16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-82.15833556379744 stress="-64.95836010169734 17.07523117098946 15.12760709742911 17.07523117098946 -48.25776346276342 -23.750900511151755 15.12760709742911 -23.750900511151755 -55.264433676146844" pbc="F F F" W -0.08129564 0.04860922 0.20118821 -0.09045473 -0.13525447 0.40468057 W 1.70960170 1.31143450 1.33833517 -6.39123042 4.33246782 6.72841885 W 2.78829595 -0.16490224 0.14041416 3.61279583 -5.35061899 -4.83117791 W 4.27812781 1.51878885 1.60054414 3.96485189 1.72014250 -2.87129446 W 0.00812325 2.95894820 0.46238060 -8.50232726 -5.38727718 -4.59052341 W 1.56504129 4.20865944 1.36550211 -10.60478165 23.52618021 15.03339261 W 2.78802619 3.22277084 0.18584377 17.64823076 -11.44714926 -18.06975708 W 4.68362810 4.69581920 1.37277522 -2.69525852 -2.98862634 2.59770009 W 0.26959405 -0.03869033 3.03768195 -0.35542060 1.19523420 -0.80303067 W 1.91285063 1.57550460 4.44885634 -3.66936429 -0.33481258 7.19400929 W 2.98657770 -0.04225341 3.13946649 -0.54428112 -7.60915329 -2.93296440 W 4.63979664 1.38825682 4.09225101 3.32350191 2.75585838 3.54381994 W 0.19178619 3.17895518 3.29140871 -3.85767122 -2.79742462 -0.83869290 W 1.82674612 4.53253581 4.57390064 -0.33816604 3.42182053 3.10660755 W 2.78091226 3.10609294 2.96603997 8.51856529 -0.45019884 -2.06757813 W 4.43588690 4.10378048 4.57571598 -0.01898984 -0.45118806 -1.60360993