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=142927.61911424127 stress="-21373.314239644315 1982.7088104361046 -2006.682657508591 1982.7088104361046 -22653.371331473805 107.53588105800898 -2006.682657508591 107.53588105800898 -20566.61856581956" pbc="T T F" Y 0.09248142 -0.00104098 0.24205982 111216.28808718 -233940.52175993 -205811.91365653 Y 1.77190336 1.20138447 0.07099359 -137925.89696788 204682.53927471 -230848.53484939 Y 1.61244700 0.07386702 1.43016117 -58016.84412026 -166411.08898321 216047.18770999 Y 0.03931767 1.30593024 1.41661459 84726.45300096 195669.07146843 220613.26079593