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=-34.52220343590716 pbc="F T T" C -0.27827151 -0.10750486 0.29393529 6 16.51420391 -6.54180162 5.34929211 C 1.27603944 1.62004229 0.07986675 6 -15.23689287 3.70357856 5.24073130 C 1.41461321 0.07476255 1.29811316 6 -16.44760362 -4.07936809 -5.82229661 C 0.19830552 1.70725285 1.61562261 6 15.17029258 6.91759116 -4.76772680