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=3706.7960712537933 pbc="F T F" No 0.16329753 0.29721237 -0.08430956 102 -15949.34442045 -13583.50990618 -1936.12678079 No 1.31316610 1.29541962 0.02090304 102 14279.38625054 17393.76670503 -3515.17094952 No 1.71409249 0.25093665 1.26125099 102 1953.23639834 -3973.79164844 5045.78659917 No -0.13751452 1.62693401 1.57326908 102 -283.27822842 163.53484959 405.51113114