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=11.9502227802562 stress="-1.4531558858744007 0.5994435091278784 -0.15377512506183996 0.5994435091278784 -2.0665953022247043 0.3599110805756592 -0.15377512506183996 0.3599110805756592 -0.9075511032780891" pbc="T T F" Ne -0.22303573 -0.08338442 0.22586561 8.45547289 -8.21065110 -8.06823731 Ne 1.79391194 1.22614529 0.02103145 -9.76370726 13.66718420 -11.70799576 Ne 1.27761356 0.18220204 1.39362841 6.58769702 -10.07531414 11.41857771 Ne 0.23573857 1.52724172 1.27538150 -5.27946265 4.61878104 8.35765536