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=16683.244472450275 stress="-3029.963864925492 -178.2975111320418 1686.598105199584 -178.2975111320418 -1265.2656621156482 -284.7010682028272 1686.598105199584 -284.7010682028272 -3415.359895185983" pbc="T F T" Cm 0.02375224 0.16218030 -0.25805890 -32381.03173000 -9611.08262148 35247.09302559 Cm 1.58358319 1.58091692 -0.26091559 -12790.73851351 15533.41572111 19479.54646688 Cm 1.23028123 0.20644881 1.54312009 31570.35300034 -13959.82872234 -43353.69707120 Cm -0.23396191 1.74754079 1.35046119 13601.41724318 8037.49562271 -11372.94242127