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=-3.51024515596 stress="1.4856122715963072 -0.37225645414129277 0.2573612847398558 -0.37225645414129277 1.3456871035862887 -0.7221756210451814 0.2573612847398558 -0.7221756210451814 1.8686290420801646" pbc="F F F" N 0.20070203 -0.29657041 -0.09914834 2.49706323 0.33327551 3.13213345 N 1.35292440 1.78187239 0.01001192 -0.94773057 -3.86507239 4.86777812 N 1.48453339 0.10170120 1.37793365 -5.06011353 4.80303236 -6.26993085 N -0.28095614 1.50082602 1.60136948 3.51078087 -1.27123547 -1.72998073