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=-0.492585533638 stress="0.6738689048268758 0.19672874025882436 0.15676998786487745 0.19672874025882436 0.37058421166909394 -0.016855543815776163 0.15676998786487745 -0.016855543815776163 0.6889131138674983" pbc="F F F" N 0.29391194 -0.27385471 0.02103145 2.17513275 1.22574505 1.62384746 N 1.06746321 1.66955635 0.07469950 -1.14902709 -1.30969851 1.41883473 N 1.73573857 0.02724172 1.27538150 -1.96226974 -0.08382902 -1.82047646 N -0.16601189 1.44882550 1.68515289 0.93616408 0.16778248 -1.22220574