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=-85.8726970336365 stress="-24.481507753581454 -5.008320319921392 2.0548827002256225 -5.008320319921392 -16.265116411410393 -6.443958650859376 2.0548827002256225 -6.443958650859376 -24.504146048039065" pbc="F F F" Ta -0.08129564 0.04860922 0.20118821 -0.46494091 -0.64122677 -2.28715439 Ta 1.70960170 1.31143450 1.33833517 1.71752138 3.91333604 0.06501234 Ta 3.06049558 -0.16490224 0.14041416 -0.83627660 -2.09230902 -1.77463041 Ta 4.27812781 1.51878885 1.32834452 2.89208238 2.83116449 0.75767109 Ta -0.12320595 2.95894820 0.13640716 -1.00923218 -1.59611137 0.24258424 Ta 1.56504129 4.20865944 1.36550211 -3.21041351 5.71535337 5.21776916 Ta 2.78802619 3.22277084 0.18584377 4.81978942 -3.30347065 -5.70509632 Ta 4.68362810 4.69581920 1.77817929 -0.89260725 -1.14092893 -0.69934739 Ta 0.26959405 0.43604902 2.57994991 -2.47022681 -1.18853721 3.81000083 Ta 1.49501075 1.67572846 4.65300231 1.01173580 -2.07136017 1.57003414 Ta 3.24137039 -0.04225341 3.00195488 -3.48563696 -3.65676859 -1.14162046 Ta 4.45789336 1.38825682 4.06627006 2.55505635 3.52710776 2.38320117 Ta 0.19178619 3.17895518 3.29140871 -3.60907887 -0.81055481 -2.94641840 Ta 1.56264813 4.53253581 4.64904689 0.94272812 2.54604412 1.82322212 Ta 2.78091226 3.10609294 3.18698489 2.07023379 -1.65796814 -2.43017621 Ta 4.53769570 4.50347925 4.33545096 -0.03073415 -0.37377011 1.11494850