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=-202.46743644242966 stress="-0.00027879848202084264 -4.9216942548007834e-05 -0.00023094883767938172 -4.9216942548007834e-05 -0.00024361711820753584 -4.459871102535906e-05 -0.00023094883767938172 -4.459871102535906e-05 -0.00024096499608703691" free_energy=-202.46743644242966 pbc="F F F" Ni 35.22086729 34.98310996 34.77096654 -1.33761752 -0.94819382 -1.08636355 Ni 36.59933616 35.93572417 35.98055861 -3.45409235 -4.76135717 2.81645679 Ni 37.14715992 37.22516294 35.23402360 -0.93990297 2.08926337 -9.93629982 Ni 37.93229823 38.31172061 36.19084223 4.19060871 6.81309969 5.22558012 Ni 37.29465675 34.93158033 37.44481085 0.53576412 -2.21749811 3.41555603 Ni 38.85840215 35.76443239 38.74197382 -2.27711934 2.86729828 -4.94115123 Ni 35.01305245 38.37091231 38.11880303 -3.83660869 -1.72321599 -3.38712600 Ni 36.55604684 39.07636534 38.99475015 1.17532055 14.82206278 -8.82697302 Ni 40.37367246 35.41590283 35.08987003 0.07122329 0.36137618 0.13841764 Ni 41.81595901 36.02721648 36.76701063 -4.44480961 4.52665431 -4.99690455 Ni 42.56413860 37.42957765 34.86420263 -4.21947096 -3.73785723 -2.65738760 Ni 43.67982227 38.56376137 35.86736005 2.92883309 4.05736096 3.73069994 Ni 42.81964364 35.29825864 37.98568119 -4.85406404 -8.46209058 -1.51167544 Ni 43.94092265 35.91364046 38.80687150 10.60415009 3.16036541 5.23464153 Ni 39.63485376 37.67682157 37.44339995 -1.71970519 -1.76032616 -2.03913604 Ni 40.92663375 38.45262663 38.77269330 2.19132390 1.63350495 2.07022035 Ni 34.75331176 39.95945902 35.10549878 -2.25483359 -1.85077738 -1.61089289 Ni 36.14575737 40.88078096 36.24085714 3.36155956 1.51629733 2.78173576 Ni 37.73158789 42.20690651 34.97929580 -1.38527258 -2.03823631 -1.40226886 Ni 38.61643991 43.32327578 36.40123177 -9.85751136 8.16839723 -5.20323098 Ni 37.95366604 39.88968876 37.71888199 -5.58132658 -3.62483172 -3.89078634 Ni 39.18297782 40.79320854 38.39174556 6.30343420 4.95778876 3.33571048 Ni 35.30609528 42.83814538 37.63905551 -2.03800090 -4.10134662 -6.69059829 Ni 35.90975672 43.66349090 39.11824152 3.31347140 2.53185803 7.58129808 Ni 40.33637782 39.80684409 35.14031394 -0.18419538 -0.86219806 0.85177105 Ni 41.60365422 41.12475624 36.46651109 -5.60263421 5.86921595 -4.40633562 Ni 41.88430911 43.32139253 35.45702886 -0.39413602 -0.40912487 1.03520934 Ni 43.88885915 43.95496023 36.62908149 -0.36021684 -0.46917098 -0.00565469 Ni 42.58087455 40.09122498 37.35935114 1.92123913 -8.29120355 2.53531652 Ni 43.96174114 41.09133389 38.30677838 2.17204413 2.88342537 1.90977478 Ni 39.66448343 42.68403127 37.11226018 11.92436098 -7.88133891 7.88508940 Ni 40.97555741 43.31914392 38.89352680 -8.73317755 2.13269239 -4.43440566 Ni 35.01722653 35.44536394 39.53882749 -5.50704529 -2.77392424 -5.65515253 Ni 36.22627882 36.09305905 40.53656773 6.07322356 5.31242476 3.44372061 Ni 37.00297454 37.99791377 39.62151619 9.09124952 -16.36614140 9.21060361 Ni 38.55150311 38.51894432 41.34725891 -3.62295569 -3.92132811 3.51577681 Ni 37.07742728 34.94599511 42.05741619 1.50441601 -0.73018676 1.20971750 Ni 39.08450338 35.75571598 43.58475277 -4.01397013 -5.07088888 2.20754051 Ni 34.99655912 37.96978731 42.51668654 -3.27415791 -2.75974846 -4.32865474 Ni 36.22422232 38.91950201 43.54655608 -1.86886734 -2.14503303 6.44260476 Ni 39.60467594 35.32260987 40.41040162 1.88949564 -1.21399926 6.18431116 Ni 41.48837336 36.00831489 41.43404765 -5.29906546 10.76633086 -6.34103539 Ni 42.84911873 37.25854751 39.76672743 -4.76760209 -1.20069683 -1.11485085 Ni 43.60556472 38.49425818 41.03735392 1.25640486 3.21296649 3.37436585 Ni 42.20384740 34.85081933 42.03810700 5.83521466 -9.60991825 5.31678340 Ni 43.25051234 35.92562707 43.81542093 -0.40961935 0.11437261 -0.32376119 Ni 40.09980901 37.00409575 42.77385137 3.63432385 5.59975227 -3.24574209 Ni 41.32560697 38.72766811 43.82601648 0.40864046 0.11481782 -0.48578578 Ni 35.16738858 39.50373621 40.18030802 -4.45275240 3.04811592 5.32893629 Ni 36.03602752 41.54200529 41.32126750 10.14664506 -8.74295297 -5.45833702 Ni 37.82350393 42.21827495 39.80335328 -4.24921790 -5.87334916 -5.74782002 Ni 38.63834321 43.28337470 40.87827378 4.18509598 4.49118974 5.61155467 Ni 37.36102597 39.94186987 42.87644269 2.96773723 2.90426788 -6.18571414 Ni 38.76188179 41.15584957 43.42846539 2.65044074 2.67427487 0.39862767 Ni 34.96909146 42.45741379 41.87629674 -8.31679849 7.91558551 4.43197134 Ni 36.64358137 43.55281325 43.36211719 0.17235045 -0.74184774 -0.81581070 Ni 39.50493887 39.74812168 40.36805486 2.06782625 3.72950122 -3.57921340 Ni 40.89974943 41.22892384 41.12165250 3.13137272 -6.59889040 -11.77542722 Ni 42.34497277 42.80178516 39.71375535 7.55343370 -4.08960303 5.24708551 Ni 43.71204231 43.94694387 41.19493634 -0.33116103 -0.10772808 0.03097214 Ni 42.46928292 40.68021602 42.28045907 1.09368022 -2.14059070 -1.04634678 Ni 43.54371834 40.92142903 44.01684309 0.80145243 0.40955896 2.24165437 Ni 40.39757659 42.11536967 42.13716159 -5.71034691 9.37288878 9.12908965 Ni 41.69791591 43.66281393 43.96495110 0.14191918 -0.83111390 -0.74195124