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=-41.89214905033566 stress="2.123197313196218 -0.359473725253397 -0.30380938306466976 -0.359473725253397 3.103810941068095 -0.3962550306710425 -0.30380938306466976 -0.3962550306710425 3.1544294050334796" pbc="F T T" N 0.09798015 0.06085714 -0.17665654 24.44991016 5.14040352 -12.34958978 N 1.43383925 1.74459391 0.09954099 -17.75054353 3.97832150 -3.85149951 N 1.37828759 0.10581235 1.77058364 -27.53244389 4.24980762 10.04818432 N 0.17650386 1.24469609 1.48765941 20.83307725 -13.36853264 6.15290498