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=-77.8591206785515 stress="-0.000720142392666176 -0.00019861729589089027 -0.0002869392490538443 -0.00019861729589089027 -0.0008951157567396569 0.00013533689935189166 -0.0002869392490538443 0.00013533689935189166 -0.0007226194033786616" pbc="F F F" Pt 35.22086729 34.98310996 34.77096654 -2.08547207 -1.21977147 -1.55424942 Pt 36.59933616 35.93572417 35.98055861 -10.97415227 -12.91756685 4.36858499 Pt 37.14715992 37.22516294 35.23402360 -7.02092674 -0.73652143 -25.81924288 Pt 37.93229823 38.31172061 35.96390753 11.31223592 23.53487682 7.37656061 Pt 37.29465675 35.15851503 37.44481085 2.94005992 -5.61320334 9.21992821 Pt 38.85840215 35.98056936 38.89217898 -0.14603102 0.28026150 1.99653973 Pt 35.14633790 38.18034815 37.73408865 -3.11007079 -2.55078616 -4.00459440 Pt 36.55604684 39.07636534 38.99475015 -17.18521006 44.14025759 -20.49045514 Pt 40.57145570 35.62693260 34.97272797 -9.88061066 -9.08560613 -11.69730306 Pt 41.39037000 36.49879227 36.11441795 3.02116155 6.28119376 19.87466559 Pt 42.56413860 37.23803765 34.86420263 0.37786792 -1.14642364 -11.24321630 Pt 43.65105045 38.33152248 35.86736005 4.89960336 5.23863896 5.95639836 Pt 42.81964364 35.29825864 38.27050804 -23.33924644 -19.11498171 -5.33023321 Pt 43.94092265 36.25441176 38.50208346 24.31076969 18.31366046 0.53751014 Pt 39.16411852 37.43584541 37.27535242 5.23657869 -1.40790515 2.22480454 Pt 40.92663375 38.88988228 38.51999491 0.97445043 -2.33033912 0.25208898 Pt 35.10340100 40.31298788 35.02164361 -1.63793181 -1.82824393 -0.94447838 Pt 36.63900191 41.14262195 36.22490470 -3.63508846 -13.84077658 17.52417163 Pt 36.99690030 42.19675187 35.09651729 4.62992103 14.50417408 -17.08281781 Pt 38.61643991 43.32327578 36.40123177 -27.38821388 17.96606146 -18.33735774 Pt 37.95366604 39.88968876 37.71888199 -9.24893670 -7.11648670 -9.85928946 Pt 39.18297782 40.79320854 38.39174556 14.57506721 10.44876211 5.16742930 Pt 35.34278350 42.83814538 37.63905551 -1.45179573 -7.50221328 -11.82752093 Pt 35.60366252 43.66349090 39.11824152 2.77728827 6.08981885 12.78056240 Pt 40.26176311 40.27927672 34.77599447 -1.00722668 -0.55028161 0.69630349 Pt 41.60365422 41.12475624 36.46651109 -8.89832158 11.54790227 -8.57766454 Pt 41.67119966 43.29253646 34.78221554 -0.88368313 -1.18403287 1.49901440 Pt 43.57559210 43.55058575 36.17451505 -1.54756757 -1.44622914 0.88858397 Pt 42.58087455 40.09122498 37.35935114 10.33428185 -10.69624166 8.13498238 Pt 43.97462727 41.11272182 38.87984742 -0.31235843 0.14427895 1.24697925 Pt 39.66448343 42.68403127 37.11226018 27.59031039 -15.93954446 16.10825662 Pt 40.97555741 43.31914392 38.89352680 -12.83487522 5.50479481 -6.83476142 Pt 34.77045360 35.28866239 39.68786656 -3.02761607 -2.97138789 -2.43291828 Pt 36.11803101 36.55239207 40.36469048 -1.92923391 -3.58615661 4.58988040 Pt 37.00297454 37.99791377 39.62151619 24.26167573 -36.15547874 21.51661534 Pt 38.91377719 38.51894432 41.34725891 -7.34864045 -4.97609410 4.28427997 Pt 36.72084025 35.30962604 42.02044147 1.23494476 -0.37205935 1.56261675 Pt 39.08450338 35.75571598 43.13833550 -8.22558508 -13.43954770 8.59376961 Pt 34.99655912 37.97047106 42.51668654 -4.98612649 -4.95004813 -5.87560580 Pt 36.22422232 38.91950201 43.54655608 -5.54637099 -6.37896392 11.31599147 Pt 39.95759388 34.98785805 40.51844656 -3.10436158 -3.76631001 -0.89382561 Pt 41.48837336 36.00831489 41.43404765 -10.03254865 24.04826636 -9.60237742 Pt 42.84911873 37.00221518 40.11836827 -3.61625980 -1.08503319 -2.31233192 Pt 43.60556472 38.49425818 41.03735392 1.69032100 6.72914712 3.83679489 Pt 42.20384740 34.85081933 42.03810700 14.75314756 -25.23631133 11.66888560 Pt 43.15722496 35.78614406 43.84807215 -0.53842098 1.62107169 0.16123132 Pt 39.82025233 37.00409575 42.32467804 7.51401085 12.04897996 -3.59854346 Pt 41.14102933 38.65792188 44.04517290 -0.17209359 0.48665520 -2.00349033 Pt 34.83286624 39.38982713 40.34912361 -2.16049159 1.23572613 2.39434626 Pt 36.31885329 41.93055363 41.19322972 3.08094960 -4.59060074 0.29093471 Pt 37.82350393 42.21827495 39.80335328 -4.83126888 -8.45436430 -13.07686183 Pt 38.63834321 43.28337470 40.87827378 6.98841512 10.81695961 9.76651585 Pt 37.36102597 39.94186987 42.87644269 11.74501000 11.27253441 -7.77584817 Pt 39.42120846 41.01441309 43.95223827 0.20786503 -0.70926243 0.24655629 Pt 34.72006559 42.56086790 41.95624253 -5.93750150 2.50703633 2.85242581 Pt 36.86909974 43.89192837 42.93209409 0.50156315 -1.50537132 -1.12017566 Pt 39.64663765 39.85817815 40.37961080 0.74743978 3.01416242 -5.45438879 Pt 40.89974943 41.22892384 41.12165250 13.24325992 -18.12713349 -27.91862509 Pt 42.34497277 42.80178516 39.71375535 14.76945601 -4.95872618 8.56274258 Pt 43.84947997 43.91585207 41.75724536 -1.75577421 -1.92851888 0.18372307 Pt 42.43376557 40.85345170 42.38498733 4.47282009 -3.34508501 1.72204930 Pt 43.66153064 41.54291660 43.96495890 0.43620315 1.49485649 0.87102636 Pt 40.39757659 42.11536967 42.13716159 -13.11513309 24.92759312 26.56727467 Pt 40.86157597 44.04079721 43.69789396 0.28846813 -1.43406190 -1.17284778