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=50.9136495106 pbc="F T T" K -0.21707836 -0.01739693 -0.13863341 19 -11.98243339 -1.39824788 0.82234862 K 1.55835534 1.24645637 -0.01723967 19 11.84845400 2.83177044 -1.70112877 K 1.42001865 0.44694300 1.20342959 19 10.49210694 -3.50198227 1.59416124 K 0.04387568 1.35292440 1.63700089 19 -10.35812755 2.06845971 -0.71538109