20
Lattice="6.242331 -0.0 -0.108014 0.0 10.892912 -0.0 -2.224341 0.0 6.108756" Properties=species:S:1:pos:R:3:initial_charges:R:1 energy=-1947.38817236 dipole="0.64783529 -16.03112017 -6.33614628" pbc="T T T"
Ta       0.00000000       3.48690000      -0.00000000       0.00000000
Ta       0.00000000       7.40600000      -0.00000000       0.00000000
Ta       3.12120000       8.93340000      -0.05400000       0.00000000
Ta       3.12120000       1.95950000      -0.05400000       0.00000000
Ag       3.96140000       0.00000000       3.76940000       0.00000000
Ag       0.05660000       0.00000000       2.23130000       0.00000000
Ag       0.84020000       5.44650000       3.82340000       0.00000000
Ag       3.17780000       5.44650000       2.17730000       0.00000000
S        0.08130000       0.00000000       4.76160000       0.00000000
S        3.93670000       0.00000000       1.23920000       0.00000000
S        3.20240000       5.44650000       4.70760000       0.00000000
S        0.81560000       5.44650000       1.29320000       0.00000000
S        2.81110000       2.03440000       4.54600000       0.00000000
S        2.81110000       8.85850000       4.54600000       0.00000000
S        1.20690000       8.85850000       1.45470000       0.00000000
S        1.20690000       2.03440000       1.45470000       0.00000000
S       -0.31010000       7.48080000       4.60000000       0.00000000
S       -0.31010000       3.41210000       4.60000000       0.00000000
S        4.32800000       3.41210000       1.40070000       0.00000000
S        4.32800000       7.48080000       1.40070000       0.00000000