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=-6.763253828236973 stress="-21.311042421515367 0.8381128750172486 -3.7999552214797916 0.8381128750172486 -21.706657651057093 0.8742376449808944 -3.7999552214797916 0.8742376449808944 -22.165389186811865" pbc="F F F" Ni -0.14801295 -0.02432459 0.06329927 -9.37316761 -6.25067219 -9.46844882 Ni 1.43745442 1.27846858 -0.00548572 5.00968149 8.18117856 -6.37581386 Ni 1.34126820 -0.15859300 1.31668137 9.19666310 -9.62292587 9.02849469 Ni -0.08013605 1.24396547 1.59073906 -4.83317697 7.69241950 6.81576799