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=-0.903067980453 stress="-7.043799827109033 0.03960290850609789 -0.673614927276798 0.03960290850609789 -6.355756777064955 0.3286942325639785 -0.673614927276798 0.3286942325639785 -4.953777264484225" pbc="F F F" O -0.14459490 0.11115480 0.11044915 -15.85751820 -13.53456451 -12.17804923 O 1.70960170 1.31143450 -0.16166483 12.78526946 9.83516720 -6.99651489 O 1.28829595 -0.16490224 1.64041416 11.82094604 -12.04023172 12.18821744 O -0.22187219 1.51878885 1.32834452 -8.74869730 15.73962903 6.98634668