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=62.963623221498636 stress="-386.29893282432243 90.46273820971552 -40.90882615067778 90.46273820971552 -421.5321036252247 -77.92383250924706 -40.90882615067778 -77.92383250924706 -406.1893409814302" pbc="F F F" Po 0.01793413 -0.02692968 -0.00123967 -126.41090118 -114.65937322 -159.08888834 Po 1.53827656 1.73368178 -0.24994958 91.71339901 52.04607054 -84.04617024 Po 1.54415513 -0.15959244 1.61605702 178.52281778 -134.05621602 93.01775087 Po 0.19594252 1.56007237 1.56319636 -143.82531561 196.66951870 150.11730771