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=-5.14170314808 stress="-0.020883352047234894 -0.013529118468960447 0.22353011182371987 -0.013529118468960447 0.05401351072315815 -0.17597174268789062 0.22353011182371987 -0.17597174268789062 -0.1709620803593323" pbc="F F F" Be -0.19401975 -0.17842402 0.01361598 0.30137171 -0.21311636 -0.24314172 Be 1.35198705 1.47567541 0.06329927 0.37677273 -0.30902398 -0.34338374 Be 1.43745442 -0.22153142 1.49451428 -0.29622699 0.32256077 -0.25526460 Be -0.15873180 1.34140700 1.31668137 -0.38191745 0.19957956 0.84179006