16
Lattice="10.679424 0.0 -0.119952 0.0 3.514082 0.0 -2.950947 0.0 9.671193" Properties=species:S:1:pos:R:3:forces:R:3 energy=-91.88208034574478 stress="-0.0016303077365689203 -5.278540200272559e-08 0.0010321035579468744 -5.278540200272559e-08 -0.0012952003564067095 8.080861038204821e-08 0.0010321035579468744 8.080861038204821e-08 -0.0020576886353683814" dipole="4.763504889830439e-05 -9.652169595373563e-05 3.690730473663114e-05" pbc="T T T"
Se       1.45682000       0.87852000       0.69979000       0.09895121      -0.00000465       0.01641748
Se       6.07330000       2.63556000       1.08103000       0.01417769       0.00000307      -0.03770456
Se       8.68199000       0.87852000       1.85021000      -0.05684055      -0.00000339       0.02023564
Se       3.41046000       0.87852000       2.41198000       0.00918514      -0.00000423      -0.05785969
Se       5.59610000       0.87852000       3.96457000       0.06616024      -0.00000430      -0.02928984
Se      -0.37048000       2.63556000       4.12389000      -0.02521258       0.00000577       0.02909424
Se       8.09896000       0.87852000       5.42735000       0.02519390      -0.00000577      -0.02911198
Se       2.13237000       2.63556000       5.58667000      -0.06606102       0.00000430       0.02930567
Se       4.31802000       2.63556000       7.13926000      -0.00923915       0.00000423       0.05785318
Se      -0.95351000       2.63556000       7.70103000       0.05682582       0.00000339      -0.02022855
Se       1.65517000       0.87852000       8.47022000      -0.01405628      -0.00000307       0.03759515
Se       6.27165000       2.63556000       8.85145000      -0.09884485       0.00000465      -0.01640555
Ta       3.39095000       2.63556000       0.40521000      -0.01587591       0.00001037      -0.01033906
Ta       7.52888000       2.63556000       3.50724000       0.00319793       0.00000955       0.00962545
Ta       0.19960000       0.87852000       6.04400000      -0.00326712      -0.00000955      -0.00960758
Ta       4.33753000       0.87852000       9.14603000       0.01570583      -0.00001037       0.01041983