4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3.3444653165447686 stress="-16.417358422142446 1.2047549947562435 0.5522217728322669 1.2047549947562435 -16.823079581253864 5.746325880564658 0.5522217728322669 5.746325880564658 -17.087422200358905" pbc="F F F" Ni 0.11775054 -0.03975236 -0.27997518 -3.05873132 -5.46048050 -2.73279661 Ni 1.27696427 1.41661558 -0.03487808 3.13647635 11.43753332 -9.60175305 Ni 1.72586561 0.29391194 1.22614529 7.49280652 -8.82279111 6.90462970 Ni 0.02103145 1.05299506 1.38516536 -7.57055156 2.84573829 5.42991995