3
Lattice="3.677441 -0.000179 0.000157 -1.838875 3.185025 0.0 0.000269 0.000155 5.943451" Properties=species:S:1:pos:R:3:forces:R:3 energy=-20.29412465738116 stress="0.0027374219914290507 -6.555624905309001e-05 5.670862370266448e-05 -6.555624905309001e-05 0.0028075965373231867 8.908617363835827e-05 5.670862370266448e-05 8.908617363835827e-05 0.0006034885847379497" dipole="-1.2887917890501298e-05 -2.376984781972001e-06 2.584327192297757e-06" pbc="T T T"
S        0.00016000       2.12344000       1.46394000      -0.00134473      -0.00195919      -0.20857746
S        1.83867000       1.06156000       4.47967000       0.00135085       0.00196044       0.20856397
Zr       0.00000000       0.00000000       0.00000000      -0.00000658      -0.00000134       0.00001344