGS: 607 16:10:55 -843.557296 20.2882 BFGS: 608 16:10:55 -844.325724 20.2798 BFGS: 609 16:10:55 -845.125038 20.2720 BFGS: 610 16:10:55 -845.956853 20.2653 BFGS: 611 16:10:55 -846.822837 20.2582 BFGS: 612 16:10:56 -847.724946 20.2559 BFGS: 613 16:10:56 -848.664853 20.2520 BFGS: 614 16:10:56 -849.646156 20.2557 BFGS: 615 16:10:56 -850.662350 20.2573 BFGS: 616 16:10:56 -851.698285 20.2748 BFGS: 617 16:10:56 -852.752872 20.2775 BFGS: 618 16:10:56 -853.823773 20.2944 BFGS: 619 16:10:56 -854.910986 20.3121 BFGS: 620 16:10:56 -856.013071 20.3328 BFGS: 621 16:10:56 -857.128767 20.3705 BFGS: 622 16:10:56 -858.257333 20.4076 BFGS: 623 16:10:57 -859.396461 20.4553 BFGS: 624 16:10:57 -860.544571 20.5092 BFGS: 625 16:10:57 -861.700121 20.5736 BFGS: 626 16:10:57 -862.860033 20.6476 BFGS: 627 16:10:57 -864.022964 20.7394 BFGS: 628 16:10:57 -865.186835 20.8316 BFGS: 629 16:10:57 -866.348065 20.9419 BFGS: 630 16:10:57 -867.504681 21.0632 BFGS: 631 16:10:57 -868.653624 21.2007 BFGS: 632 16:10:57 -869.792464 21.3519 BFGS: 633 16:10:57 -870.916952 21.5211 BFGS: 634 16:10:58 -871.988545 21.7422 BFGS: 635 16:10:58 -873.110132 21.8887 BFGS: 636 16:10:58 -874.214433 22.0933 BFGS: 637 16:10:58 -875.313487 22.2582 BFGS: 638 16:10:58 -876.398828 22.4627 BFGS: 639 16:10:58 -877.474741 22.6497 BFGS: 640 16:10:58 -878.536336 22.8621 BFGS: 641 16:10:58 -879.584558 23.0673 BFGS: 642 16:10:59 -880.615587 23.2899 BFGS: 643 16:10:59 -881.628627 23.5098 BFGS: 644 16:10:59 -882.620420 23.7420 BFGS: 645 16:10:59 -883.589780 23.9729 BFGS: 646 16:10:59 -884.534593 24.2121 BFGS: 647 16:10:59 -885.454782 24.4494 BFGS: 648 16:10:59 -886.349827 24.6895 BFGS: 649 16:11:00 -887.220674 24.9302 BFGS: 650 16:11:00 -888.068642 25.1693 BFGS: 651 16:11:00 -888.895085 25.4067 BFGS: 652 16:11:00 -889.701972 25.6506 BFGS: 653 16:11:00 -890.491088 25.8769 BFGS: 654 16:11:01 -891.263746 26.1120 BFGS: 655 16:11:01 -892.022273 26.3374 BFGS: 656 16:11:01 -892.767324 26.5706 BFGS: 657 16:11:01 -893.500939 26.7905 BFGS: 658 16:11:01 -894.223415 27.0209 BFGS: 659 16:11:01 -894.936760 27.2382 BFGS: 660 16:11:02 -895.641181 27.4663 BFGS: 661 16:11:02 -896.338454 27.6802 BFGS: 662 16:11:02 -897.028599 27.9034 BFGS: 663 16:11:02 -897.712815 28.1194 BFGS: 664 16:11:02 -898.391882 28.3384 BFGS: 665 16:11:02 -899.066644 28.5582 BFGS: 666 16:11:02 -899.738810 28.7374 BFGS: 667 16:11:02 -900.405781 28.9664 BFGS: 668 16:11:02 -901.070703 29.1436 BFGS: 669 16:11:02 -901.731039 29.3762 BFGS: 670 16:11:02 -902.390649 29.5426 BFGS: 671 16:11:03 -903.045994 29.7782 BFGS: 672 16:11:03 -903.701633 29.9313 BFGS: 673 16:11:03 -904.353004 30.1705 BFGS: 674 16:11:03 -905.005560 30.3094 BFGS: 675 16:11:03 -905.653672 30.5520 BFGS: 676 16:11:04 -906.303717 30.6780 BFGS: 677 16:11:04 -906.949119 30.9218 BFGS: 678 16:11:04 -907.596987 31.0387 BFGS: 679 16:11:04 -908.240161 31.2793 BFGS: 680 16:11:04 -908.886046 31.3929 BFGS: 681 16:11:05 -909.527671 31.6268 BFGS: 682 16:11:05 -910.172034 31.7413 BFGS: 683 16:11:05 -910.812199 31.9635 BFGS: 684 16:11:05 -911.454986 32.0843 BFGS: 685 16:11:05 -912.094164 32.2939 BFGS: 686 16:11:06 -912.735799 32.4225 BFGS: 687 16:11:06 -913.375116 32.6219 BFGS: 688 16:11:06 -914.016190 32.7619 BFGS: 689 16:11:06 -914.654855 32.9486 BFGS: 690 16:11:06 -915.296019 33.0959 BFGS: 691 16:11:06 -915.935509 33.2771 BFGS: 692 16:11:06 -916.578044 33.4296 BFGS: 693 16:11:06 -917.219251 33.6083 BFGS: 694 16:11:07 -917.864425 33.7661 BFGS: 695 16:11:07 -918.508677 33.9443 BFGS: 696 16:11:07 -919.158405 34.1041 BFGS: 697 16:11:07 -919.806515 34.3200 BFGS: 698 16:11:07 -920.462677 34.4819 BFGS: 699 16:11:07 -921.119819 34.6717 BFGS: 700 16:11:08 -921.768591 34.8486 BFGS: 701 16:11:08 -922.403349 35.0112 BFGS: 702 16:11:08 -923.020260 35.1797 BFGS: 703 16:11:08 -923.625606 35.3323 BFGS: 704 16:11:08 -924.216643 35.4837 BFGS: 705 16:11:09 -924.797765 35.6209 BFGS: 706 16:11:09 -925.367371 35.7526 BFGS: 707 16:11:09 -925.928515 35.8706 BFGS: 708 16:11:09 -926.480237 35.9797 BFGS: 709 16:11:09 -927.024783 36.0747 BFGS: 710 16:11:10 -927.560595 36.1462 BFGS: 711 16:11:10 -928.090679 36.2178 BFGS: 712 16:11:10 -928.613757 36.2805 BFGS: 713 16:11:10 -929.130986 36.3073 BFGS: 714 16:11:10 -929.642454 36.3352 BFGS: 715 16:11:11 -930.148270 36.3384 BFGS: 716 16:11:11 -930.648379 36.3280 BFGS: 717 16:11:11 -931.143197 36.2973 BFGS: 718 16:11:11 -931.632470 36.2491 BFGS: 719 16:11:11 -932.117073 36.1809 BFGS: 720 16:11:11 -932.595326 36.0936 BFGS: 721 16:11:12 -933.068551 35.9870 BFGS: 722 16:11:12 -933.536518 35.8604 BFGS: 723 16:11:12 -933.999281 35.7151 BFGS: 724 16:11:12 -934.457067 35.5442 BFGS: 725 16:11:13 -934.910075 35.3705 BFGS: 726 16:11:13 -935.356688 35.1652 BFGS: 727 16:11:13 -935.798649 34.9442 BFGS: 728 16:11:13 -936.235472 34.7033 BFGS: 729 16:11:13 -936.667553 34.4439 BFGS: 730 16:11:14 -937.094664 34.1678 BFGS: 731 16:11:14 -937.517130 33.8748 BFGS: 732 16:11:14 -937.935045 33.5669 BFGS: 733 16:11:14 -938.347865 33.2440 BFGS: 734 16:11:14 -938.756205 32.9102 BFGS: 735 16:11:15 -939.160767 32.5630 BFGS: 736 16:11:15 -939.560071 32.2078 BFGS: 737 16:11:15 -939.955467 31.8417 BFGS: 738 16:11:15 -940.346806 31.4670 BFGS: 739 16:11:15 -940.734506 31.0833 BFGS: 740 16:11:15 -941.118208 30.7704 BFGS: 741 16:11:15 -941.497254 30.4617 BFGS: 742 16:11:16 -941.873092 30.1472 BFGS: 743 16:11:16 -942.245554 29.8280 BFGS: 744 16:11:16 -942.614707 29.5043 BFGS: 745 16:11:16 -942.980029 29.1747 BFGS: 746 16:11:16 -943.342559 28.8404 BFGS: 747 16:11:17 -943.701924 28.5004 BFGS: 748 16:11:17 -944.058422 28.1581 BFGS: 749 16:11:17 -944.412046 27.8109 BFGS: 750 16:11:17 -944.762413 27.4638 BFGS: 751 16:11:17 -945.110060 27.1132 BFGS: 752 16:11:17 -945.455063 26.7613 BFGS: 753 16:11:17 -945.797476 26.4081 BFGS: 754 16:11:18 -946.137358 26.0543 BFGS: 755 16:11:18 -946.474762 25.6999 BFGS: 756 16:11:18 -946.809755 25.3458 BFGS: 757 16:11:18 -947.142386 24.9916 BFGS: 758 16:11:18 -947.472730 24.6384 BFGS: 759 16:11:18 -947.800830 24.2855 BFGS: 760 16:11:18 -948.126766 23.9344 BFGS: 761 16:11:18 -948.450576 23.5839 BFGS: 762 16:11:19 -948.772346 23.2357 BFGS: 763 16:11:19 -949.092105 22.8883 BFGS: 764 16:11:19 -949.410359 22.5439 BFGS: 765 16:11:19 -949.725842 22.1994 BFGS: 766 16:11:19 -950.039711 21.8617 BFGS: 767 16:11:19 -950.351804 21.5210 BFGS: 768 16:11:19 -950.662370 21.1894 BFGS: 769 16:11:19 -950.971251 20.8521 BFGS: 770 16:11:20 -951.278549 20.5301 BFGS: 771 16:11:20 -951.584250 20.1959 BFGS: 772 16:11:20 -951.888833 19.8836 BFGS: 773 16:11:20 -952.191675 19.5495 BFGS: 774 16:11:20 -952.493905 19.2461 BFGS: 775 16:11:21 -952.794095 18.9174 BFGS: 776 16:11:21 -953.093497 18.6195 BFGS: 777 16:11:21 -953.391398 18.2983 BFGS: 778 16:11:21 -953.688539 18.0036 BFGS: 779 16:11:21 -953.984360 17.6920 BFGS: 780 16:11:22 -954.279476 17.4001 BFGS: 781 16:11:22 -954.573598 17.0983 BFGS: 782 16:11:22 -954.866946 16.8063 BFGS: 783 16:11:22 -955.159371 16.5126 BFGS: 784 16:11:22 -955.451059 16.2287 BFGS: 785 16:11:23 -955.741909 15.9431 BFGS: 786 16:11:23 -956.032087 15.6651 BFGS: 787 16:11:23 -956.321711 15.3846 BFGS: 788 16:11:23 -956.610449 15.1127 BFGS: 789 16:11:23 -956.898661 14.8423 BFGS: 790 16:11:24 -957.186403 14.5765 BFGS: 791 16:11:24 -957.473961 14.3128 BFGS: 792 16:11:24 -957.761650 14.0546 BFGS: 793 16:11:24 -958.049190 13.7998 BFGS: 794 16:11:24 -958.335974 13.5477 BFGS: 795 16:11:25 -958.622235 13.2980 BFGS: 796 16:11:25 -958.908483 13.0530 BFGS: 797 16:11:25 -959.194329 12.8105 BFGS: 798 16:11:25 -959.479878 12.5726 BFGS: 799 16:11:25 -959.765193 12.3379 BFGS: 800 16:11:26 -960.050398 12.1070 BFGS: 801 16:11:26 -960.335438 11.8785 BFGS: 802 16:11:26 -960.620508 11.6547 BFGS: 803 16:11:26 -960.905802 11.4346 BFGS: 804 16:11:26 -961.191587 11.2205 BFGS: 805 16:11:27 -961.478097 11.0110 BFGS: 806 16:11:27 -961.765625 10.8083 BFGS: 807 16:11:27 -962.054418 10.6107 BFGS: 808 16:11:27 -962.344766 10.4205 BFGS: 809 16:11:27 -962.636908 10.2358 BFGS: 810 16:11:28 -962.931239 10.0589 BFGS: 811 16:11:28 -963.228162 9.8877 BFGS: 812 16:11:28 -963.527592 9.7241 BFGS: 813 16:11:28 -963.829730 9.5667 BFGS: 814 16:11:28 -964.134791 9.4169 BFGS: 815 16:11:29 -964.442947 9.2733 BFGS: 816 16:11:29 -964.754478 9.1373 BFGS: 817 16:11:29 -965.069557 9.0087 BFGS: 818 16:11:29 -965.389018 8.8858 BFGS: 819 16:11:29 -965.714095 8.7732 BFGS: 820 16:11:30 -966.042687 8.6597 BFGS: 821 16:11:30 -966.375098 8.5586 BFGS: 822 16:11:30 -966.711353 8.4574 BFGS: 823 16:11:30 -967.051665 8.3691 BFGS: 824 16:11:30 -967.396008 8.2799 BFGS: 825 16:11:31 -967.744838 8.2041 BFGS: 826 16:11:31 -968.098179 8.1260 BFGS: 827 16:11:31 -968.456320 8.0637 BFGS: 828 16:11:31 -968.819139 7.9967 BFGS: 829 16:11:31 -969.186287 7.9430 BFGS: 830 16:11:32 -969.557783 7.8852 BFGS: 831 16:11:32 -969.934260 7.8424 BFGS: 832 16:11:32 -970.315160 7.7949 BFGS: 833 16:11:32 -970.700678 7.7619 BFGS: 834 16:11:32 -971.090927 7.7210 BFGS: 835 16:11:33 -971.486244 7.7004 BFGS: 836 16:11:33 -971.886017 7.6656 BFGS: 837 16:11:33 -972.290542 7.6567 BFGS: 838 16:11:33 -972.699520 7.6271 BFGS: 839 16:11:33 -973.113470 7.6303 BFGS: 840 16:11:34 -973.532496 7.6045 BFGS: 841 16:11:34 -973.956404 7.6217 BFGS: 842 16:11:34 -974.385100 7.5910 BFGS: 843 16:11:34 -974.820438 7.6308 BFGS: 844 16:11:34 -975.259885 7.6566 BFGS: 845 16:11:35 -975.705111 7.7346 BFGS: 846 16:11:35 -976.144722 8.5061 BFGS: 847 16:11:35 -976.603454 8.3302 BFGS: 848 16:11:35 -977.061769 8.4263 BFGS: 849 16:11:35 -977.527624 8.3673 BFGS: 850 16:11:36 -977.996322 8.4205 BFGS: 851 16:11:36 -978.471172 8.3948 BFGS: 852 16:11:36 -978.949794 8.4345 BFGS: 853 16:11:36 -979.434155 8.4271 BFGS: 854 16:11:37 -979.923013 8.4603 BFGS: 855 16:11:37 -980.417496 8.4666 BFGS: 856 16:11:37 -980.917040 8.4985 BFGS: 857 16:11:37 -981.421703 8.5129 BFGS: 858 16:11:37 -981.931107 8.5463 BFGS: 859 16:11:37 -982.445680 8.5678 BFGS: 860 16:11:38 -982.965102 8.6024 BFGS: 861 16:11:38 -983.489693 8.6295 BFGS: 862 16:11:38 -984.019234 8.6658 BFGS: 863 16:11:38 -984.554144 8.6849 BFGS: 864 16:11:38 -985.094323 8.7310 BFGS: 865 16:11:39 -985.639812 8.7612 BFGS: 866 16:11:39 -986.190233 8.8072 BFGS: 867 16:11:39 -986.745991 8.8425 BFGS: 868 16:11:39 -987.306793 8.8886 BFGS: 869 16:11:39 -987.872929 8.9278 BFGS: 870 16:11:40 -988.444306 8.9744 BFGS: 871 16:11:40 -989.021005 9.0161 BFGS: 872 16:11:40 -989.603562 9.0694 BFGS: 873 16:11:40 -990.193128 9.1153 BFGS: 874 16:11:40 -990.789480 9.1582 BFGS: 875 16:11:41 -991.390873 9.2094 BFGS: 876 16:11:41 -991.998391 9.2539 BFGS: 877 16:11:41 -992.611540 9.3050 BFGS: 878 16:11:41 -993.230180 9.3522 BFGS: 879 16:11:42 -993.854592 9.4027 BFGS: 880 16:11:42 -994.484598 9.4513 BFGS: 881 16:11:42 -995.120126 9.5015 BFGS: 882 16:11:42 -995.762152 9.5493 BFGS: 883 16:11:42 -996.409670 9.6005 BFGS: 884 16:11:43 -997.062848 9.6499 BFGS: 885 16:11:43 -997.721771 9.7036 BFGS: 886 16:11:43 -998.386448 9.7489 BFGS: 887 16:11:43 -999.057217 9.8038 BFGS: 888 16:11:43 -999.733803 9.8514 BFGS: 889 16:11:43 -1000.416012 9.9032 BFGS: 890 16:11:44 -1001.103894 9.9518 BFGS: 891 16:11:44 -1001.797584 10.0024 BFGS: 892 16:11:44 -1002.497130 10.0507 BFGS: 893 16:11:44 -1003.202930 10.0990 BFGS: 894 16:11:44 -1003.914256 10.1484 BFGS: 895 16:11:45 -1004.631244 10.2030 BFGS: 896 16:11:45 -1005.354043 10.2565 BFGS: 897 16:11:45 -1006.082608 10.3103 BFGS: 898 16:11:45 -1006.816911 10.3642 BFGS: 899 16:11:45 -1007.557232 10.4179 BFGS: 900 16:11:46 -1008.303959 10.4728 BFGS: 901 16:11:46 -1009.056595 10.5316 BFGS: 902 16:11:46 -1009.815909 10.5870 BFGS: 903 16:11:46 -1010.580651 10.6435 BFGS: 904 16:11:47 -1011.351912 10.6985 BFGS: 905 16:11:47 -1012.128945 10.7541 BFGS: 906 16:11:47 -1012.911764 10.8095 BFGS: 907 16:11:47 -1013.700374 10.8651 BFGS: 908 16:11:47 -1014.495107 10.9206 BFGS: 909 16:11:48 -1015.296408 10.9771 BFGS: 910 16:11:48 -1016.103168 11.0332 BFGS: 911 16:11:48 -1016.916524 11.1181 BFGS: 912 16:11:48 -1017.736418 11.1745 BFGS: 913 16:11:49 -1018.562084 11.2310 BFGS: 914 16:11:49 -1019.394024 11.2883 BFGS: 915 16:11:49 -1020.233701 11.3446 BFGS: 916 16:11:49 -1021.079088 11.4156 BFGS: 917 16:11:49 -1021.931726 11.4937 BFGS: 918 16:11:50 -1022.790250 11.5518 BFGS: 919 16:11:50 -1023.655333 11.6082 BFGS: 920 16:11:50 -1024.527169 11.6866 BFGS: 921 16:11:50 -1025.405452 11.7438 BFGS: 922 16:11:51 -1026.289470 11.8013 BFGS: 923 16:11:51 -1027.179592 11.8585 BFGS: 924 16:11:51 -1028.076295 11.9238 BFGS: 925 16:11:51 -1028.980974 12.0016 BFGS: 926 16:11:52 -1029.891626 12.0622 BFGS: 927 16:11:52 -1030.808776 12.1219 BFGS: 928 16:11:52 -1031.732011 12.1895 BFGS: 929 16:11:52 -1032.661640 12.2551 BFGS: 930 16:11:53 -1033.598144 12.3210 BFGS: 931 16:11:53 -1034.540777 12.3792 BFGS: 932 16:11:53 -1035.490261 12.4354 BFGS: 933 16:11:53 -1036.446406 12.4927 BFGS: 934 16:11:53 -1037.408610 12.5552 BFGS: 935 16:11:54 -1038.376969 12.6118 BFGS: 936 16:11:54 -1039.351520 12.6683 BFGS: 937 16:11:54 -1040.332221 12.7247 BFGS: 938 16:11:54 -1041.319094 12.7808 BFGS: 939 16:11:54 -1042.312383 12.8549 BFGS: 940 16:11:55 -1043.312859 12.9253 BFGS: 941 16:11:55 -1044.320007 12.9884 BFGS: 942 16:11:55 -1045.334358 13.0445 BFGS: 943 16:11:55 -1046.354359 13.1011 BFGS: 944 16:11:55 -1047.381252 13.1557 BFGS: 945 16:11:55 -1048.414197 13.2104 BFGS: 946 16:11:56 -1049.453501 13.2685 BFGS: 947 16:11:56 -1050.499353 13.3223 BFGS: 948 16:11:56 -1051.551504 13.3758 BFGS: 949 16:11:56 -1052.609879 13.4288 BFGS: 950 16:11:57 -1053.674499 13.4813 BFGS: 951 16:11:57 -1054.745474 13.5426 BFGS: 952 16:11:57 -1055.822169 13.5947 BFGS: 953 16:11:57 -1056.905628 13.6452 BFGS: 954 16:11:58 -1057.995147 13.6960 BFGS: 955 16:11:58 -1059.091677 13.7668 BFGS: 956 16:11:58 -1060.195198 13.8315 BFGS: 957 16:11:58 -1061.307363 13.8805 BFGS: 958 16:11:59 -1062.425339 13.9298 BFGS: 959 16:11:59 -1063.549657 13.9778 BFGS: 960 16:11:59 -1064.680063 14.0255 BFGS: 961 16:11:59 -1065.816733 14.0721 BFGS: 962 16:12:00 -1066.959348 14.1186 BFGS: 963 16:12:00 -1068.108329 14.1663 BFGS: 964 16:12:00 -1069.264566 14.2119 BFGS: 965 16:12:00 -1070.427028 14.2555 BFGS: 966 16:12:01 -1071.595694 14.3009 BFGS: 967 16:12:01 -1072.770883 14.3428 BFGS: 968 16:12:01 -1073.952302 14.3921 BFGS: 969 16:12:01 -1075.139212 14.4317 BFGS: 970 16:12:02 -1076.333290 14.4805 BFGS: 971 16:12:02 -1077.534179 14.5258 BFGS: 972 16:12:02 -1078.741087 14.5722 BFGS: 973 16:12:02 -1079.954178 14.6090 BFGS: 974 16:12:02 -1081.173602 14.6437 BFGS: 975 16:12:03 -1082.399468 14.6989 BFGS: 976 16:12:03 -1083.632102 14.7293 BFGS: 977 16:12:03 -1084.870562 14.7665 BFGS: 978 16:12:03 -1086.114851 14.7954 BFGS: 979 16:12:04 -1087.365354 14.8353 BFGS: 980 16:12:04 -1088.621278 14.8620 BFGS: 981 16:12:04 -1089.882884 14.8863 BFGS: 982 16:12:04 -1091.150064 14.9095 BFGS: 983 16:12:04 -1092.422839 14.9309 BFGS: 984 16:12:05 -1093.701489 14.9658 BFGS: 985 16:12:05 -1094.985725 14.9851 BFGS: 986 16:12:05 -1096.276459 15.0025 BFGS: 987 16:12:05 -1097.572354 15.0232 BFGS: 988 16:12:06 -1098.873865 15.0363 BFGS: 989 16:12:06 -1100.180619 15.0476 BFGS: 990 16:12:06 -1101.492710 15.0610 BFGS: 991 16:12:06 -1102.810121 15.0683 BFGS: 992 16:12:07 -1104.132920 15.0856 BFGS: 993 16:12:07 -1105.461044 15.0936 BFGS: 994 16:12:07 -1106.794585 15.0949 BFGS: 995 16:12:07 -1108.133467 15.1023 BFGS: 996 16:12:08 -1109.477073 15.0992 BFGS: 997 16:12:08 -1110.825319 15.0937 BFGS: 998 16:12:08 -1112.178675 15.0857 BFGS: 999 16:12:08 -1113.536711 15.0753 BFGS: 1000 16:12:08 -1114.900038 15.0748 BFGS: 1001 16:12:09 -1116.268210 15.0598 BFGS: 1002 16:12:09 -1117.641115 15.0440 BFGS: 1003 16:12:09 -1119.019770 15.0400 BFGS: 1004 16:12:09 -1120.404250 15.0250 BFGS: 1005 16:12:10 -1121.793142 15.0003 BFGS: 1006 16:12:10 -1123.187042 14.9863 BFGS: 1007 16:12:10 -1124.585635 14.9571 BFGS: 1008 16:12:10 -1125.989193 14.9241 BFGS: 1009 16:12:10 -1127.397143 14.8883 BFGS: 1010 16:12:11 -1128.810151 14.8625 BFGS: 1011 16:12:11 -1130.228135 14.8217 BFGS: 1012 16:12:11 -1131.651117 14.7859 BFGS: 1013 16:12:11 -1133.078956 14.7397 BFGS: 1014 16:12:12 -1134.512661 14.6959 BFGS: 1015 16:12:12 -1135.951882 14.6458 BFGS: 1016 16:12:12 -1137.397893 14.5946 BFGS: 1017 16:12:12 -1138.853196 14.5563 BFGS: 1018 16:12:13 -1140.318897 14.5296 BFGS: 1019 16:12:13 -1141.794368 14.4817 BFGS: 1020 16:12:13 -1143.291007 14.4504 BFGS: 1021 16:12:13 -1144.810563 14.4213 BFGS: 1022 16:12:14 -1146.363327 14.4128 BFGS: 1023 16:12:14 -1147.951416 14.4175 BFGS: 1024 16:12:14 -1149.570499 14.4324 BFGS: 1025 16:12:14 -1151.215762 14.4507 BFGS: 1026 16:12:15 -1152.884504 14.4892 BFGS: 1027 16:12:15 -1154.560977 14.4996 BFGS: 1028 16:12:15 -1156.262766 14.5468 BFGS: 1029 16:12:15 -1157.954633 14.5333 BFGS: 1030 16:12:16 -1159.666983 14.5224 BFGS: 1031 16:12:16 -1161.392473 14.5202 BFGS: 1032 16:12:16 -1163.124999 14.5028 BFGS: 1033 16:12:16 -1164.864619 14.4796 BFGS: 1034 16:12:17 -1166.605486 14.4473 BFGS: 1035 16:12:17 -1168.344982 14.3908 BFGS: 1036 16:12:17 -1170.086480 14.3326 BFGS: 1037 16:12:17 -1171.831128 14.3717 BFGS: 1038 16:12:18 -1173.570505 14.4024 BFGS: 1039 16:12:18 -1175.305476 14.4331 BFGS: 1040 16:12:18 -1177.037225 14.4618 BFGS: 1041 16:12:19 -1178.764941 14.4784 BFGS: 1042 16:12:19 -1180.488382 14.4949 BFGS: 1043 16:12:19 -1182.206200 14.4961 BFGS: 1044 16:12:20 -1183.907782 14.4904 BFGS: 1045 16:12:20 -1185.600762 14.4823 BFGS: 1046 16:12:20 -1187.285488 14.4644 BFGS: 1047 16:12:21 -1188.956512 14.4410 BFGS: 1048 16:12:21 -1190.615746 14.4084 BFGS: 1049 16:12:21 -1192.263437 14.3689 BFGS: 1050 16:12:22 -1193.898439 14.3244 BFGS: 1051 16:12:22 -1195.519682 14.2702 BFGS: 1052 16:12:22 -1197.127350 14.2085 BFGS: 1053 16:12:22 -1198.720857 14.1392 BFGS: 1054 16:12:23 -1200.299658 14.0644 BFGS: 1055 16:12:23 -1201.863779 13.9843 BFGS: 1056 16:12:23 -1203.412751 13.8948 BFGS: 1057 16:12:23 -1204.943993 13.7935 BFGS: 1058 16:12:24 -1206.460411 13.6841 BFGS: 1059 16:12:24 -1207.960846 13.5659 BFGS: 1060 16:12:24 -1209.439203 13.4390 BFGS: 1061 16:12:25 -1210.904164 13.3083 BFGS: 1062 16:12:25 -1212.350055 13.1630 BFGS: 1063 16:12:25 -1213.779754 13.0088 BFGS: 1064 16:12:25 -1215.189658 12.8454 BFGS: 1065 16:12:26 -1216.582367 12.6717 BFGS: 1066 16:12:26 -1217.956283 12.4881 BFGS: 1067 16:12:26 -1219.308633 12.4351 BFGS: 1068 16:12:27 -1220.641799 12.4856 BFGS: 1069 16:12:27 -1221.953404 12.5370 BFGS: 1070 16:12:27 -1223.242573 12.5731 BFGS: 1071 16:12:27 -1224.512833 12.6197 BFGS: 1072 16:12:28 -1225.762195 12.6601 BFGS: 1073 16:12:28 -1226.989729 12.7009 BFGS: 1074 16:12:28 -1228.193671 12.7356 BFGS: 1075 16:12:28 -1229.371146 12.7632 BFGS: 1076 16:12:28 -1230.527425 12.7882 BFGS: 1077 16:12:29 -1231.659744 12.8095 BFGS: 1078 16:12:29 -1232.767637 12.8180 BFGS: 1079 16:12:29 -1233.850344 12.8188 BFGS: 1080 16:12:29 -1234.910085 12.8315 BFGS: 1081 16:12:29 -1235.939846 12.8322 BFGS: 1082 16:12:30 -1236.936051 12.8284 BFGS: 1083 16:12:30 -1237.916582 12.8044 BFGS: 1084 16:12:30 -1238.860764 12.7760 BFGS: 1085 16:12:31 -1239.779005 12.7954 BFGS: 1086 16:12:31 -1240.675700 13.0049 BFGS: 1087 16:12:31 -1241.541834 13.2019 BFGS: 1088 16:12:31 -1242.384424 13.3946 BFGS: 1089 16:12:32 -1243.205280 13.5763 BFGS: 1090 16:12:32 -1244.007586 13.7463 BFGS: 1091 16:12:32 -1244.797715 13.9029 BFGS: 1092 16:12:32 -1245.573079 14.0372 BFGS: 1093 16:12:33 -1246.334008 14.1465 BFGS: 1094 16:12:33 -1247.084021 14.2334 BFGS: 1095 16:12:33 -1247.835574 14.2649 BFGS: 1096 16:12:34 -1248.578601 14.2440 BFGS: 1097 16:12:34 -1249.331232 14.1580 BFGS: 1098 16:12:34 -1250.093065 14.3102 BFGS: 1099 16:12:35 -1250.897156 14.8897 BFGS: 1100 16:12:35 -1251.734684 15.2398 BFGS: 1101 16:12:35 -1252.755173 15.4849 BFGS: 1102 16:12:36 -1253.982511 15.0095 BFGS: 1103 16:12:36 -1255.483561 13.2399 BFGS: 1104 16:12:36 -1257.003941 10.6470 BFGS: 1105 16:12:36 -1258.172790 10.1084 BFGS: 1106 16:12:37 -1259.114733 9.3997 BFGS: 1107 16:12:37 -1259.932936 8.9163 BFGS: 1108 16:12:37 -1260.590348 8.0252 BFGS: 1109 16:12:38 -1261.125772 7.2935 BFGS: 1110 16:12:38 -1261.530055 5.9065 BFGS: 1111 16:12:38 -1261.801027 4.6101 BFGS: 1112 16:12:39 -1261.917857 3.3891 BFGS: 1113 16:12:39 -1262.045677 2.5038 BFGS: 1114 16:12:39 -1262.182312 2.1562 BFGS: 1115 16:12:39 -1262.261985 2.6089 BFGS: 1116 16:12:40 -1262.321551 1.9714 BFGS: 1117 16:12:40 -1262.391488 2.9441 BFGS: 1118 16:12:40 -1262.468357 2.7061 BFGS: 1119 16:12:41 -1262.550030 2.8638 BFGS: 1120 16:12:41 -1262.632161 2.3639 BFGS: 1121 16:12:41 -1262.712731 1.9691 BFGS: 1122 16:12:41 -1262.790803 2.1467 BFGS: 1123 16:12:42 -1262.866714 2.3016 BFGS: 1124 16:12:42 -1262.941831 2.4364 BFGS: 1125 16:12:42 -1263.016724 2.5713 BFGS: 1126 16:12:42 -1263.092751 2.6864 BFGS: 1127 16:12:43 -1263.169943 2.7960 BFGS: 1128 16:12:43 -1263.249016 2.9631 BFGS: 1129 16:12:43 -1263.330072 3.3206 BFGS: 1130 16:12:44 -1263.412625 3.9372 BFGS: 1131 16:12:44 -1263.496675 4.5536 BFGS: 1132 16:12:44 -1263.658692 5.1947 BFGS: 1133 16:12:44 -1263.838805 5.8546 BFGS: 1134 16:12:45 -1264.031920 6.5414 BFGS: 1135 16:12:45 -1264.260314 7.1744 BFGS: 1136 16:12:45 -1264.544826 7.8488 BFGS: 1137 16:12:46 -1264.882006 8.6591 BFGS: 1138 16:12:46 -1265.298036 9.3775 BFGS: 1139 16:12:47 -1265.817191 10.0121 BFGS: 1140 16:12:47 -1266.468370 10.5625 BFGS: 1141 16:12:47 -1267.278896 11.0230 BFGS: 1142 16:12:47 -1268.276761 11.4005 BFGS: 1143 16:12:48 -1269.481735 11.6873 BFGS: 1144 16:12:48 -1270.910223 11.8929 BFGS: 1145 16:12:48 -1272.557362 12.0524 BFGS: 1146 16:12:49 -1274.417032 12.1622 BFGS: 1147 16:12:49 -1276.456745 12.2578 BFGS: 1148 16:12:49 -1278.646852 12.3624 BFGS: 1149 16:12:49 -1280.948158 12.5112 BFGS: 1150 16:12:50 -1283.331685 12.7189 BFGS: 1151 16:12:50 -1285.755804 12.9883 BFGS: 1152 16:12:50 -1288.184999 13.3258 BFGS: 1153 16:12:51 -1290.597927 13.7082 BFGS: 1154 16:12:51 -1292.965532 14.1349 BFGS: 1155 16:12:51 -1295.266601 14.5813 BFGS: 1156 16:12:51 -1297.488388 15.0377 BFGS: 1157 16:12:52 -1299.564559 15.5270 BFGS: 1158 16:12:52 -1301.583737 15.9859 BFGS: 1159 16:12:52 -1303.550646 16.3748 BFGS: 1160 16:12:53 -1305.469133 16.6583 BFGS: 1161 16:12:53 -1307.329463 16.8289 BFGS: 1162 16:12:53 -1309.136529 16.8284 BFGS: 1163 16:12:53 -1310.840844 16.7090 BFGS: 1164 16:12:54 -1312.434142 16.4874 BFGS: 1165 16:12:54 -1313.902327 16.2032 BFGS: 1166 16:12:55 -1315.241853 15.9175 BFGS: 1167 16:12:55 -1316.451199 15.6429 BFGS: 1168 16:12:55 -1317.547575 15.3927 BFGS: 1169 16:12:55 -1318.543073 15.1673 BFGS: 1170 16:12:56 -1319.449435 14.9615 BFGS: 1171 16:12:56 -1320.271254 14.7820 BFGS: 1172 16:12:56 -1321.027251 14.5870 BFGS: 1173 16:12:57 -1321.720227 14.3963 BFGS: 1174 16:12:57 -1322.359097 14.2020 BFGS: 1175 16:12:57 -1322.950594 14.0103 BFGS: 1176 16:12:57 -1323.501195 13.9916 BFGS: 1177 16:12:58 -1324.017720 14.2137 BFGS: 1178 16:12:58 -1324.506523 14.4374 BFGS: 1179 16:12:58 -1324.973455 14.6622 BFGS: 1180 16:12:59 -1325.422977 14.8869 BFGS: 1181 16:12:59 -1325.861070 15.1133 BFGS: 1182 16:12:59 -1326.290654 15.3372 BFGS: 1183 16:12:59 -1326.714619 15.5580 BFGS: 1184 16:13:00 -1327.135439 15.7735 BFGS: 1185 16:13:00 -1327.552950 15.9698 BFGS: 1186 16:13:00 -1327.970265 16.1732 BFGS: 1187 16:13:01 -1328.384902 16.3652 BFGS: 1188 16:13:01 -1328.799407 16.5443 BFGS: 1189 16:13:01 -1329.211912 16.7069 BFGS: 1190 16:13:02 -1329.622944 16.8484 BFGS: 1191 16:13:02 -1330.031674 16.9635 BFGS: 1192 16:13:02 -1330.437837 17.0462 BFGS: 1193 16:13:02 -1330.841401 17.0895 BFGS: 1194 16:13:03 -1331.238420 17.0927 BFGS: 1195 16:13:03 -1331.634487 17.0386 BFGS: 1196 16:13:03 -1332.026974 16.9210 BFGS: 1197 16:13:04 -1332.416091 16.7371 BFGS: 1198 16:13:04 -1332.797328 16.4930 BFGS: 1199 16:13:05 -1333.175453 16.1759 BFGS: 1200 16:13:05 -1333.545964 15.7938 BFGS: 1201 16:13:05 -1333.908819 15.3532 BFGS: 1202 16:13:06 -1334.261751 14.8673 BFGS: 1203 16:13:06 -1334.600231 14.3479 BFGS: 1204 16:13:06 -1334.899159 13.8556 BFGS: 1205 16:13:07 -1335.165985 13.3823 BFGS: 1206 16:13:07 -1335.410171 12.9210 BFGS: 1207 16:13:07 -1335.641331 12.4874 BFGS: 1208 16:13:08 -1335.860244 12.0693 BFGS: 1209 16:13:08 -1336.074030 11.6297 BFGS: 1210 16:13:08 -1336.288382 11.1685 BFGS: 1211 16:13:08 -1336.504974 10.7011 BFGS: 1212 16:13:09 -1336.726831 10.2161 BFGS: 1213 16:13:09 -1336.938780 9.7418 BFGS: 1214 16:13:09 -1337.134927 9.3174 BFGS: 1215 16:13:10 -1337.321219 8.9122 BFGS: 1216 16:13:10 -1337.499468 8.5499 BFGS: 1217 16:13:10 -1337.672322 8.4577 BFGS: 1218 16:13:10 -1337.842832 8.5131 BFGS: 1219 16:13:11 -1338.015449 8.5426 BFGS: 1220 16:13:11 -1338.208726 8.6140 BFGS: 1221 16:13:11 -1338.407239 8.6432 BFGS: 1222 16:13:12 -1338.618717 8.6680 BFGS: 1223 16:13:12 -1338.851336 8.6916 BFGS: 1224 16:13:12 -1339.103177 8.7011 BFGS: 1225 16:13:12 -1339.376501 8.7034 BFGS: 1226 16:13:12 -1339.658445 8.6837 BFGS: 1227 16:13:13 -1339.959977 8.6615 BFGS: 1228 16:13:13 -1340.251554 8.5983 BFGS: 1229 16:13:13 -1340.586265 8.6093 BFGS: 1230 16:13:14 -1340.866771 8.5108 BFGS: 1231 16:13:14 -1341.235159 8.6114 BFGS: 1232 16:13:14 -1341.522030 8.4863 BFGS: 1233 16:13:15 -1341.844314 8.4177 BFGS: 1234 16:13:15 -1342.159300 8.3448 BFGS: 1235 16:13:15 -1342.452666 8.5944 BFGS: 1236 16:13:16 -1342.731687 8.9835 BFGS: 1237 16:13:16 -1342.981315 9.4197 BFGS: 1238 16:13:16 -1343.226758 9.7188 BFGS: 1239 16:13:17 -1343.437573 10.1292 BFGS: 1240 16:13:17 -1343.661090 10.2923 BFGS: 1241 16:13:17 -1343.851024 10.6576 BFGS: 1242 16:13:18 -1344.036112 10.8926 BFGS: 1243 16:13:18 -1344.209556 11.1290 BFGS: 1244 16:13:18 -1344.375155 11.3429 BFGS: 1245 16:13:19 -1344.533701 11.5340 BFGS: 1246 16:13:19 -1344.685111 11.7075 BFGS: 1247 16:13:20 -1344.830218 11.8647 BFGS: 1248 16:13:20 -1344.969947 12.0062 BFGS: 1249 16:13:20 -1345.103800 12.1363 BFGS: 1250 16:13:21 -1345.233890 12.2558 BFGS: 1251 16:13:21 -1345.359945 12.3706 BFGS: 1252 16:13:21 -1345.482324 12.4804 BFGS: 1253 16:13:21 -1345.601312 12.5880 BFGS: 1254 16:13:22 -1345.717452 12.6952 BFGS: 1255 16:13:22 -1345.827357 12.8149 BFGS: 1256 16:13:22 -1345.939887 12.9103 BFGS: 1257 16:13:23 -1346.048576 13.0252 BFGS: 1258 16:13:23 -1346.152546 13.1446 BFGS: 1259 16:13:23 -1346.255817 13.2644 BFGS: 1260 16:13:23 -1346.355771 13.3945 BFGS: 1261 16:13:24 -1346.470383 13.5563 BFGS: 1262 16:13:24 -1346.598132 13.6880 BFGS: 1263 16:13:24 -1346.743601 13.8008 BFGS: 1264 16:13:25 -1346.898470 13.8857 BFGS: 1265 16:13:25 -1347.064666 13.9737 BFGS: 1266 16:13:26 -1347.239066 14.0229 BFGS: 1267 16:13:26 -1347.422828 14.0917 BFGS: 1268 16:13:26 -1347.614363 14.1231 BFGS: 1269 16:13:26 -1347.813010 14.1791 BFGS: 1270 16:13:27 -1348.018107 14.2032 BFGS: 1271 16:13:27 -1348.229402 14.2640 BFGS: 1272 16:13:27 -1348.446147 14.2861 BFGS: 1273 16:13:28 -1348.670913 14.3594 BFGS: 1274 16:13:28 -1348.900452 14.3857 BFGS: 1275 16:13:28 -1349.135589 14.4730 BFGS: 1276 16:13:29 -1349.375457 14.4923 BFGS: 1277 16:13:29 -1349.622060 14.6407 BFGS: 1278 16:13:29 -1349.873014 14.5293 BFGS: 1279 16:13:30 -1350.118684 14.7011 BFGS: 1280 16:13:30 -1350.390474 14.7150 BFGS: 1281 16:13:30 -1350.666678 14.7912 BFGS: 1282 16:13:31 -1350.949958 14.8687 BFGS: 1283 16:13:31 -1351.241663 14.9599 BFGS: 1284 16:13:31 -1351.543028 15.0632 BFGS: 1285 16:13:31 -1351.854821 15.2165 BFGS: 1286 16:13:32 -1352.178309 15.4448 BFGS: 1287 16:13:32 -1352.515629 15.6878 BFGS: 1288 16:13:32 -1352.866599 15.9475 BFGS: 1289 16:13:33 -1353.233407 16.2215 BFGS: 1290 16:13:33 -1353.616705 16.5122 BFGS: 1291 16:13:33 -1354.018221 16.8143 BFGS: 1292 16:13:34 -1354.439653 17.1263 BFGS: 1293 16:13:34 -1354.882652 17.4439 BFGS: 1294 16:13:34 -1355.348500 17.7668 BFGS: 1295 16:13:35 -1355.838889 18.0867 BFGS: 1296 16:13:35 -1356.355110 18.3996 BFGS: 1297 16:13:35 -1356.897214 18.7167 BFGS: 1298 16:13:36 -1357.467244 19.0036 BFGS: 1299 16:13:36 -1358.063244 19.2581 BFGS: 1300 16:13:37 -1358.685257 19.4826 BFGS: 1301 16:13:37 -1359.333537 19.6651 BFGS: 1302 16:13:37 -1360.005655 19.8128 BFGS: 1303 16:13:38 -1360.700679 19.9159 BFGS: 1304 16:13:38 -1361.417045 19.9789 BFGS: 1305 16:13:39 -1362.153730 19.9996 BFGS: 1306 16:13:39 -1362.910685 19.9828 BFGS: 1307 16:13:39 -1363.687879 19.9296 BFGS: 1308 16:13:40 -1364.483466 19.8372 BFGS: 1309 16:13:40 -1365.296811 19.7302 BFGS: 1310 16:13:40 -1366.128577 19.5947 BFGS: 1311 16:13:41 -1366.978558 19.4413 BFGS: 1312 16:13:41 -1367.845769 19.2682 BFGS: 1313 16:13:41 -1368.730774 19.0846 BFGS: 1314 16:13:42 -1369.633942 18.8882 BFGS: 1315 16:13:42 -1370.555815 18.6827 BFGS: 1316 16:13:42 -1371.496670 18.4703 BFGS: 1317 16:13:43 -1372.456919 18.2630 BFGS: 1318 16:13:43 -1373.437769 18.0434 BFGS: 1319 16:13:43 -1374.439300 17.7950 BFGS: 1320 16:13:44 -1375.464855 17.5685 BFGS: 1321 16:13:44 -1376.508663 17.3101 BFGS: 1322 16:13:44 -1377.574154 17.1010 BFGS: 1323 16:13:45 -1378.659443 16.8373 BFGS: 1324 16:13:45 -1379.764136 16.6092 BFGS: 1325 16:13:45 -1380.887835 16.3420 BFGS: 1326 16:13:46 -1382.030751 16.1227 BFGS: 1327 16:13:46 -1383.190345 15.8426 BFGS: 1328 16:13:46 -1384.371148 15.6505 BFGS: 1329 16:13:47 -1385.563497 15.2789 BFGS: 1330 16:13:47 -1386.742775 14.8577 BFGS: 1331 16:13:47 -1387.990559 14.6879 BFGS: 1332 16:13:48 -1389.179647 14.3436 BFGS: 1333 16:13:48 -1390.391864 14.0733 BFGS: 1334 16:13:48 -1391.719772 13.8777 BFGS: 1335 16:13:49 -1393.087482 13.8555 BFGS: 1336 16:13:49 -1394.428302 13.4710 BFGS: 1337 16:13:49 -1395.847622 13.4065 BFGS: 1338 16:13:50 -1397.336207 13.5119 BFGS: 1339 16:13:50 -1398.994365 13.6619 BFGS: 1340 16:13:50 -1400.455292 14.1375 BFGS: 1341 16:13:51 -1402.432528 13.9827 BFGS: 1342 16:13:51 -1404.735221 14.1680 BFGS: 1343 16:13:51 -1407.378759 14.3744 BFGS: 1344 16:13:52 -1410.351025 14.5649 BFGS: 1345 16:13:52 -1413.688119 14.6439 BFGS: 1346 16:13:52 -1416.518688 14.4402 BFGS: 1347 16:13:53 -1418.155328 14.2505 BFGS: 1348 16:13:53 -1419.434113 14.0841 BFGS: 1349 16:13:54 -1420.545072 13.8800 BFGS: 1350 16:13:54 -1421.517707 13.6987 BFGS: 1351 16:13:54 -1422.401083 13.4870 BFGS: 1352 16:13:55 -1423.207609 13.3065 BFGS: 1353 16:13:55 -1423.967478 13.0899 BFGS: 1354 16:13:55 -1424.679317 12.9198 BFGS: 1355 16:13:55 -1425.363895 12.7016 BFGS: 1356 16:13:56 -1426.014562 12.5413 BFGS: 1357 16:13:56 -1426.646379 12.3339 BFGS: 1358 16:13:56 -1427.254739 12.1666 BFGS: 1359 16:13:57 -1427.848103 11.9745 BFGS: 1360 16:13:57 -1428.425336 11.8057 BFGS: 1361 16:13:57 -1428.991496 11.6295 BFGS: 1362 16:13:58 -1429.546513 11.4652 BFGS: 1363 16:13:58 -1430.093338 11.2989 BFGS: 1364 16:13:58 -1430.633086 11.1408 BFGS: 1365 16:13:59 -1431.168035 10.9830 BFGS: 1366 16:13:59 -1431.699534 10.8938 BFGS: 1367 16:13:59 -1432.229753 11.0834 BFGS: 1368 16:14:00 -1432.759347 11.2870 BFGS: 1369 16:14:00 -1433.289783 11.4972 BFGS: 1370 16:14:00 -1433.819175 11.7385 BFGS: 1371 16:14:01 -1434.341084 12.0008 BFGS: 1372 16:14:01 -1434.841095 12.2628 BFGS: 1373 16:14:01 -1435.317769 12.3909 BFGS: 1374 16:14:01 -1435.773137 12.4007 BFGS: 1375 16:14:02 -1436.212291 12.3392 BFGS: 1376 16:14:02 -1436.635956 12.2353 BFGS: 1377 16:14:02 -1437.047422 12.5265 BFGS: 1378 16:14:02 -1437.447909 12.7213 BFGS: 1379 16:14:03 -1437.839414 12.9475 BFGS: 1380 16:14:03 -1438.223427 13.1007 BFGS: 1381 16:14:03 -1438.600424 13.2693 BFGS: 1382 16:14:03 -1438.972369 13.3899 BFGS: 1383 16:14:04 -1439.339551 13.5078 BFGS: 1384 16:14:04 -1439.703112 13.6016 BFGS: 1385 16:14:05 -1440.063595 13.6693 BFGS: 1386 16:14:05 -1440.421649 13.7333 BFGS: 1387 16:14:05 -1440.777928 13.7756 BFGS: 1388 16:14:05 -1441.133372 13.9615 BFGS: 1389 16:14:06 -1441.487489 14.1652 BFGS: 1390 16:14:06 -1441.841387 14.3663 BFGS: 1391 16:14:07 -1442.195446 14.5617 BFGS: 1392 16:14:07 -1442.549251 14.7528 BFGS: 1393 16:14:07 -1442.903812 14.9344 BFGS: 1394 16:14:08 -1443.259616 15.1096 BFGS: 1395 16:14:08 -1443.617334 15.2738 BFGS: 1396 16:14:08 -1443.977221 15.4315 BFGS: 1397 16:14:09 -1444.339417 15.5783 BFGS: 1398 16:14:09 -1444.705171 15.7146 BFGS: 1399 16:14:09 -1445.074499 15.8401 BFGS: 1400 16:14:10 -1445.449314 15.9537 BFGS: 1401 16:14:10 -1445.830064 16.0570 BFGS: 1402 16:14:10 -1446.218247 16.1467 BFGS: 1403 16:14:11 -1446.615599 16.2239 BFGS: 1404 16:14:11 -1447.025194 16.2864 BFGS: 1405 16:14:11 -1447.447039 16.3337 BFGS: 1406 16:14:12 -1447.887823 16.3629 BFGS: 1407 16:14:12 -1448.348954 16.3781 BFGS: 1408 16:14:12 -1448.843864 16.3778 BFGS: 1409 16:14:13 -1449.366337 16.3529 BFGS: 1410 16:14:13 -1449.983660 16.3520 BFGS: 1411 16:14:13 -1450.622415 16.3224 BFGS: 1412 16:14:14 -1451.414041 16.1298 BFGS: 1413 16:14:14 -1452.486234 16.0506 BFGS: 1414 16:14:14 -1453.700104 15.8297 BFGS: 1415 16:14:15 -1454.767793 15.4985 BFGS: 1416 16:14:15 -1455.732582 15.2162 BFGS: 1417 16:14:15 -1456.649179 14.9130 BFGS: 1418 16:14:16 -1457.541334 14.5627 BFGS: 1419 16:14:16 -1458.419916 14.1516 BFGS: 1420 16:14:16 -1459.293223 13.6720 BFGS: 1421 16:14:17 -1460.167533 13.1227 BFGS: 1422 16:14:17 -1461.049158 12.9242 BFGS: 1423 16:14:17 -1461.941508 13.3328 BFGS: 1424 16:14:18 -1462.856058 13.7359 BFGS: 1425 16:14:18 -1463.798505 14.1453 BFGS: 1426 16:14:18 -1464.723265 14.5290 BFGS: 1427 16:14:18 -1465.649187 14.8930 BFGS: 1428 16:14:19 -1466.585371 15.2326 BFGS: 1429 16:14:19 -1467.542440 15.5327 BFGS: 1430 16:14:20 -1468.539467 15.7790 BFGS: 1431 16:14:20 -1469.617631 15.9448 BFGS: 1432 16:14:20 -1470.807290 15.9789 BFGS: 1433 16:14:20 -1471.747394 15.8451 BFGS: 1434 16:14:21 -1472.551392 15.6823 BFGS: 1435 16:14:21 -1473.325267 15.4049 BFGS: 1436 16:14:21 -1474.046571 15.1598 BFGS: 1437 16:14:22 -1474.745602 14.8932 BFGS: 1438 16:14:22 -1475.417838 14.6352 BFGS: 1439 16:14:22 -1476.063012 14.3897 BFGS: 1440 16:14:23 -1476.681102 14.1573 BFGS: 1441 16:14:23 -1477.274155 13.9375 BFGS: 1442 16:14:24 -1477.844003 13.7282 BFGS: 1443 16:14:24 -1478.391836 13.9049 BFGS: 1444 16:14:25 -1478.920366 14.2581 BFGS: 1445 16:14:25 -1479.431427 14.6069 BFGS: 1446 16:14:25 -1479.926785 14.9400 BFGS: 1447 16:14:26 -1480.406892 15.2910 BFGS: 1448 16:14:26 -1480.874486 15.6309 BFGS: 1449 16:14:26 -1481.330529 15.9658 BFGS: 1450 16:14:27 -1481.774646 16.2998 BFGS: 1451 16:14:27 -1482.208833 16.6306 BFGS: 1452 16:14:27 -1482.635108 16.9604 BFGS: 1453 16:14:28 -1483.054762 17.2869 BFGS: 1454 16:14:28 -1483.466905 17.6120 BFGS: 1455 16:14:28 -1483.872953 17.9348 BFGS: 1456 16:14:29 -1484.272522 18.2551 BFGS: 1457 16:14:29 -1484.666973 18.5741 BFGS: 1458 16:14:30 -1485.056990 18.8897 BFGS: 1459 16:14:30 -1485.441796 19.2046 BFGS: 1460 16:14:30 -1485.822523 19.5185 BFGS: 1461 16:14:31 -1486.199621 19.8290 BFGS: 1462 16:14:31 -1486.573402 20.1401 BFGS: 1463 16:14:31 -1486.944019 20.4445 BFGS: 1464 16:14:32 -1487.312233 20.7479 BFGS: 1465 16:14:32 -1487.678139 21.0492 BFGS: 1466 16:14:33 -1488.042112 21.3483 BFGS: 1467 16:14:33 -1488.403310 21.6451 BFGS: 1468 16:14:33 -1488.763067 21.9403 BFGS: 1469 16:14:34 -1489.121514 22.2327 BFGS: 1470 16:14:34 -1489.478865 22.5220 BFGS: 1471 16:14:34 -1489.835391 22.8099 BFGS: 1472 16:14:35 -1490.191498 23.0931 BFGS: 1473 16:14:35 -1490.546077 23.3648 BFGS: 1474 16:14:35 -1490.899864 23.6447 BFGS: 1475 16:14:36 -1491.254517 23.9220 BFGS: 1476 16:14:36 -1491.609706 24.1922 BFGS: 1477 16:14:37 -1491.964887 24.4619 BFGS: 1478 16:14:37 -1492.320641 24.7263 BFGS: 1479 16:14:37 -1492.677087 24.9870 BFGS: 1480 16:14:38 -1493.034367 25.2433 BFGS: 1481 16:14:38 -1493.391150 25.4937 BFGS: 1482 16:14:39 -1493.749331 25.7449 BFGS: 1483 16:14:39 -1494.109958 25.9879 BFGS: 1484 16:14:39 -1494.471636 26.2305 BFGS: 1485 16:14:40 -1494.834956 26.4643 BFGS: 1486 16:14:40 -1495.200441 26.6931 BFGS: 1487 16:14:40 -1495.567328 26.9114 BFGS: 1488 16:14:41 -1495.936579 27.1314 BFGS: 1489 16:14:41 -1496.308357 27.3440 BFGS: 1490 16:14:42 -1496.683025 27.5417 BFGS: 1491 16:14:42 -1497.059532 27.7454 BFGS: 1492 16:14:42 -1497.439395 27.9373 BFGS: 1493 16:14:43 -1497.821845 28.1220 BFGS: 1494 16:14:43 -1498.206939 28.3010 BFGS: 1495 16:14:44 -1498.594884 28.4721 BFGS: 1496 16:14:44 -1498.986151 28.6346 BFGS: 1497 16:14:44 -1499.380469 28.7897 BFGS: 1498 16:14:45 -1499.778048 28.9360 BFGS: 1499 16:14:45 -1500.178740 29.0742 BFGS: 1500 16:14:46 -1500.582630 29.2034 BFGS: 1501 16:14:46 -1500.989822 29.3239 BFGS: 1502 16:14:46 -1501.399502 29.4355 BFGS: 1503 16:14:47 -1501.812357 29.5379 BFGS: 1504 16:14:47 -1502.228264 29.6305 BFGS: 1505 16:14:47 -1502.647283 29.7134 BFGS: 1506 16:14:48 -1503.067866 29.7889 BFGS: 1507 16:14:48 -1503.491191 29.8542 BFGS: 1508 16:14:49 -1503.917764 29.9072 BFGS: 1509 16:14:49 -1504.346763 29.9513 BFGS: 1510 16:14:49 -1504.778614 29.9827 BFGS: 1511 16:14:50 -1505.212846 30.0049 BFGS: 1512 16:14:50 -1505.649448 30.0115 BFGS: 1513 16:14:50 -1506.087554 30.0123 BFGS: 1514 16:14:51 -1506.527545 29.9980 BFGS: 1515 16:14:51 -1506.968353 29.9733 BFGS: 1516 16:14:52 -1507.410378 29.9396 BFGS: 1517 16:14:52 -1507.853788 29.8909 BFGS: 1518 16:14:52 -1508.298652 29.8284 BFGS: 1519 16:14:53 -1508.744524 29.7533 BFGS: 1520 16:14:53 -1509.191815 29.6675 BFGS: 1521 16:14:53 -1509.639333 29.5642 BFGS: 1522 16:14:54 -1510.087120 29.4503 BFGS: 1523 16:14:54 -1510.535327 29.3202 BFGS: 1524 16:14:54 -1510.983434 29.1777 BFGS: 1525 16:14:55 -1511.431304 29.0191 BFGS: 1526 16:14:55 -1511.878938 28.8450 BFGS: 1527 16:14:55 -1512.326051 28.6562 BFGS: 1528 16:14:56 -1512.773031 28.4509 BFGS: 1529 16:14:56 -1513.218348 28.2300 BFGS: 1530 16:14:57 -1513.663161 27.9925 BFGS: 1531 16:14:57 -1514.105357 27.7445 BFGS: 1532 16:14:57 -1514.546291 27.4760 BFGS: 1533 16:14:58 -1514.984857 27.1911 BFGS: 1534 16:14:58 -1515.421553 26.8870 BFGS: 1535 16:14:59 -1515.855437 26.5680 BFGS: 1536 16:14:59 -1516.287134 26.2275 BFGS: 1537 16:14:59 -1516.715483 25.8742 BFGS: 1538 16:15:00 -1517.141191 25.4990 BFGS: 1539 16:15:00 -1517.563073 25.1058 BFGS: 1540 16:15:01 -1517.981430 24.6922 BFGS: 1541 16:15:01 -1518.396028 24.2602 BFGS: 1542 16:15:02 -1518.808904 23.8080 BFGS: 1543 16:15:02 -1519.215885 23.3381 BFGS: 1544 16:15:02 -1519.619643 22.8401 BFGS: 1545 16:15:03 -1520.017466 22.3333 BFGS: 1546 16:15:03 -1520.412662 21.7906 BFGS: 1547 16:15:04 -1520.801084 21.2606 BFGS: 1548 16:15:04 -1521.187080 20.6537 BFGS: 1549 16:15:05 -1521.564096 20.0925 BFGS: 1550 16:15:05 -1521.941064 19.4302 BFGS: 1551 16:15:05 -1522.307859 18.8331 BFGS: 1552 16:15:06 -1522.675367 18.1446 BFGS: 1553 16:15:06 -1523.034560 17.4813 BFGS: 1554 16:15:07 -1523.394118 16.7579 BFGS: 1555 16:15:07 -1523.749582 16.0441 BFGS: 1556 16:15:08 -1524.104766 15.2816 BFGS: 1557 16:15:08 -1524.458989 14.5239 BFGS: 1558 16:15:08 -1524.813900 13.7312 BFGS: 1559 16:15:09 -1525.170090 12.9451 BFGS: 1560 16:15:09 -1525.529799 12.1234 BFGS: 1561 16:15:10 -1525.893279 11.3064 BFGS: 1562 16:15:10 -1526.260869 10.4697 BFGS: 1563 16:15:10 -1526.635924 9.6457 BFGS: 1564 16:15:11 -1527.017895 8.8062 BFGS: 1565 16:15:11 -1527.409132 7.9827 BFGS: 1566 16:15:12 -1527.809636 7.2275 BFGS: 1567 16:15:12 -1528.228449 7.1359 BFGS: 1568 16:15:12 -1528.676495 7.0638 BFGS: 1569 16:15:13 -1529.165295 6.9996 BFGS: 1570 16:15:13 -1529.694650 6.9463 BFGS: 1571 16:15:13 -1530.248383 6.8988 BFGS: 1572 16:15:13 -1530.821891 6.8759 BFGS: 1573 16:15:14 -1531.405005 6.9000 BFGS: 1574 16:15:14 -1531.988695 6.9737 BFGS: 1575 16:15:15 -1532.565555 7.0718 BFGS: 1576 16:15:15 -1533.131112 7.2145 BFGS: 1577 16:15:15 -1533.680334 7.3790 BFGS: 1578 16:15:16 -1534.213822 7.5769 BFGS: 1579 16:15:16 -1534.735349 7.7739 BFGS: 1580 16:15:17 -1535.260577 7.9875 BFGS: 1581 16:15:17 -1535.807663 8.1713 BFGS: 1582 16:15:17 -1536.406195 8.3284 BFGS: 1583 16:15:18 -1537.070833 8.4418 BFGS: 1584 16:15:18 -1537.820231 8.5523 BFGS: 1585 16:15:19 -1538.648977 8.8860 BFGS: 1586 16:15:19 -1539.561723 9.4234 BFGS: 1587 16:15:19 -1540.542184 10.0504 BFGS: 1588 16:15:20 -1541.591981 10.5236 BFGS: 1589 16:15:20 -1542.703512 11.0530 BFGS: 1590 16:15:20 -1543.879118 11.4443 BFGS: 1591 16:15:21 -1545.123002 11.8133 BFGS: 1592 16:15:21 -1546.440305 11.9828 BFGS: 1593 16:15:22 -1547.890551 11.9498 BFGS: 1594 16:15:22 -1549.213316 11.4510 BFGS: 1595 16:15:22 -1550.162472 10.8204 BFGS: 1596 16:15:22 -1551.039270 10.1358 BFGS: 1597 16:15:23 -1551.860027 9.5083 BFGS: 1598 16:15:23 -1552.648886 8.9586 BFGS: 1599 16:15:23 -1553.383083 8.4621 BFGS: 1600 16:15:24 -1554.062708 8.0891 BFGS: 1601 16:15:24 -1554.677402 7.7569 BFGS: 1602 16:15:24 -1555.223188 7.5736 BFGS: 1603 16:15:25 -1555.704962 7.6023 BFGS: 1604 16:15:25 -1556.124295 7.7432 BFGS: 1605 16:15:25 -1556.490174 7.8750 BFGS: 1606 16:15:26 -1556.807152 8.0017 BFGS: 1607 16:15:26 -1557.090514 8.1257 BFGS: 1608 16:15:26 -1557.344557 8.2386 BFGS: 1609 16:15:27 -1557.582503 8.3588 BFGS: 1610 16:15:27 -1557.807756 8.4786 BFGS: 1611 16:15:27 -1558.030496 8.5998 BFGS: 1612 16:15:28 -1558.250989 8.7264 BFGS: 1613 16:15:28 -1558.474704 8.8532 BFGS: 1614 16:15:28 -1558.700762 8.9778 BFGS: 1615 16:15:28 -1558.932402 9.1086 BFGS: 1616 16:15:29 -1559.168242 9.2415 BFGS: 1617 16:15:29 -1559.409686 9.3745 BFGS: 1618 16:15:29 -1559.654382 9.5042 BFGS: 1619 16:15:30 -1559.904616 9.6304 BFGS: 1620 16:15:30 -1560.156134 9.7630 BFGS: 1621 16:15:30 -1560.411122 9.8942 BFGS: 1622 16:15:31 -1560.670090 10.0246 BFGS: 1623 16:15:31 -1560.934870 10.1522 BFGS: 1624 16:15:31 -1561.205979 10.2786 BFGS: 1625 16:15:32 -1561.489487 10.3951 BFGS: 1626 16:15:32 -1561.792057 10.5142 BFGS: 1627 16:15:32 -1562.130402 10.6206 BFGS: 1628 16:15:32 -1562.536013 10.6849 BFGS: 1629 16:15:33 -1563.038001 10.6312 BFGS: 1630 16:15:33 -1563.543074 11.3713 BFGS: 1631 16:15:34 -1563.838879 11.1326 BFGS: 1632 16:15:34 -1564.022175 9.9732 BFGS: 1633 16:15:34 -1564.168370 9.5749 BFGS: 1634 16:15:35 -1564.278527 9.5052 BFGS: 1635 16:15:35 -1564.420756 9.3865 BFGS: 1636 16:15:35 -1564.584166 9.2544 BFGS: 1637 16:15:36 -1564.696472 9.1989 BFGS: 1638 16:15:36 -1564.794791 9.1805 BFGS: 1639 16:15:36 -1564.889794 9.1768 BFGS: 1640 16:15:37 -1564.989459 9.1795 BFGS: 1641 16:15:37 -1565.101090 9.1587 BFGS: 1642 16:15:37 -1565.235133 9.1131 BFGS: 1643 16:15:37 -1565.404471 9.0257 BFGS: 1644 16:15:38 -1565.628801 8.8747 BFGS: 1645 16:15:38 -1565.946662 8.6074 BFGS: 1646 16:15:38 -1566.461371 8.0463 BFGS: 1647 16:15:39 -1567.108729 8.0872 BFGS: 1648 16:15:39 -1567.469467 8.0461 BFGS: 1649 16:15:40 -1567.766406 8.2252 BFGS: 1650 16:15:40 -1568.055034 8.2796 BFGS: 1651 16:15:40 -1568.348833 8.2157 BFGS: 1652 16:15:41 -1568.649005 8.0361 BFGS: 1653 16:15:41 -1568.958808 7.7901 BFGS: 1654 16:15:41 -1569.278152 7.4446 BFGS: 1655 16:15:42 -1569.609002 7.0347 BFGS: 1656 16:15:42 -1569.951438 6.5136 BFGS: 1657 16:15:42 -1570.307928 6.1455 BFGS: 1658 16:15:43 -1570.678916 6.0737 BFGS: 1659 16:15:43 -1571.069296 5.9881 BFGS: 1660 16:15:43 -1571.476180 5.8700 BFGS: 1661 16:15:44 -1571.743025 5.7831 BFGS: 1662 16:15:44 -1571.922880 5.8229 BFGS: 1663 16:15:44 -1572.043509 5.8799 BFGS: 1664 16:15:44 -1572.134053 5.9407 BFGS: 1665 16:15:45 -1572.201345 5.9706 BFGS: 1666 16:15:45 -1572.250511 5.9951 BFGS: 1667 16:15:45 -1572.282413 5.9816 BFGS: 1668 16:15:46 -1572.299356 5.9475 BFGS: 1669 16:15:46 -1572.306049 5.8909 BFGS: 1670 16:15:46 -1572.309251 5.8286 BFGS: 1671 16:15:46 -1572.310968 5.7759 BFGS: 1672 16:15:47 -1572.312327 5.7226 BFGS: 1673 16:15:47 -1572.313321 5.6961 BFGS: 1674 16:15:47 -1572.314525 5.6894 BFGS: 1675 16:15:48 -1572.315384 5.7153 BFGS: 1676 16:15:48 -1572.315889 5.7549 BFGS: 1677 16:15:48 -1572.316115 5.7829 BFGS: 1678 16:15:49 -1572.316226 5.8026 BFGS: 1679 16:15:49 -1572.316274 5.8128 BFGS: 1680 16:15:49 -1572.316297 5.8207 BFGS: 1681 16:15:50 -1572.316306 5.8231 BFGS: 1682 16:15:50 -1572.316313 5.8256 BFGS: 1683 16:15:50 -1572.316314 5.8254 BFGS: 1684 16:15:50 -1572.316314 5.8250 BFGS: 1685 16:15:51 -1572.316315 5.8248 BFGS: 1686 16:15:51 -1572.316316 5.8246 BFGS: 1687 16:15:51 -1572.316319 5.8248 BFGS: 1688 16:15:51 -1572.316326 5.8257 BFGS: 1689 16:15:52 -1572.316341 5.8277 BFGS: 1690 16:15:52 -1572.316373 5.8318 BFGS: 1691 16:15:52 -1572.316446 5.8390 BFGS: 1692 16:15:53 -1572.316615 5.8509 BFGS: 1693 16:15:53 -1572.317025 5.8701 BFGS: 1694 16:15:53 -1572.318048 5.9008 BFGS: 1695 16:15:53 -1572.320644 5.9488 BFGS: 1696 16:15:54 -1572.327306 6.0220 BFGS: 1697 16:15:54 -1572.344480 6.1283 BFGS: 1698 16:15:54 -1572.388601 6.2672 BFGS: 1699 16:15:55 -1572.500082 6.4024 BFGS: 1700 16:15:55 -1572.753056 6.3890 BFGS: 1701 16:15:55 -1573.082585 6.1381 BFGS: 1702 16:15:55 -1573.484560 5.6909 BFGS: 1703 16:15:56 -1573.932674 5.0725 BFGS: 1704 16:15:56 -1574.393695 4.3046 BFGS: 1705 16:15:56 -1574.829029 3.4094 BFGS: 1706 16:15:57 -1575.193004 2.3853 BFGS: 1707 16:15:57 -1575.455664 1.2452 BFGS: 1708 16:15:57 -1575.560358 0.3495 BFGS: 1709 16:15:57 -1575.563062 0.2027 BFGS: 1710 16:15:58 -1575.564289 0.0148 BFGS: 1711 16:15:58 -1575.564297 0.0066 BFGS: 1712 16:15:58 -1575.564299 0.0018 BFGS: 1713 16:15:58 -1575.564299 0.0005 BFGS: 1714 16:15:59 -1575.564300 0.0002 BFGS: 1715 16:15:59 -1575.564300 0.0001 BFGS: 1716 16:15:59 -1575.564300 0.0000 BFGS: 1717 16:16:00 -1575.564300 0.0000 BFGS: 1718 16:16:00 -1575.564300 0.0000 BFGS: 1719 16:16:00 -1575.564300 0.0000 BFGS: 1720 16:16:00 -1575.564300 0.0000 BFGS: 1721 16:16:01 -1575.564300 0.0000 BFGS: 1722 16:16:01 -1575.564300 0.0000 BFGS: 1723 16:16:01 -1575.564300 0.0000 Minimization converged after 1723 steps. Maximum force component: 1.6213617062008426e-08 eV/Angstrom Maximum stress component: 2.1841479082518565e-09 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', 'B', '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', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'H', 'N', 'N', 'N', 'N'] basis = [[0.00000000e+00 1.05115095e-02 2.50000000e-01] [0.00000000e+00 9.89488491e-01 7.50000000e-01] [5.00000000e-01 5.10511509e-01 2.50000000e-01] [5.00000000e-01 4.89488491e-01 7.50000000e-01] [0.00000000e+00 2.87023114e-01 4.42703830e-01] [6.27530517e-33 7.12976886e-01 9.42703830e-01] [2.04673853e-32 2.87023114e-01 5.72961696e-02] [0.00000000e+00 7.12976886e-01 5.57296170e-01] [5.00000000e-01 7.87023114e-01 4.42703830e-01] [5.00000000e-01 2.12976886e-01 9.42703830e-01] [5.00000000e-01 7.87023114e-01 5.72961696e-02] [5.00000000e-01 2.12976886e-01 5.57296170e-01] [4.06009313e-35 6.27136876e-02 5.07720073e-01] [0.00000000e+00 9.37286312e-01 7.72007270e-03] [1.79641258e-34 6.27136876e-02 9.92279927e-01] [1.75488889e-35 9.37286312e-01 4.92279927e-01] [5.00000000e-01 5.62713688e-01 5.07720073e-01] [5.00000000e-01 4.37286312e-01 7.72007270e-03] [5.00000000e-01 5.62713688e-01 9.92279927e-01] [5.00000000e-01 4.37286312e-01 4.92279927e-01] [3.98382186e-35 4.89191411e-01 5.63668916e-01] [8.77740042e-35 5.10808589e-01 6.36689160e-02] [5.55710937e-36 4.89191411e-01 9.36331084e-01] [6.06606405e-35 5.10808589e-01 4.36331084e-01] [5.00000000e-01 9.89191411e-01 5.63668916e-01] [5.00000000e-01 1.08085890e-02 6.36689160e-02] [5.00000000e-01 9.89191411e-01 9.36331084e-01] [5.00000000e-01 1.08085890e-02 4.36331084e-01] [7.23632851e-01 7.26958866e-01 2.50000000e-01] [2.76367149e-01 2.73041134e-01 7.50000000e-01] [2.76367149e-01 7.26958866e-01 2.50000000e-01] [7.23632851e-01 2.73041134e-01 7.50000000e-01] [2.23632851e-01 2.26958866e-01 2.50000000e-01] [7.76367149e-01 7.73041134e-01 7.50000000e-01] [7.76367149e-01 2.26958866e-01 2.50000000e-01] [2.23632851e-01 7.73041134e-01 7.50000000e-01] [7.22885779e-01 8.51691944e-01 2.50000000e-01] [2.77114221e-01 1.48308056e-01 7.50000000e-01] [2.77114221e-01 8.51691944e-01 2.50000000e-01] [7.22885779e-01 1.48308056e-01 7.50000000e-01] [2.22885779e-01 3.51691944e-01 2.50000000e-01] [7.77114221e-01 6.48308056e-01 7.50000000e-01] [7.77114221e-01 3.51691944e-01 2.50000000e-01] [2.22885779e-01 6.48308056e-01 7.50000000e-01] [6.13483228e-01 7.09740961e-01 6.82121752e-01] [3.86516772e-01 2.90259039e-01 1.82121752e-01] [3.86516772e-01 7.09740961e-01 8.17878248e-01] [6.13483228e-01 2.90259039e-01 3.17878248e-01] [1.13483228e-01 2.09740961e-01 6.82121752e-01] [8.86516772e-01 7.90259039e-01 1.82121752e-01] [8.86516772e-01 2.09740961e-01 8.17878248e-01] [1.13483228e-01 7.90259039e-01 3.17878248e-01] [3.86516772e-01 2.90259039e-01 3.17878248e-01] [6.13483228e-01 7.09740961e-01 8.17878248e-01] [6.13483228e-01 2.90259039e-01 1.82121752e-01] [3.86516772e-01 7.09740961e-01 6.82121752e-01] [8.86516772e-01 7.90259039e-01 3.17878248e-01] [1.13483228e-01 2.09740961e-01 8.17878248e-01] [1.13483228e-01 7.90259039e-01 1.82121752e-01] [8.86516772e-01 2.09740961e-01 6.82121752e-01] [0.00000000e+00 6.02377660e-01 2.50000000e-01] [0.00000000e+00 3.97622340e-01 7.50000000e-01] [5.00000000e-01 1.02377660e-01 2.50000000e-01] [5.00000000e-01 8.97622340e-01 7.50000000e-01]] cellpar = Cell([[2.765619824252501, 2.440846104902321e-35, 0.0], [-2.889132377085092e-35, 4.854666016127504, 0.0], [0.0, 0.0, 4.540802081687552]]) forces = [[-5.43815848e-44 9.13784477e-09 0.00000000e+00] [ 5.43815848e-44 -9.13784477e-09 1.43282450e-29] [-5.43815848e-44 9.13784477e-09 0.00000000e+00] [ 5.43815848e-44 -9.13784477e-09 2.86564899e-29] [ 6.08626243e-44 -1.02268666e-08 1.36373767e-08] [-6.08626243e-44 1.02268666e-08 1.36373767e-08] [ 6.08626243e-44 -1.02268666e-08 -1.36373767e-08] [-6.08626243e-44 1.02268666e-08 -1.36373767e-08] [ 6.08626243e-44 -1.02268666e-08 1.36373767e-08] [-6.08626243e-44 1.02268666e-08 1.36373767e-08] [-8.72675743e-30 -1.02268666e-08 -1.36373767e-08] [ 8.72675743e-30 1.02268666e-08 -1.36373767e-08] [ 6.07700395e-44 -1.02113094e-08 -1.13625478e-08] [-6.07700395e-44 1.02113094e-08 -1.13625478e-08] [ 6.07700395e-44 -1.02113094e-08 1.13625478e-08] [-6.07700395e-44 1.02113094e-08 1.13625478e-08] [ 6.07700395e-44 -1.02113094e-08 -1.13625478e-08] [-6.07700395e-44 1.02113094e-08 -1.13625478e-08] [ 6.07700395e-44 -1.02113094e-08 1.13625478e-08] [-6.07700395e-44 1.02113094e-08 1.13625478e-08] [-6.84803923e-44 1.15068952e-08 -1.19474121e-08] [ 6.84803923e-44 -1.15068952e-08 -1.19474121e-08] [-6.84803923e-44 1.15068952e-08 1.19474121e-08] [ 6.84803923e-44 -1.15068952e-08 1.19474121e-08] [-6.84803923e-44 1.15068952e-08 -1.19474121e-08] [ 6.84803923e-44 -1.15068952e-08 -1.19474121e-08] [-6.84803923e-44 1.15068952e-08 1.19474121e-08] [ 6.84803923e-44 -1.15068952e-08 1.19474121e-08] [-6.38662501e-09 2.55493036e-09 0.00000000e+00] [ 6.38662501e-09 -2.55493036e-09 0.00000000e+00] [ 6.38662501e-09 2.55493036e-09 0.00000000e+00] [-6.38662501e-09 -2.55493036e-09 0.00000000e+00] [-6.38662501e-09 2.55493036e-09 0.00000000e+00] [ 6.38662501e-09 -2.55493036e-09 0.00000000e+00] [ 6.38662501e-09 2.55493036e-09 0.00000000e+00] [-6.38662501e-09 -2.55493036e-09 0.00000000e+00] [ 8.95110577e-10 -4.36825156e-09 0.00000000e+00] [-8.95110577e-10 4.36825156e-09 0.00000000e+00] [-8.95110577e-10 -4.36825156e-09 0.00000000e+00] [ 8.95110577e-10 4.36825156e-09 0.00000000e+00] [ 8.95110577e-10 -4.36825156e-09 0.00000000e+00] [-8.95110577e-10 4.36825156e-09 0.00000000e+00] [-8.95110577e-10 -4.36825156e-09 0.00000000e+00] [ 8.95110577e-10 4.36825156e-09 0.00000000e+00] [-4.05591761e-09 -3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 -3.90292893e-09 6.94173535e-09] [-4.05591761e-09 3.90292893e-09 6.94173535e-09] [-4.05591761e-09 -3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 -3.90292893e-09 6.94173535e-09] [-4.05591761e-09 3.90292893e-09 6.94173535e-09] [ 4.05591761e-09 3.90292893e-09 6.94173535e-09] [-4.05591761e-09 -3.90292893e-09 6.94173535e-09] [-4.05591761e-09 3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 -3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 3.90292893e-09 6.94173535e-09] [-4.05591761e-09 -3.90292893e-09 6.94173535e-09] [-4.05591761e-09 3.90292893e-09 -6.94173535e-09] [ 4.05591761e-09 -3.90292893e-09 -6.94173535e-09] [ 9.64912640e-44 -1.62136171e-08 0.00000000e+00] [-9.64912640e-44 1.62136171e-08 0.00000000e+00] [ 9.64912640e-44 -1.62136171e-08 0.00000000e+00] [-9.64912640e-44 1.62136171e-08 0.00000000e+00]] stress = [ 1.56172973e-09 3.22785394e-10 -2.18414791e-09 0.00000000e+00 0.00000000e+00 -1.17511019e-31] energy per atom = -24.618192179792214 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0