64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=36424.5087944472 stress="-160788.42295418307 -48960.3463673254 -104755.90641737985 -48960.3463673254 -147891.98598963325 1611.164734865306 -104755.90641737985 1611.164734865306 -144234.5759598296" pbc="F F F" Ni -0.08340716 -0.12988006 0.67328234 -709.46318013 -521.16248293 -254.32925172 Ni 1.25914167 0.85733809 1.15736404 -5298.14837510 324.00315802 -5911.10060719 Ni 2.77421492 2.40712153 0.05985189 -2.99576544 -5.24212426 -2.63158175 Ni 4.13527333 3.51462279 1.54437208 -106.54629645 240.16437911 -189.11534367 Ni 2.28442347 0.89154903 2.21026798 5992.95982777 199.24789258 6156.97944149 Ni 3.96010395 1.41188368 3.54621112 -11909.37052016 -5734.89959998 8578.69155220 Ni -0.10471713 2.57870474 2.64372283 0.54298554 -7.31725234 -4.69893481 Ni 1.14774309 4.31221320 3.55719560 -322.78951101 -439.80098369 398.75033771 Ni 4.83072937 0.71007950 0.02275829 -5.06889838 1.65436632 0.51299738 Ni 6.09763622 1.63471561 1.77665099 736.82680185 -227.26481574 -560.91709538 Ni 8.32995539 2.10484882 -0.05225854 -5.04653562 -5.93155630 -0.80816681 Ni 8.99501237 3.79072971 1.41352604 37.55964496 -16.80194139 -36.31129255 Ni 7.37204452 0.15837513 2.21967498 -79.69295457 -243.55227573 -208.65946604 Ni 8.25890270 1.07901422 3.58370495 596.37309956 -562.59792862 -595.69007366 Ni 4.73961980 2.17311036 2.68724150 9639.54526285 10180.84031943 -10768.34089587 Ni 5.99255668 3.25188508 3.85455932 35.53544926 61.36067168 45.40336890 Ni -0.23836859 4.46089614 0.34081224 3.39341077 -0.20914293 4.13716965 Ni 1.51744288 6.49861672 1.65036474 -3830.26670382 7998.15707360 -6758.76016469 Ni 3.21130125 7.32353861 -0.02137160 -0.25275953 -14.52535076 -7.55985362 Ni 3.36241461 8.91961357 1.55363660 37.40949808 23.05462933 -21.96667269 Ni 2.01228974 5.46336079 2.52314611 4124.74863037 -7574.52970666 6331.00657455 Ni 3.81476818 5.91246156 3.53777280 -33424.58700144 42137.38745445 -40949.19738954 Ni -0.29107904 8.08851107 2.88141430 -15.51579484 -4.54824155 -1.10350423 Ni 1.92749349 8.29372102 2.96112883 -11.92366598 -7.10204339 44.86387794 Ni 4.83312349 5.18811006 0.14087196 1.44650439 9.12235138 -3.03425414 Ni 6.84386997 6.11305872 1.27477370 -170.59570520 -252.65048994 134.65086927 Ni 7.80461243 7.51844573 0.51465424 -5386.76535224 -5168.98071632 -4201.65970361 Ni 8.73567871 8.42644578 1.19586177 5556.30858097 5418.41517517 4068.61760432 Ni 7.69778703 4.56030056 2.85275626 -434.23909502 -752.04571657 -436.16711597 Ni 8.38769978 5.90330401 3.68831245 392.70327504 774.40163047 479.54036926 Ni 5.37409572 7.05289687 2.88032165 50.18632335 31.57839942 -36.52401713 Ni 6.55648047 8.57644504 3.94326571 -31.79957183 39.93752889 -33.07275985 Ni -0.10272401 -0.33194559 4.33546067 2.79260647 3.14772070 -0.14732506 Ni 1.09319402 1.09335626 7.09271091 -319.17473315 -1539.57492734 41.18856677 Ni 2.12747403 2.17732045 5.29965275 0.68134985 -1.69423566 -10.91962648 Ni 3.24780996 3.39347067 6.94017448 -167.37037348 128.24234955 -69.04260501 Ni 2.11187551 0.03106931 6.96417532 5557.54653908 -5795.86133299 -707.49426006 Ni 2.90816518 1.70292913 8.42548904 -23.47680267 -10.59415622 25.97673066 Ni 0.24320796 2.28138707 7.19963236 -5240.01595144 7334.97440407 658.26380412 Ni 1.57684491 4.56408205 8.45463634 -159.64789993 -93.48331596 36.52959817 Ni 4.38261063 0.19096109 4.34798321 1373.91080616 -4458.62105503 2776.93837118 Ni 5.85598100 0.66947348 5.50242356 148.74166017 52.76016792 117.68634498 Ni 7.61790555 2.11606339 4.77286475 -426.44538722 713.59311658 841.99838217 Ni 9.15659237 3.20564587 6.91168067 2.28208730 -6.36322815 -0.90856064 Ni 7.65301383 0.22169720 7.16306449 -0.17638027 3.93373646 -1.23299489 Ni 8.68578281 1.60145400 9.04741394 -1.89988027 2.04841404 -3.59313912 Ni 4.76108469 2.35115607 7.50158469 188.89256190 -116.49175602 38.00986527 Ni 6.22343873 3.53469561 8.74752072 -13.34501987 -13.77936758 40.15354414 Ni -0.28128422 4.84548435 5.35506348 -0.71079180 -0.29318691 4.12737974 Ni 1.25774086 6.32976672 6.56284496 16.38056698 -44.54078203 -5.50281930 Ni 2.48010966 7.48100903 5.22418085 -5533.13299057 -6504.65291705 -3828.14679384 Ni 3.34605773 8.49712622 5.81691164 5556.97146912 6515.49117952 3804.83667110 Ni 3.21636774 5.51015601 8.03622231 -28449.94601598 -26324.76947769 -20135.98532473 Ni 4.06476249 6.29359055 8.63215802 16274.21314754 6593.03754301 32794.89301562 Ni -0.09004329 7.31715217 7.85063817 -47.61235595 6.56793905 24.13922589 Ni 1.48430563 8.75348078 8.41019492 19.39951985 12.15500712 3.07219018 Ni 4.43548712 5.12857285 4.29981851 33395.31872726 -42174.34866378 40999.42962555 Ni 6.02502621 6.25720195 6.18009734 -4.00875982 4.54716082 -5.44619654 Ni 7.90795651 7.77336107 5.28976970 -82686.94586215 -47640.67006042 -78188.05818047 Ni 8.71284388 8.23656523 6.05091349 82727.60208848 47607.84366915 78233.74307311 Ni 7.26209176 4.52841887 7.18693598 18.90207437 22.68960823 -32.04493645 Ni 8.72167974 6.61881912 8.06402117 -3.63065538 -0.80957432 -4.29816711 Ni 4.69104744 7.30032328 7.98684802 12334.25974619 19827.83072408 -12707.90673608 Ni 6.18275956 9.05613444 9.06566033 -0.82669878 -2.47736390 -1.76474062