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=3.39110839219 stress="15.412633941649522 -33.25971758675235 -3.4011522247844668 -33.25971758675235 -27.350151807596813 -16.377045635477373 -3.4011522247844668 -16.377045635477373 -48.57969047602142" pbc="F F F" C -0.21495266 0.18365717 0.20288723 -55.82385081 -137.58105409 -105.36167129 C 1.58343331 1.29585403 -0.05190546 23.17801588 62.05967450 -69.32807582 C 1.72094491 0.23171545 1.68190327 -64.26241760 29.71516482 71.46512033 C -0.17816502 1.71219253 1.42485375 96.90825252 45.80621477 103.22462678