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=-5.840579906513405 stress="-8.038478220455179 0.6498255490819611 1.358377252220719 0.6498255490819611 -12.793436659685145 -8.485425821889388 1.358377252220719 -8.485425821889388 -12.666344203960808" pbc="F F F" Ni 0.07034430 0.04852473 0.05473499 -1.33609471 -9.05467375 -9.02938533 Ni 1.41561068 1.63661615 -0.00908358 2.99634665 1.68274613 -1.00413591 Ni 1.37719504 -0.16761815 1.61041876 2.17696129 -0.42237786 1.88372353 Ni -0.23264389 1.33533445 1.24148635 -3.83721323 7.79430548 8.14979771