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=-1.66735181723 stress="1.5333541846091625 -0.29840474805527456 -0.04936525271987132 -0.29840474805527456 1.2104810553753855 -0.29332129980038174 -0.04936525271987132 -0.29332129980038174 1.5714772260250185" pbc="F F F" N -0.08950840 -0.27713580 -0.06141927 1.53508154 0.49605003 1.62410760 N 1.25205420 1.65488783 0.05988540 -1.62228840 -1.53438029 2.84861772 N 1.20245745 0.16431082 1.31425730 -3.00182372 2.56088900 -2.70653662 N -0.01155935 1.53277713 1.39971974 3.08903057 -1.52255874 -1.76618870