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:Z:I:1:forces:R:3 energy=-9.219658291651438 pbc="T F T" Ni -0.01726309 -0.13934333 0.17089611 28 -1.78789597 0.76584031 1.12985866 H 1.41979814 1.20220318 -0.28244114 1 0.04683158 -0.99572950 0.21733122 Ni 1.35541431 -0.10082852 1.76235339 28 1.67604625 0.77013743 -1.28520264 H 0.14432769 1.71005355 1.70254585 1 0.06501814 -0.54024825 -0.06198724