32 Lattice="6.837428071369069 0.0 0.0 0.0 6.837428071369069 0.0 0.0 0.0 6.837428071369069" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.21263639057851 stress="-9.156028473354322 19.572633763416814 -15.68068859168964 19.572633763416814 -27.02347900752515 -0.7661530221747607 -15.68068859168964 -0.7661530221747607 15.313731405750211" free_energy=-97.21263639057851 pbc="F F F" Ni 0.01314332 0.00888915 0.02282546 -341.08736736 -341.00760131 1.65031735 Ni 1.72172375 1.74050321 0.00198423 0.38825207 -0.34398146 -0.81215744 Ni 1.68909325 0.03237778 1.72608092 0.03042925 -0.70717781 -0.24927307 Ni 0.03097122 1.73603785 1.67229127 -1.03369612 -0.44203604 0.33123536 Ni 3.43063181 0.02312066 0.02334835 -0.34260065 0.17841493 0.10057075 Ni 5.12700339 1.74719605 0.02774525 -0.10505113 0.09160289 -0.11668943 Ni 5.13484747 0.03485168 1.69924850 -6377.42544367 0.67838367 6361.47646200 Ni 3.44118577 1.71237797 1.72190454 627.20734014 7.29101334 -631.03781753 Ni 0.03756428 3.37791209 0.01387761 -0.22278261 0.21691893 -0.17504617 Ni 1.64423272 5.14569977 0.00378979 0.54169238 -0.30539995 0.10846785 Ni 1.69980863 3.40512994 1.67899117 0.69702107 0.35803126 0.48697048 Ni 0.02611393 5.14407540 1.71245899 0.07847425 -0.34078205 0.30428264 Ni 3.43217858 3.42717656 0.01120302 341.26314085 341.45593669 -1.61701774 Ni 5.13620056 5.10757204 0.01072107 4211.20725078 -45.66863399 -4260.70162392 Ni 5.11898999 3.38877820 1.73067803 0.80668928 0.17450221 0.07620554 Ni 3.40610976 5.09635555 1.69878159 -0.14205036 0.59518742 0.18333372 Ni 0.00999935 0.03396523 3.45418957 0.06525155 0.21601854 -0.48742913 Ni 1.72626140 1.74758956 3.39570129 -0.00725300 -0.07074633 -0.06012347 Ni 1.71127195 0.03533821 5.11411478 6377.86205773 -1.12733550 -6361.31155020 Ni 0.02772529 1.67490657 5.15206786 -627.71701022 -6.40100723 630.65714744 Ni 3.38021169 0.01158688 3.35601632 0.17566078 -0.83980712 0.33419840 Ni 5.11623272 1.68279090 3.39651648 2108.37622070 -2157.43075032 -34.24839589 Ni 5.09954865 0.03162090 5.11782423 -0.49827727 0.41182123 -0.46622185 Ni 3.37969001 1.72159827 5.07072810 0.33073514 0.03420563 0.94393004 Ni 0.03746464 3.35715242 3.39274381 -0.83753716 0.43201322 0.20922633 Ni 1.73505607 5.14427399 3.45188645 -6319.05593782 2203.63560972 4295.29397006 Ni 1.69120066 3.39353705 5.14814978 0.33250956 0.12242949 0.44882462 Ni 0.01205774 5.07158098 5.15889130 0.36090202 -0.48697528 -0.51798632 Ni 3.46759179 3.42989573 3.43739736 -0.60130701 0.07367041 -0.17073640 Ni 5.15684900 5.11939576 3.41363202 -0.26370030 -0.19733169 -0.08928722 Ni 5.14584309 3.38887091 5.14779661 -0.21997698 -0.16428859 -0.29603000 Ni 3.45259148 5.13766530 5.15941410 -0.16363590 -0.43190492 -0.24775680