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=6.914835076060076 stress="-0.7453385279171941 0.11822158297035176 -0.1429140417015183 0.11822158297035176 -0.7478681526673918 -0.10402209271696274 -0.1429140417015183 -0.10402209271696274 -0.8109744505070094" pbc="T T T" Ne -0.14459490 0.11115480 0.11044915 4.70264111 -6.99863008 -2.37132618 Ne 1.70960170 1.31143450 0.04092907 -8.11419126 5.68413696 -3.25232019 Ne 1.35333724 0.05786860 1.64041416 -1.28148678 -2.91314641 -0.49813132 Ne -0.22187219 1.37281364 1.32834452 4.69303693 4.22763952 6.12177769