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=-129.56330216276882 stress="-1.2833372439177982e-05 -5.007514078532573e-05 -0.00012898217412503208 -5.007514078532573e-05 -5.889496316257606e-05 -1.3420858766457199e-05 -0.00012898217412503208 -1.3420858766457199e-05 -5.417202182402155e-05" pbc="F F F" Ni 35.22086729 34.98310996 34.77096654 -0.67968630 -0.54169656 -0.73958916 Ni 36.59933616 35.93572417 35.98055861 -2.58128655 -2.16091722 2.30084714 Ni 37.14715992 37.22516294 35.23402360 0.47769303 2.84187291 -4.08318220 Ni 37.93229823 38.78131475 35.96390753 0.78610767 2.93931445 -0.19281126 Ni 37.29465675 34.93158033 37.36806237 0.22081624 -1.82330978 2.78154707 Ni 38.85840215 35.76443239 38.75277156 -0.43032975 2.94888103 -2.71858820 Ni 34.64671032 37.47843907 38.02587658 1.73017965 0.10578267 0.52054033 Ni 36.55604684 39.07636534 38.99475015 -2.55957201 7.53722427 -5.16412430 Ni 40.81566554 35.79339813 35.06577139 -3.28990679 -1.63079118 -5.02663695 Ni 41.59993901 36.23678549 36.42935289 1.75974065 2.53788838 6.47283956 Ni 42.56413860 37.42957765 34.86420263 -1.77395579 -1.48235474 -2.59442461 Ni 43.67982227 38.56376137 35.86736005 1.79688325 2.29654510 2.26958053 Ni 42.81964364 35.29825864 37.98568119 -0.79283944 -0.86305394 -0.30703634 Ni 43.94092265 36.42635864 39.33157354 5.39503229 -2.51216887 -1.58294821 Ni 39.63485376 37.89284156 37.44339995 -2.59036595 -1.18028519 -2.27296078 Ni 40.92663375 38.45262663 38.77269330 3.14913087 0.57585829 2.03733186 Ni 34.75331176 39.95945902 35.10549878 -1.27683204 -1.40687431 -1.58986136 Ni 36.14575737 40.67121195 36.24085714 1.49333829 0.08185971 3.67818943 Ni 37.49745377 41.84509243 35.19060985 0.93858586 -0.43993198 -0.74926684 Ni 38.61643991 43.32327578 36.40123177 -6.58054557 3.71913374 -3.34823622 Ni 37.95366604 39.88968876 37.71888199 -2.24900013 -1.12568489 -1.82716589 Ni 39.18297782 40.79320854 38.39174556 4.46780080 2.77305360 1.64315501 Ni 35.27732346 42.83814538 37.63905551 -0.43483580 -3.15792253 -4.01368077 Ni 35.90975672 43.66349090 39.11824152 2.26772869 2.26412887 3.96249875 Ni 40.15395354 40.58799898 34.70305829 -0.80884530 0.72218382 1.15644215 Ni 41.60365422 41.12475624 36.46651109 -3.02435437 4.35186394 -1.82152995 Ni 42.13700750 42.92148869 34.86252385 -1.11888892 -0.74705254 0.26368379 Ni 43.80466679 43.46171569 36.36724050 -0.52605886 -1.04810910 1.22109409 Ni 42.58087455 40.09122498 37.35935114 1.61920725 -4.13625936 2.14451835 Ni 43.72499518 41.09133389 38.89541432 0.00930137 0.68871847 1.15784405 Ni 39.66448343 42.68403127 37.11226018 7.20637712 -4.99685254 3.70625605 Ni 40.97555741 43.31914392 38.89352680 -5.13378222 0.83494682 -2.34294912 Ni 35.40968184 34.95946043 39.53882749 0.91661286 0.59514252 -1.15183221 Ni 36.18959060 36.09305905 41.33590647 -2.54431507 5.26844749 -4.11212101 Ni 37.00297454 37.99791377 39.62151619 3.15972133 -9.34149101 4.71439780 Ni 38.55150311 38.51894432 41.34725891 -1.07554263 -2.23042785 1.84610501 Ni 37.07742728 35.23173151 42.36669775 4.04632144 -2.98483566 3.60676305 Ni 39.08450338 35.75571598 43.56880033 -1.98064931 -2.85584006 0.81019528 Ni 34.99655912 37.96978731 42.51668654 -1.57784591 -2.11482743 -3.12673064 Ni 36.22422232 38.91950201 43.54655608 -1.08047979 -2.02738579 4.23987815 Ni 39.29319308 34.96245024 40.41040162 0.64934906 -0.59702895 4.76102113 Ni 41.48837336 36.00831489 41.43404765 -3.70321165 6.42591301 -4.05746195 Ni 42.84911873 37.25854751 40.08801189 -7.71388244 0.05014762 -0.08472237 Ni 43.60556472 38.49425818 41.03735392 1.43228013 3.78291769 2.94724399 Ni 42.20384740 34.85081933 42.03810700 4.00518693 -5.30462486 3.81409335 Ni 43.64763455 36.23880535 44.00814638 -1.52869235 -0.06584354 -1.72462531 Ni 40.09980901 37.00409575 42.77385137 0.78405835 1.75606085 -2.78200456 Ni 40.97711705 38.73073442 43.49853435 1.11608878 2.65865980 -0.84078230 Ni 34.83286624 39.66500628 39.91106582 -1.84167311 -1.29324294 0.72096296 Ni 35.57770690 41.68650106 40.39612664 0.46087012 1.06097493 1.00892265 Ni 37.82350393 42.21827495 39.80335328 -1.72060309 -3.77794545 -4.17380260 Ni 38.63834321 43.28337470 40.87827378 2.34145072 2.56470732 3.45935754 Ni 37.36102597 39.94186987 42.87644269 3.36244687 3.82888732 -3.48541817 Ni 39.23985324 41.11480866 43.46376795 -0.47590951 -1.21951106 0.57353395 Ni 34.71822599 42.61094463 42.70789215 0.42209322 -0.38820359 -0.61920738 Ni 36.63983132 43.81679079 43.37563583 0.56835784 -0.51927522 -0.68784165 Ni 39.83946121 39.74812168 40.36805486 -0.96006017 -0.53375956 -0.70212427 Ni 40.89974943 41.22892384 41.12165250 4.08473808 -3.39263036 -5.76267853 Ni 42.34497277 42.80178516 39.71375535 4.71401645 -2.06265474 3.39676873 Ni 43.96837464 43.91658749 41.39964654 -1.35470704 -1.27433866 0.42342678 Ni 42.76524265 40.56948487 42.36897370 -2.67438712 -2.92214994 -5.52563604 Ni 43.34530356 41.37060237 43.73306859 0.79951278 3.84197717 4.04383054 Ni 40.39757659 42.11536967 42.13716159 -0.65065750 6.83144260 4.77013013 Ni 41.62358612 44.06242240 43.78359587 0.55267447 -1.72525294 -1.24101807