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=126000.22810119881 pbc="F T F" Sm 0.27824833 0.06768852 0.03885685 62 -226795.36617965 -216984.73685817 -63997.78283418 Sm 1.19328427 1.32330667 0.01568736 62 195165.60329307 225199.60203307 -35853.81737945 Sm 1.23431043 -0.21723656 1.44472943 62 380184.78329688 386919.68511468 4770.33572551 Sm 0.29299048 1.64615817 1.63635088 62 -348555.02041030 -395134.55028959 95081.26448812