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=6.170919158479273 stress="-20.33966417536125 6.265132353032387 12.185071459483261 6.265132353032387 -48.36202712077861 -12.66405081046344 12.185071459483261 -12.66405081046344 -10.339230661062533" pbc="T T T" Ne 0.04871692 -0.12544506 0.42752534 24.63998929 -63.03097499 -23.74213638 Ne 0.54502308 1.04040729 -0.05499786 3.95725400 -4.07880524 -3.39227787 Ne 0.88210715 -0.04717284 0.77836715 -23.02667432 -15.73169433 8.14864435 Ne -0.14673552 0.45360187 0.63839221 -5.57056897 82.84147456 18.98576990