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=1.6087939693392488 stress="-0.19061735563552523 -0.08567614592907385 0.10510127728874456 -0.08567614592907385 -0.7268932266182451 0.1870260925250025 0.10510127728874456 0.1870260925250025 -0.00023502293115570963" free_energy=1.6087939693392488 pbc="F T F" N 0.01258782 0.16911338 0.12365747 -1.38123163 4.78892265 0.08100096 N 1.45588739 1.45297513 0.04737131 2.93632228 -2.50069756 0.64442752 N 1.53238783 0.24404962 1.16451567 0.77710990 4.41176218 -2.62515011 N 0.12937675 1.25818085 1.59119645 -2.33220055 -6.69998727 1.89972163