14
Lattice="9.629013 -5.2e-05 0.0 -4.814552 8.339123 0.0 0.0 0.0 3.390986" Properties=species:S:1:pos:R:3:forces:R:3 energy=-111.14193594282308 stress="0.005724791079203853 -6.105770705876559e-05 -2.1513371701060058e-10 -6.105770705876559e-05 0.005583923633582383 -2.3166758714664831e-10 -2.1513371701060058e-10 -2.3166758714664831e-10 0.0059783009285287085" dipole="-3.806003360764866e-05 -3.809122021599741e-05 0.000160065323110996" pbc="T T T"
Nb       4.12498000       0.95287000       0.84775000       0.08561826      -0.05319933      -0.00003116
Nb       6.74123000       3.09591000       0.84775000       0.00279183       0.10170634      -0.00003113
Nb       3.57720000       4.29020000       0.84775000      -0.08996915      -0.04892340      -0.00003114
Nb       1.23726000       4.04887000       2.54324000       0.08996915       0.04892339       0.00003114
Nb      -1.92677000       5.24316000       2.54324000      -0.00279182      -0.10170635       0.00003113
Nb       0.68948000       7.38620000       2.54324000      -0.08561827       0.05319933       0.00003116
S        6.58830000       0.48200000       0.84775000      -0.23921010      -0.06727376      -0.00001761
S        1.93777000       2.39235000       0.84775000       0.05890169       0.24071586      -0.00001762
S        5.91740000       5.46467000       0.84775000       0.17962159      -0.17192109      -0.00001761
S        0.00035000       5.55962000       0.84775000      -0.00558215      -0.00346755      -0.00002385
S        4.81411000       2.77945000       2.54324000       0.00558215       0.00346755       0.00002385
S       -1.10294000       2.87440000       2.54324000      -0.17962160       0.17192110       0.00001761
S        2.87669000       5.94672000       2.54324000      -0.05890170      -0.24071585       0.00001762
S       -1.77384000       7.85707000       2.54324000       0.23921011       0.06727377       0.00001761