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=-3.230384522470913 stress="-0.9599586600817944 0.04374342559160947 0.0008819524402644839 0.04374342559160947 -1.1111603051262802 -0.04849861221877047 0.0008819524402644839 -0.04849861221877047 -1.3420675286950474" free_energy=-3.230384522470913 pbc="T F T"
Ni       0.15300231       0.03848316      -0.04225341      -8.52652441      -9.00527708       4.93624816
Ni       1.41852158       1.45789336      -0.11174318       8.76220679      10.45266045       6.15317719
Ni       1.27041603       0.19178619       1.67895518       9.31057749     -12.26194347      -7.06601473
Ni       0.29140871       1.61455359       1.53253581      -9.54625988      10.81456009      -4.02341062