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=40.19993343033957 stress="-0.0014307231545474626 -0.0002733301425337398 -0.0006567574804584575 -0.0002733301425337398 -0.001619645804646691 -0.00024476413521342354 -0.0006567574804584575 -0.00024476413521342354 -0.0011337123281091451" pbc="F F F" Ni 35.22086729 34.98310996 34.77096654 -2.05937113 -1.29329721 -1.89642012 Ni 36.59933616 35.93572417 35.98055861 -10.56145496 -28.77506472 19.94416078 Ni 37.14715992 37.22516294 35.23402360 -1.29799581 10.99037731 -34.95915454 Ni 37.93229823 38.31172061 36.19084223 13.41807292 18.34620009 15.71316093 Ni 36.90181109 35.14771729 38.20399864 0.42609113 0.61286064 0.42110100 Ni 39.35802973 36.07349581 38.45018589 -0.79027464 -24.58193178 8.80139793 Ni 34.76884260 38.20444678 38.02575960 0.15223330 -0.30227090 -0.23605044 Ni 36.55604684 39.07636534 38.99475015 -27.21837803 76.11485991 -49.81982963 Ni 40.23975440 35.55577733 35.25284888 -1.84127692 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35.30302897 42.85953330 37.63905551 -6.93665944 -4.07081082 -11.24206132 Ni 36.24427906 43.37779151 39.11824152 4.80735212 7.64742574 8.57762090 Ni 40.63153922 40.45221119 35.16239131 -10.23645861 -6.78548037 -13.31274241 Ni 41.60365422 41.12475624 36.46651109 -4.34893766 24.32370317 0.34441190 Ni 41.65903605 43.33357737 34.74691298 0.76804016 -1.28742080 2.02396422 Ni 43.62645804 43.01529842 36.36792425 -2.15979063 -0.95805197 -0.38294911 Ni 42.58087455 40.09122498 37.35935114 5.31183114 -10.68812495 18.02136729 Ni 43.73510397 41.07781524 38.65337001 2.94464128 2.99205586 3.32723204 Ni 39.66448343 42.68403127 37.11226018 53.91291439 -33.31632251 35.14760097 Ni 40.97555741 43.06281160 38.89352680 -29.27430634 5.00455906 -16.50333440 Ni 35.08650936 34.99270265 39.79859771 -56.30685464 -49.02066882 -35.62117765 Ni 36.02951638 35.81350238 40.39348859 56.29045991 50.02838897 34.85715340 Ni 37.00297454 37.99791377 39.62151619 33.58230904 -81.24041707 46.46448801 Ni 38.75210362 38.51894432 41.27444638 -5.56227900 -8.14523343 2.27434753 Ni 37.49149260 35.21043487 41.96708928 1.22668414 0.21920028 0.48328671 Ni 39.08450338 35.75571598 43.99891515 -2.76795258 -2.83226524 1.84597856 Ni 35.42842396 38.28677606 42.84798177 -87.88152834 -70.07519707 -77.98420379 Ni 36.22422232 38.91950201 43.54655608 71.37609236 54.78857714 87.26629230 Ni 39.71309499 35.22221430 40.57758748 -2.38639821 -0.84644456 0.10845141 Ni 41.48837336 36.00831489 41.43404765 -22.91415661 44.20586469 -23.50762916 Ni 42.84911873 37.34925718 39.84520972 -30.99589542 8.75163698 10.69442139 Ni 43.60556472 38.49425818 41.03735392 7.63415911 5.31149871 6.70889842 Ni 42.20384740 34.85081933 42.03810700 26.37955910 -43.82294238 22.17834672 Ni 43.28116307 36.06295912 43.56460464 -0.32199762 0.62909504 -0.18201738 Ni 40.24150778 37.00409575 42.88390785 0.88874533 2.80640795 -1.88450314 Ni 40.95198476 39.00576363 43.68573388 2.72487160 -1.57318226 -0.82062134 Ni 35.14758552 39.78870018 40.00686066 -7.17836712 3.44124575 5.43190533 Ni 35.80085817 42.04657078 40.80638853 4.25429988 -8.25358219 -7.64728205 Ni 37.82350393 42.21827495 39.80335328 -6.16675945 -16.97299811 -13.67864540 Ni 38.63834321 43.28337470 40.87827378 10.78087652 13.77257129 14.04096672 Ni 37.36102597 39.94186987 42.87644269 17.41960032 15.47755497 -10.52906586 Ni 39.69225143 40.63183112 43.95736664 -2.27585810 2.77649494 -0.33662606 Ni 35.04200871 42.98730845 42.19801729 -16.46553575 -0.68064937 -0.45768996 Ni 36.22062300 43.77377768 43.28993392 11.27203631 7.19746806 9.94434063 Ni 39.81899047 40.03247668 40.85421832 -14.36285335 -13.87459541 -7.16910438 Ni 40.89974943 41.22892384 41.12165250 42.71643532 -18.45113679 -41.97531626 Ni 42.34497277 42.80178516 39.71375535 29.86525602 -5.60630477 18.77378556 Ni 43.91609134 43.82709812 41.74953070 -1.87199616 -0.81048440 0.20476787 Ni 42.76961237 40.00036892 42.15602423 -2.83189420 3.25733566 1.94702454 Ni 43.46907250 41.19521481 43.88955235 -0.41692599 0.84554497 0.11089804 Ni 40.39757659 42.11536967 42.13716159 -22.11684561 41.10793120 47.00186316 Ni 41.75211220 43.77016552 43.57819544 0.64486089 -1.33710992 -1.64163635