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=2.69392590745 stress="-14.806736984519972 2.8596569334226998 -6.6745108256038925 2.8596569334226998 -9.399951693094195 -2.5115140620991916 -6.6745108256038925 -2.5115140620991916 -17.265724854041522" pbc="F F F" Ni 0.19178619 0.17895518 0.29140871 -27.39606248 -14.96860769 -45.19642567 Ni 1.61455359 1.53253581 0.14904689 6.07449357 7.33530945 -5.30981550 Ni 1.28091226 0.10609294 1.46603997 35.10028263 -11.91273945 34.28287481 Ni -0.19401975 1.32157598 1.51361598 -13.77871372 19.54603770 16.22336636