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=75.85271028236869 stress="-0.0012186308697557848 2.21720607164e-05 -5.070282547070466e-06 2.21720607164e-05 -0.001398531352378616 0.00013496939162338417 -5.070282547070466e-06 0.00013496939162338417 -0.0012687177022494783" pbc="F F F" Ni 35.18546883 34.58901709 35.76564031 1.19994740 1.17932127 1.12601031 Ni 37.18500013 36.94257741 36.31541277 -16.73306607 4.89751235 83.67463041 Ni 37.45988454 36.86516073 34.94390734 16.99761674 -4.94621793 -82.13631709 Ni 38.48807910 39.24569653 36.20381834 57.54679734 -79.00806949 -78.55779043 Ni 37.57292896 34.88304420 37.43125866 -1.84431612 -1.58858297 -2.15971665 Ni 38.35690137 36.30483852 38.77521663 4.90865098 -0.32766705 -2.52188074 Ni 34.99727231 37.12000583 37.86106051 1.20197881 -1.27737121 0.16043977 Ni 36.58129035 38.30415239 39.18399638 -16.04652125 25.85985530 -23.55108260 Ni 39.86560323 35.55696623 35.16575175 -27.11444144 -7.53328044 -31.70600539 Ni 40.84590944 35.86250509 36.35039395 26.98135733 8.87921212 32.34383415 Ni 42.52059945 37.43801611 34.78397808 -1.06934871 -0.55452314 1.07908218 Ni 43.50993377 38.90793550 36.27085953 -0.86488923 0.64937649 1.06202065 Ni 43.04044599 35.07232000 36.85682744 -0.18052292 1.28931923 0.31486055 Ni 44.07498987 36.25724697 39.11219565 -1.18687304 0.35529600 -0.32433090 Ni 39.94299699 37.87220419 37.36472521 -0.44478268 -0.70629789 -0.37930782 Ni 41.00334388 38.63827491 39.23602587 1.48932924 -1.29844160 0.45793106 Ni 35.16503548 40.44579169 35.08432776 -0.13535115 -0.54471724 0.01938817 Ni 36.57181618 41.77847307 36.09508615 -11.81972016 -12.02888173 13.52534581 Ni 37.61457661 42.65605603 35.06773381 14.95011002 11.63948697 -13.70091220 Ni 39.44908187 43.78216877 36.24614510 -1.43435813 4.87575480 -2.32069390 Ni 37.88894163 40.06698366 37.00996911 -57.48619754 79.05763707 78.56947345 Ni 38.95774368 41.02841774 39.18037883 -164.24939648 146.58663787 -91.93315126 Ni 35.14058525 42.66286191 37.39525280 -1.51779910 0.09382805 0.45245742 Ni 35.70445527 43.61459443 39.30725519 0.66749431 -0.59013477 1.66266061 Ni 40.41125254 39.96756647 34.69294446 -8.02792639 -19.00136073 -13.27565402 Ni 40.96160554 41.25428532 35.65947224 24.29084037 4.23207995 -5.94895047 Ni 41.77306212 43.08007524 34.76104733 -0.39903789 1.23418229 0.01596273 Ni 43.12830642 43.08607768 36.63223917 -1.14882933 -1.25596876 0.89758385 Ni 42.36911921 40.45543301 38.08161268 -28.34305826 -5.88749155 -2.67390691 Ni 43.99199169 40.81162467 38.21969531 26.64386192 6.06405641 2.01297141 Ni 40.05141911 41.98089467 36.84697487 -14.59675590 7.12051943 23.73839816 Ni 40.59061537 43.91729600 38.31768066 0.39419009 -1.35591812 0.08929098 Ni 34.90467713 34.98816220 39.36925903 1.40696443 1.49544254 -0.61535452 Ni 36.67749086 36.29544742 40.77719125 -65.05526962 -102.09475836 65.36892534 Ni 37.27006853 37.23825435 40.16805889 65.98442070 71.99520037 -40.73765415 Ni 38.72660604 38.29543831 40.52533910 8.65144606 9.32890727 0.45171950 Ni 37.13486619 35.21948219 42.68161940 -0.14284257 -0.39562000 0.33225232 Ni 38.35250585 37.11127759 42.88374928 -2.49762861 0.72274708 0.35904200 Ni 35.11234375 37.59105219 42.61569772 -1.93123077 -3.18469502 -3.82300805 Ni 36.36874452 38.77277998 43.63362531 4.39589212 3.27157848 1.40582976 Ni 39.72213011 34.93294052 40.47874667 -3.73547638 -1.20217672 -1.79440443 Ni 41.08673160 36.18125417 41.36419230 6.52777760 -10.15921542 -0.25840799 Ni 42.50769666 37.49920392 40.60569444 -37.18832671 -66.09921573 -21.22178920 Ni 43.20463160 38.67668353 40.95431910 40.16473308 67.89743140 19.52275535 Ni 42.81415526 34.62715892 43.30697937 -7.12525953 -7.53901797 -1.56190065 Ni 44.00276445 36.03972573 43.48818230 6.34479041 8.22942445 0.48430656 Ni 40.16612467 37.69402109 41.91406791 -1.09310878 9.02608084 3.30824987 Ni 40.36457965 39.25205456 43.45347529 -2.73965323 -0.39634064 2.75938429 Ni 35.01745485 39.72309055 40.62546287 -15.59849407 -13.33927674 3.04199653 Ni 36.37328912 40.79556655 40.43518631 8.86057015 13.32960034 -13.56516055 Ni 37.60213638 42.61739589 40.53529403 0.98352680 1.29291061 0.49078438 Ni 39.63553396 43.68721277 41.58386761 -6.66057324 35.03835854 -40.38360066 Ni 37.33859636 40.56492504 42.00117672 4.91083377 -2.28063093 8.42335680 Ni 38.62115715 40.78607057 43.68200856 1.38563497 0.25489474 1.49786573 Ni 34.97531277 42.35592732 42.12991470 0.96383814 -1.60037767 -2.03743657 Ni 35.56579212 43.72374247 43.70747146 0.62633488 0.42561574 0.46799362 Ni 39.72645972 40.34274857 39.61062386 163.10082180 -144.23558706 92.39948858 Ni 40.86434150 41.81776752 41.31684551 -19.00361890 -5.15229111 11.99658958 Ni 42.17526597 41.92495439 40.28942991 22.87837941 1.68422628 -17.97149193 Ni 43.50517531 43.70492366 41.79089059 -1.65042596 -1.49889977 0.45953347 Ni 41.85200379 40.07732352 42.27371351 3.14999472 0.96668081 -1.55219299 Ni 43.56332221 41.24912338 43.76377536 -1.41015229 0.54222749 -1.37323904 Ni 39.81002328 42.70639568 42.73602429 -7.90663886 -35.82457676 40.79007116 Ni 41.39430228 43.39510397 43.44924008 10.77375770 3.39220190 3.32285461