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=-0.9896909580196216 stress="0.048300451750085786 0.004552320280801512 -0.0025270296838887088 0.004552320280801512 0.09059672130371967 0.02055447932141517 -0.0025270296838887088 0.02055447932141517 0.08359767732489404" pbc="F T T" user14 0.06606600 0.29656461 -0.01027048 0.53456994 0.42128685 0.19315444 user14 1.62209446 1.34898177 -0.29771924 -0.52424801 -0.33315412 -0.28177124 user14 1.28390438 0.00811800 1.67522077 -0.38854849 0.31157222 0.40559855 user14 0.02593631 1.48336809 1.15866537 0.37822656 -0.39970495 -0.31698176