20
Lattice="11.3337 0.0 0.0 0.0 3.4508 0.0 0.0 0.0 10.8037" Properties=species:S:1:pos:R:3:initial_charges:R:1 energy=-1946.11956595 dipole="-8.64311776 4.71648186 -1.52314148" pbc="T T T"
Ag       9.68360000       0.86270000       5.19410000       0.00000000
Ag       4.01680000       0.86270000       0.20780000       0.00000000
Ag       1.65010000       2.58810000       5.60960000       0.00000000
Ag       7.31690000       2.58810000      10.59590000       0.00000000
Ta       5.19650000       0.86270000       7.06500000       0.00000000
Ta      10.86340000       0.86270000       9.14060000       0.00000000
Ta       6.13720000       2.58810000       3.73870000       0.00000000
Ta       0.47030000       2.58810000       1.66310000       0.00000000
S        0.05890000       0.86270000       6.93730000       0.00000000
S        5.72580000       0.86270000       9.26830000       0.00000000
S       11.27480000       2.58810000       3.86640000       0.00000000
S        5.60790000       2.58810000       1.53540000       0.00000000
S       10.21230000       0.86270000       0.93640000       0.00000000
S        4.54550000       0.86270000       4.46550000       0.00000000
S        1.12140000       2.58810000       9.86730000       0.00000000
S        6.78820000       2.58810000       6.33820000       0.00000000
S        7.84560000       0.86270000       3.66300000       0.00000000
S        2.17880000       0.86270000       1.73890000       0.00000000
S        3.48810000       2.58810000       7.14070000       0.00000000
S        9.15490000       2.58810000       9.06480000       0.00000000