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=-7.702604915873945 pbc="F F T" Ni 0.00693356 0.16501753 0.22580078 28 1.52430077 1.31985174 0.55730183 Ni 1.42866320 1.68883157 -0.00044125 28 -1.63603840 -1.15501706 -0.32373695 H 1.54313966 -0.05167817 1.75980354 1 -1.65787497 1.48716391 0.39600474 H -0.03332758 1.77143892 1.40295338 1 1.76961259 -1.65199859 -0.62956963