4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.9828447849321664 stress="-3.333661086663741 -1.6786887774576598 2.778600117972226 -1.6786887774576598 -1.2749145290645287 2.196507523689632 2.778600117972226 2.196507523689632 -7.167307297844774" pbc="T T T" Ne -0.29952809 0.33435866 0.09483406 3.56829465 -0.79310349 5.39605235 Ne 0.50787595 0.97744757 0.23323627 21.09137899 14.53484670 -30.89474152 Ne 0.93206732 0.34120739 0.88609189 -5.14701963 -1.65953630 -5.40081386 Ne 0.14835290 0.73858590 0.75416538 -19.51265401 -12.08220690 30.89950303