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=-6.956581068555846 stress="-3.9890806886761503 0.37403802169942657 -0.05463548854766964 0.37403802169942657 -5.77991844563767 0.9992534951563457 -0.05463548854766964 0.9992534951563457 -5.663531662827307" pbc="F F F" Ni -0.12633864 -0.03902326 -0.21780693 -0.89908241 -1.18288332 -1.99765575 Ni 1.71813893 1.26716069 0.19410236 1.17218115 2.35800374 -1.92690463 Ni 1.33096497 -0.11798803 1.43300593 1.10808642 -3.04410096 2.61445077 Ni -0.27997518 1.27696427 1.41661558 -1.38118516 1.86898054 1.31010961