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=-8.750900703877905 stress="-5.137307840258675 -0.02437810438800625 -0.946520058309402 -0.02437810438800625 -7.169556381636065 -2.061952946254461 -0.946520058309402 -2.061952946254461 -6.933786568581189" pbc="F F F" Ni -0.14459490 0.11115480 0.11044915 -2.04691849 -3.48614488 -3.96773993 Ni 1.70960170 1.31143450 0.04092907 1.56574552 1.33083507 -1.09249275 Ni 1.28829595 -0.16490224 1.64041416 1.50399913 -1.50757735 2.22707482 Ni -0.22187219 1.51878885 1.32834452 -1.02282615 3.66288716 2.83315787