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=-23.591221717247954 stress="-0.0008582786491454882 -0.00021636086449260898 -0.0005298698592626661 -0.00021636086449260898 -0.0008291423164626791 -0.0002349333209849748 -0.0005298698592626661 -0.0002349333209849748 -0.0006261517983920115" pbc="F F F" Ni 35.22086729 34.98310996 34.77096654 -0.82633710 -0.31361366 -0.76935562 Ni 36.59933616 35.93572417 35.98055861 -6.77356702 -18.02811022 12.67733663 Ni 37.14715992 37.22516294 35.23402360 -1.18791819 6.66402802 -21.90171086 Ni 37.93229823 38.31172061 36.19084223 6.73542069 11.65924696 8.72656714 Ni 36.90181109 35.14771729 38.20399864 0.63978177 0.91631956 0.18901426 Ni 39.35802973 36.07349581 38.45018589 -0.41141352 -0.49274027 0.00690754 Ni 34.76884260 38.20444678 38.02575960 0.33278285 -0.09934295 -0.79861239 Ni 36.55604684 39.07636534 38.99475015 -17.03793088 48.17002954 -31.54149965 Ni 40.23975440 35.55577733 35.25284888 -0.94652146 0.64511921 -0.75771272 Ni 41.57116719 36.00454661 36.78983070 -3.53988608 2.14102556 -4.14976033 Ni 42.51432400 36.93324962 34.69615509 -0.82750911 0.13148975 1.58927802 Ni 43.42712388 38.91385061 36.22088890 2.63706053 -5.44275468 -4.64067941 Ni 42.73578848 35.79150318 38.24752218 -37.55813246 -18.63235726 -12.96425909 Ni 43.94092265 36.28827392 38.75986480 45.69227410 12.85251023 12.91255932 Ni 39.59592731 38.07886991 37.48008817 -9.07172681 -2.47046527 -13.51438207 Ni 40.62053955 38.32819731 38.74879789 11.78717926 2.93731371 14.66147598 Ni 34.82624793 39.49365118 35.42673195 -8.69956765 -9.71036275 -7.70342716 Ni 35.82447290 40.48365875 36.32972720 10.11411308 9.24564580 9.02871333 Ni 37.04272155 42.62085647 34.71585688 0.15219500 -0.69354238 1.44430111 Ni 38.61643991 43.32327578 36.40123177 -33.28755504 19.43466765 -22.32615767 Ni 37.95366604 39.88968876 37.71888199 -11.05751806 -6.31474740 -7.92691457 Ni 39.18297782 40.79320854 38.39174556 13.44083427 8.60080885 7.43655357 Ni 35.64061762 42.55244599 37.63905551 0.31427594 -2.51156893 -1.87877580 Ni 36.15510351 43.81252997 39.11824152 1.07149388 1.22805174 2.37863454 Ni 40.31463283 40.76250514 35.06533237 -3.24990284 -0.23514750 -2.42527443 Ni 41.60365422 41.12475624 36.46651109 -6.17611090 11.92194169 -5.09613468 Ni 41.78042048 43.31103882 34.75724372 -0.12295062 -1.21300647 1.91964301 Ni 43.52629705 43.46239944 36.79309461 -1.72704688 -1.47134059 0.06250709 Ni 42.58087455 40.09122498 37.35935114 3.38675551 -7.32407010 11.58825830 Ni 43.73510397 41.07781524 38.65337001 1.28493639 2.16163942 2.18970251 Ni 39.66448343 42.68403127 37.11226018 32.54607317 -20.15194638 20.67290835 Ni 40.97555741 43.06281160 38.89352680 -16.95007200 2.78263200 -9.57234253 Ni 35.08650936 34.99270265 39.79859771 -34.07126206 -29.59676307 -21.68008170 Ni 36.02951638 35.81350238 40.39348859 34.11725833 30.52636570 21.15121006 Ni 37.00297454 37.99791377 39.62151619 21.58888764 -51.86426756 29.43735956 Ni 38.75210362 38.51894432 41.27444638 -3.34944980 -5.57256473 1.67502207 Ni 37.49149260 35.21043487 41.96708928 1.61464694 0.64665452 0.35765513 Ni 39.08450338 35.75571598 43.99891515 -1.59499673 -1.32429048 0.03119260 Ni 35.42842396 38.28677606 42.84798177 -56.59693928 -45.33534933 -50.56061674 Ni 36.22422232 38.91950201 43.54655608 45.44364620 34.57278003 56.42452361 Ni 39.71309499 35.22221430 40.57758748 -2.08062119 -0.09765883 0.02043352 Ni 41.48837336 36.00831489 41.43404765 -13.53720884 26.89916732 -14.21752638 Ni 42.84911873 37.34925718 39.84520972 -8.57561492 -4.45504871 -5.20765259 Ni 43.23909324 38.49425818 41.03735392 4.23504861 5.94829657 7.69396063 Ni 42.20384740 34.85081933 42.03810700 16.38267491 -25.75036462 14.04342861 Ni 43.87383666 35.93328252 43.56460464 -1.19086158 0.15206836 -1.08346833 Ni 40.24150778 37.00409575 42.88390785 -0.01260729 1.89656876 -1.04773739 Ni 40.95198476 39.00576363 43.68573388 1.60880753 -0.67305078 -1.12440464 Ni 35.14758552 39.78870018 40.00686066 -4.87436722 2.68730433 3.74095389 Ni 35.80085817 42.04657078 40.80638853 2.95701759 -4.25915698 -5.63777153 Ni 37.82350393 42.21827495 39.80335328 -5.64408306 -8.91239450 -9.15004723 Ni 38.63834321 43.28337470 40.87827378 6.22077585 8.02975586 8.25419177 Ni 37.36102597 39.94186987 42.87644269 12.48518000 11.04073197 -7.57264484 Ni 39.69225143 40.63183112 43.95736664 -1.13345226 1.38895045 -0.89432007 Ni 35.04200871 42.98730845 42.19801729 -8.72153851 0.01240128 0.26855884 Ni 36.22062300 43.77377768 43.28993392 6.05313933 3.40752085 4.63923293 Ni 39.81899047 40.03247668 40.85421832 -9.68711928 -9.73275488 -4.82741828 Ni 40.89974943 41.22892384 41.12165250 27.85016258 -11.02678913 -26.42939195 Ni 42.34497277 42.80178516 39.71375535 17.85389216 -3.50827476 10.86434855 Ni 43.91609134 43.82709812 41.74953070 -1.65643963 -1.03279095 0.25038397 Ni 42.76961237 40.00036892 42.15602423 -2.16808414 4.10255502 2.87664824 Ni 43.46907250 41.19521481 43.88955235 -1.01689879 0.76810314 -0.50582390 Ni 40.39757659 42.11536967 42.13716159 -13.84620837 26.11867396 30.04268183 Ni 41.75211220 43.77016552 43.57819544 0.66310547 -1.44373169 -1.35024199