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=-2.020689848808508 stress="0.4751288910004837 0.2404655776769797 2.470173487718731 0.2404655776769797 3.4972242832770317 -0.3374011639401354 2.470173487718731 -0.3374011639401354 0.33225874992018456" pbc="F F F" Be 0.05269463 -0.28070327 -0.17328860 0.91282650 0.90775016 0.87043254 Be 1.35268773 1.55876836 0.04942752 0.68790256 -1.24411923 -0.82834125 Be 1.52487199 -0.20355569 1.50137603 -0.88350500 0.97696086 -1.00940235 Be 0.14851045 1.72380637 1.42147929 -0.71722406 -0.64059179 0.96731106