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=-101.0778107893371 stress="-70.38897439440419 77.85753977964634 51.52284749632113 77.85753977964634 -18.555990770964286 -80.11239504232151 51.52284749632113 -80.11239504232151 32.950403875108236" pbc="F F F" Ds -0.11805945 0.24854685 0.05685681 5.20231218 4.64977521 5.53328955 Ds 1.40947481 1.72632890 1.75174221 37.22485955 -77.33339910 -79.74418773 Ds 2.90350030 0.18702762 0.28813124 -1.63599289 5.78333293 5.71408919 Ds 4.60770798 1.79974846 1.74917156 10.46305865 -10.73977315 -10.49298025 Ds 0.16293399 3.27345743 -0.15129101 5.40377018 -4.08290430 7.59654597 Ds 1.76349838 4.70356235 1.96218721 -4.21673246 2.78221302 -4.67820682 Ds 3.26620382 2.82836776 -0.26783932 -3.82669778 -1.55582783 9.56034153 Ds 4.50677545 4.57560591 1.42508911 -6.44706885 -7.12617786 4.05571815 Ds 0.02840789 0.06847701 2.85540166 0.28600379 0.33208101 1.64101804 Ds 1.36693828 1.90670748 4.78183415 2.46552028 -1.08505226 -9.07558336 Ds 3.12893068 -0.29147356 3.03709530 -3.48100359 9.69902927 -4.50359203 Ds 4.39534648 1.49094077 4.45656574 -3.52677350 2.52095938 -3.99981095 Ds -0.01097102 2.95046521 2.75652559 -58.33617139 54.55464908 46.00871431 Ds 1.76479667 4.44550217 4.74637182 2.97364679 -3.58883409 -7.77581531 Ds 2.91498783 2.85557723 2.90096739 23.65890504 30.54569029 44.87284970 Ds 4.61582901 4.60851111 4.16624811 -6.20763600 -5.35576160 -4.71239000