864 Lattice="15.337146440498554 0.0 0.0 15.337146440498554 18.78409144478237 0.0 0.0 0.0 70.83924500818044" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3006.992078892103 stress="0.002159835986205229 -1.8178880838734298e-07 -4.28406766415349e-07 -1.8178880838734298e-07 0.0017344660409287851 2.626987979415243e-06 -4.28406766415349e-07 2.626987979415243e-06 3.5392557596081847e-07" free_energy=-3006.992078892103 pbc="T T F" Cu 0.00129716 0.00962254 17.82195585 -0.00000115 0.00000841 0.00000138 Cu 3.83558361 2.08856194 18.48345957 -0.00000113 0.00000835 0.00000093 Cu 2.55748821 0.00962281 17.82195571 -0.00000118 0.00000834 0.00000124 Cu 6.39177474 2.08856130 18.48345997 -0.00000132 0.00000854 0.00000084 Cu 17.89463430 16.70732498 19.17745303 -0.00000134 0.00000836 0.00000141 Cu 6.39177389 0.01046023 19.96911868 -0.00000153 0.00000823 0.00000092 Cu 20.45082550 16.70732455 19.17745337 -0.00000129 0.00000869 0.00000134 Cu 8.94796492 0.01045977 19.96911901 -0.00000084 0.00000835 0.00000096 Cu 20.45082480 14.61753682 20.66253669 -0.00000118 0.00000822 0.00000151 Cu 24.28511026 16.69790683 21.38828100 -0.00000121 0.00000837 0.00000099 Cu 23.00701589 14.61753623 20.66253716 -0.00000152 0.00000845 0.00000129 Cu 26.84130133 16.69790693 21.38828092 -0.00000131 0.00000821 0.00000087 Cu 23.00701432 12.52332317 22.15600823 -0.00000178 0.00000805 0.00000139 Cu 26.84129952 14.61247785 22.87494672 -0.00000134 0.00000749 0.00000085 Cu 10.22605893 12.52332298 22.15600838 -0.00000097 0.00000807 0.00000134 Cu 14.06034415 14.61247837 22.87494628 -0.00000124 0.00000761 0.00000120 Cu 10.22605644 10.43583465 23.61108984 -0.00000118 0.00000780 0.00000121 Cu 14.06034153 12.52372075 24.36124264 -0.00000122 0.00000677 0.00000113 Cu 12.78224754 10.43583501 23.61108954 -0.00000145 0.00000769 0.00000141 Cu 16.61653259 12.52372118 24.36124235 -0.00000129 0.00000655 0.00000091 Cu 12.78224419 8.35014005 25.09043982 -0.00000128 0.00000685 0.00000102 Cu 16.61652908 10.43634754 25.82848425 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30.25773923 -0.00000071 0.00000343 0.00000043 Cu 7.66984421 0.00126335 30.99637141 -0.00000041 0.00000335 0.00000043 Cu 11.50412824 2.08842512 31.73354541 -0.00000021 0.00000276 0.00000011 Cu 10.22603531 0.00126324 30.99637151 -0.00000060 0.00000308 0.00000027 Cu 14.06031935 2.08842556 31.73354512 -0.00000065 0.00000247 0.00000002 Cu 25.56317646 16.69823176 32.47161324 -0.00000017 0.00000209 -0.00000000 Cu 14.06031393 0.00133756 33.20981728 -0.00000038 0.00000134 0.00000000 Cu 28.11936756 16.69823206 32.47161300 -0.00000044 0.00000210 0.00000048 Cu 1.27935854 0.00133786 33.20981707 -0.00000003 0.00000125 0.00000006 Cu 12.78221575 14.61120521 33.94745897 -0.00000045 0.00000134 0.00000054 Cu 16.61649945 16.69832581 34.68534854 0.00000038 -0.00000014 -0.00000009 Cu 15.33840678 14.61120564 33.94745870 0.00000021 0.00000084 0.00000032 Cu 19.17269057 16.69832568 34.68534861 -0.00000037 0.00000009 0.00000012 Cu 15.33840141 12.52414726 35.42344490 0.00000044 -0.00000055 -0.00000011 Cu 19.17268516 14.61126723 36.16133476 -0.00000010 -0.00000062 -0.00000006 Cu 17.89459253 12.52414734 35.42344481 -0.00000038 -0.00000043 0.00000031 Cu 21.72887619 14.61126686 36.16133506 0.00000046 -0.00000075 -0.00000059 Cu 17.89458720 10.43704382 36.89897643 -0.00000033 -0.00000112 0.00000029 Cu 21.72887097 12.52424007 37.63718113 0.00000058 -0.00000253 -0.00000045 Cu 20.45077820 10.43704355 36.89897664 0.00000069 -0.00000125 0.00000007 Cu 24.28506208 12.52423980 37.63718128 0.00000004 -0.00000205 -0.00000006 Cu 20.45077288 8.34995558 38.37524901 0.00000072 -0.00000270 -0.00000041 Cu 8.94791051 10.43711685 39.11242320 0.00000039 -0.00000255 -0.00000037 Cu 7.66981755 8.34995523 38.37524926 0.00000002 -0.00000261 -0.00000041 Cu 11.50410158 10.43711700 39.11242314 0.00000051 -0.00000282 -0.00000086 Cu 7.66981224 6.26299008 39.85105550 0.00000029 -0.00000342 -0.00000039 Cu 11.50409655 8.34997196 40.58929320 0.00000060 -0.00000449 -0.00000053 Cu 10.22600328 6.26299003 39.85105553 0.00000091 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Cu 7.66979517 4.17602395 45.74755079 0.00000149 -0.00000683 -0.00000119 Cu 11.50408045 6.26390950 46.49770406 0.00000144 -0.00000705 -0.00000099 Cu 10.22598627 4.17602395 45.74755081 0.00000100 -0.00000695 -0.00000128 Cu 14.06027154 6.26390984 46.49770380 0.00000108 -0.00000734 -0.00000106 Cu 10.22598345 2.08726627 47.23384732 0.00000108 -0.00000770 -0.00000084 Cu 14.06026880 4.17642149 47.95278510 0.00000139 -0.00000796 -0.00000093 Cu 12.78217450 2.08726655 47.23384710 0.00000156 -0.00000786 -0.00000077 Cu 16.61645989 4.17642164 47.95278494 0.00000134 -0.00000788 -0.00000052 Cu 12.78217257 0.00183736 48.72051338 0.00000152 -0.00000778 -0.00000124 Cu 16.61645811 2.08220852 49.44625621 0.00000135 -0.00000833 -0.00000111 Cu 0.00121723 0.00183763 48.72051312 0.00000114 -0.00000781 -0.00000106 Cu 3.83550272 2.08220838 49.44625636 0.00000143 -0.00000857 -0.00000139 Cu 15.33836260 16.68928477 50.13967554 0.00000094 -0.00000857 -0.00000063 Cu 3.83550200 -0.00757927 50.93134009 0.00000146 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