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=-1.05535733226547 stress="-10.803397433996565 -1.1272119818033912 0.36039179947946565 -1.1272119818033912 -10.46578521224169 -0.8707897236704563 0.36039179947946565 -0.8707897236704563 -13.412217577333989" pbc="F F F" Al -0.12320595 -0.04105180 0.20259391 -4.67231316 -3.92326626 -3.22114493 Al 1.56504129 1.20865944 -0.13449789 4.06488299 2.61879096 -4.81261811 Al 1.28802619 0.22277084 1.68584377 3.39958004 -3.34500041 4.79851008 Al 0.18362810 1.69581920 1.64685009 -2.79214987 4.64947571 3.23525296