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=3.09480222765 stress="-1.8013173879282953 2.1696387052055432 2.6880090975509665 2.1696387052055432 -0.876517846297993 2.256405720665202 2.6880090975509665 2.256405720665202 2.6865171597401334" pbc="F F F" N -0.03902326 -0.21780693 0.21813893 6.20850510 6.49400129 12.71990279 N 1.26716069 1.69410236 0.05683059 2.43240876 2.77810812 -1.78289416 N 1.38201197 -0.06699407 1.22002482 1.88536521 -9.17214995 -7.04857319 N -0.22303573 1.14276088 1.46512192 -10.52627907 -0.09995946 -3.88843543