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=-1.6332901614757978 stress="-4.402772329361962 0.053691379435521526 0.2913723959921453 0.053691379435521526 -2.6519038990909403 -0.25052028106277935 0.2913723959921453 -0.25052028106277935 -4.641978941129373" free_energy=-1.6332901614757978 pbc="T F T" Ni 0.03848316 0.19178619 0.17895518 13.89698194 -22.17656822 -11.54826682 Ni 1.79140871 1.61455359 0.03253581 -9.35744063 34.51766044 -3.98458836 Ni 1.64904689 0.10609294 1.46603997 -13.98005661 -29.97462074 4.20875573 Ni -0.19401975 1.32157598 1.51361598 9.44051530 17.63352852 11.32409944