8
Lattice="5.175222 0.0 0.005853 0.0 3.648882 0.0 -1.139024 0.0 9.083287" Properties=species:S:1:pos:R:3:forces:R:3 energy=-49.270259399162214 stress="-0.0030398976313695835 -1.6224802980142738e-09 -1.5893016122106436e-05 -1.6224802980142738e-09 0.002469151534313956 -6.855497403394117e-08 -1.5893016122106436e-05 -6.855497403394117e-08 0.0016526504030834064" dipole="3.634733021540344e-05 -4.118355833010142e-05 3.349334299539957e-08" pbc="T T T"
S        4.34358000       0.91222000       1.56615000       0.08209756      -0.00000307       0.14530716
S        2.26723000       0.91222000       1.58477000      -0.07798098      -0.00000297       0.14596433
S        0.72331000       2.73666000       4.04780000       0.00517175       0.00000241       0.11811844
S        3.31289000       0.91222000       5.04134000      -0.00517175      -0.00000241      -0.11811843
S        1.76897000       2.73666000       7.50437000       0.07798098       0.00000298      -0.14596434
S       -0.30738000       2.73666000       7.52299000      -0.08209757       0.00000307      -0.14530716
Zr       3.31360000       2.73666000       3.15588000      -0.00258704       0.00000767       0.00743620
Zr       0.72260000       0.91222000       5.93326000       0.00258705      -0.00000767      -0.00743620