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=79.2976706019 stress="-45.84912875085612 5.893623438860579 -16.166781374110357 5.893623438860579 -34.00995350284322 -6.888742740945721 -16.166781374110357 -6.888742740945721 -52.75913326933889" pbc="F F F" O 0.19178619 0.17895518 0.29140871 -80.57223275 -55.61671862 -131.57611454 O 1.61455359 1.53253581 0.14904689 27.00902515 33.43461076 -21.90616620 O 1.28091226 0.10609294 1.46603997 97.51984554 -40.53344504 99.91134270 O -0.19401975 1.32157598 1.51361598 -43.95663794 62.71555290 53.57093805