64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=103.86572942087682 stress="-0.0007879892172504614 -3.8075684209551114e-06 -0.0005255873640614468 -3.8075684209551114e-06 -0.0008882528354115714 0.00015669695099791204 -0.0005255873640614468 0.00015669695099791204 -0.0008908379625916275" free_energy=103.86572942087682 pbc="F F F" Cu 35.22086729 34.98310996 34.77096654 -3.26622203 -2.18269939 -2.77420482 Cu 36.59933616 35.93572417 35.98055861 -8.00700214 -12.31193455 8.50329388 Cu 37.14715992 37.22516294 35.23402360 -1.02431444 6.90720320 -22.61025981 Cu 37.93229823 38.31172061 36.19084223 3.69816619 13.09483864 5.41058595 Cu 37.29465675 34.93158033 37.44481085 0.98249024 -4.97166366 5.19725963 Cu 38.85840215 35.76443239 38.74197382 1.56063887 2.10968767 1.33524434 Cu 35.01305245 38.37091231 38.11880303 -6.84755676 -3.63934553 -5.40087324 Cu 36.55604684 39.07636534 38.99475015 -10.43122363 43.81650193 -20.51232765 Cu 40.37367246 35.41590283 35.08987003 -2.19666031 -0.12316885 -0.88116963 Cu 41.81595901 36.02721648 36.76701063 -14.09040407 10.77400952 -10.19315183 Cu 42.56413860 37.03899175 34.86420263 -1.53856095 -1.45313099 -3.36282624 Cu 43.67982227 38.56376137 35.86736005 2.14109050 1.95228169 1.73675608 Cu 42.81964364 35.29825864 37.79414119 12.07134605 -11.98075028 13.05397443 Cu 43.94092265 36.80036726 38.96963967 19.07029889 -1.29185411 -17.22724140 Cu 39.40261487 37.96164842 37.39358535 -12.30608007 -2.35514567 -16.50096039 Cu 40.43030572 37.98189139 38.53171715 19.61940846 0.64805796 21.51004094 Cu 35.19056740 39.70676063 35.45558802 -6.14410117 -6.13158974 -3.48013292 Cu 36.49928622 40.79692580 36.24085714 5.42362167 5.32605368 4.13273914 Cu 37.72869154 42.49751932 35.09651729 -5.82925347 -5.89945346 -10.12777332 Cu 38.61643991 43.32327578 36.40123177 -23.22962670 23.69337350 -9.71028250 Cu 37.95366604 39.88968876 37.71888199 -9.42781979 -5.57056843 -6.72071892 Cu 39.18297782 40.79320854 38.39174556 14.16747177 8.97159054 5.95210747 Cu 35.34278350 42.83814538 37.63905551 -1.65676432 -8.75827813 -14.22980722 Cu 35.60366252 43.66349090 39.11824152 2.99347774 7.43493900 14.81327451 Cu 40.26176311 40.27927672 34.77599447 -1.65932411 -0.77806194 -0.17123862 Cu 41.60365422 41.12475624 36.46651109 -9.58659510 11.54257850 -7.52066239 Cu 41.67119966 43.29253646 34.78221554 -1.98050004 -0.52579470 -0.51603265 Cu 43.57559210 43.55058575 36.17451505 0.79233793 -0.46456122 1.61102343 Cu 42.58087455 40.09122498 37.35935114 7.67073819 -11.70680699 9.86840583 Cu 43.97462727 41.11272182 38.87984742 1.08853282 0.11306619 1.25025307 Cu 39.66448343 42.68403127 37.11226018 28.83831085 -17.87876422 18.32167366 Cu 40.97555741 43.31914392 38.89352680 -14.37271973 5.29971434 -7.39566070 Cu 34.77045360 35.28866239 39.68786656 -0.88393623 -0.18094877 -2.27117917 Cu 36.11803101 36.09305905 41.30199494 -35.03451272 60.92000536 -54.40331685 Cu 37.00297454 37.99791377 39.62151619 18.79791585 -44.20017063 24.45097796 Cu 38.55150311 38.51894432 41.34725891 -4.53228830 -5.42657546 3.50969170 Cu 36.59945583 35.33216459 42.01011072 38.60909588 -59.00787582 55.39103438 Cu 39.08450338 35.75571598 43.58475277 -8.35256014 -19.52857631 12.21734506 Cu 34.99655912 37.96978731 42.51668654 -6.52950468 -4.58520576 -6.01177454 Cu 36.22422232 38.91950201 43.54655608 -5.56319216 -6.47984387 12.47537610 Cu 39.87147529 35.00206044 40.83625574 -5.74803062 -2.95876870 -1.59310358 Cu 41.48837336 36.00831489 41.43404765 -12.32124682 28.02330057 -9.97257541 Cu 42.84911873 37.01595790 40.07449325 -20.32462134 -1.14078956 11.58880161 Cu 43.60556472 38.49425818 41.03735392 2.37600399 7.20705126 4.60171011 Cu 42.20384740 34.85081933 42.03810700 15.78901504 -25.33135932 13.06576323 Cu 43.75567948 35.58042468 44.03850275 -0.15207477 0.43031403 -0.12900280 Cu 39.60939942 37.00409575 42.77385137 7.91396788 19.01909709 -12.37522536 Cu 40.88981588 38.99050463 43.64455433 0.09293918 -0.88152044 -0.71896678 Cu 35.03346674 39.71662307 40.34902654 -4.92515021 -1.84190653 0.89316902 Cu 36.12753280 41.21395641 41.27609686 2.67637086 2.77303560 0.91935305 Cu 37.82350393 42.21827495 39.80335328 -7.22813691 -10.14371533 -10.50711196 Cu 38.63834321 43.28337470 40.87827378 7.01936735 9.74922836 9.53391925 Cu 37.36102597 39.94186987 42.87644269 13.58361822 11.81353244 -6.87525751 Cu 39.67171808 41.11056424 43.96640764 -1.51792336 -0.47007462 1.87194383 Cu 34.85019353 42.97085593 42.41342367 -5.23376187 -1.09428306 -3.89228982 Cu 36.40009545 43.42893138 43.60183795 5.62733918 0.83122375 3.26891327 Cu 39.60146438 39.74812168 40.36805486 2.43698012 2.10873816 -4.22167222 Cu 40.89974943 41.22892384 41.12165250 14.48667156 -20.96542297 -26.53932525 Cu 42.34497277 42.80178516 39.71375535 14.19521028 -5.51120327 8.76050210 Cu 43.52483290 44.05828627 41.79540240 -0.43913986 -0.66897276 0.19907567 Cu 42.53145179 40.69547502 42.81686792 -2.59144159 -3.18300532 -4.23387898 Cu 43.70438034 41.68532165 44.08892020 3.32713534 3.54319625 3.81720829 Cu 40.39757659 42.11536967 42.13716159 -12.20441006 24.04091778 24.02208400 Cu 41.35575003 43.97629211 43.72804991 0.12709957 -0.51974668 -0.20349651