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=-1.5082879008619425 stress="0.12653163992771244 -0.000944492654338431 0.012718875716290087 -0.000944492654338431 0.1286181930837909 -0.009139067971955859 0.012718875716290087 -0.009139067971955859 0.08732265375689365" pbc="T T F" F 0.20367778 -0.22208453 0.06124725 -0.05834154 -0.28881180 0.78575159 F 1.77602598 1.48025543 0.08203475 0.19721094 0.21008741 0.83004990 F 1.61890393 0.03794463 1.31729724 0.28936741 -0.27633510 -0.76112321 F -0.16439897 1.72477608 1.72147139 -0.42823682 0.35505949 -0.85467828