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:forces:R:3 energy=-7.5841331873993 stress="-5.297879192537241 0.34571579070192004 -0.039790374673276396 0.34571579070192004 -4.112386346612931 0.4630365134692225 -0.039790374673276396 0.4630365134692225 -3.9766640581982537" pbc="F F F" C 0.26959405 0.17626233 -0.14597521 -1.35671355 -1.13970446 -1.69645408 C 1.70996341 1.49207130 0.15300231 1.88664323 1.62158036 -1.18645376 C 1.53848316 -0.04225341 1.41852158 1.52806038 -1.79147778 1.67489779 C -0.04210664 1.38825682 1.27041603 -2.05799007 1.30960189 1.20801004