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=3075.330239047465 stress="-10335.211248810367 -2427.277507066223 2927.118693501844 -2427.277507066223 -15168.367442618823 -4776.082963970302 2927.118693501844 -4776.082963970302 -11614.053687228236" pbc="F F F" Xe 0.28278197 0.06210000 0.13362859 -3070.38376253 -9964.29464358 -6255.95741141 Xe 1.32702941 1.57034430 0.04852473 5747.02079809 5255.72054482 -2880.83836542 Xe 1.55473499 0.02602945 1.63661615 2013.52206479 -776.54024340 2142.34571751 Xe -0.09519967 1.37719504 1.29869006 -4690.15910034 5485.11434216 6994.45005932