data_[Ag2Te12Mo12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Te  2.1000  1.4000  1.2933
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5285]
_cell_length_b [4.6149]
_cell_length_c [9.6998]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.3901]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ag(TeMo)6]
_chemical_formula_sum '[Ag2 Te12 Mo12]'
_cell_volume [708.0070]
_cell_formula_units_Z [2]
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
[
  Ag  Ag0  2  0.0000  0.0000  0.0000  1.0
  Te  Te1  4  0.0442  0.5000  0.8374  1.0
  Te  Te2  4  0.1218  0.0000  0.6115  1.0
  Te  Te3  4  0.1779  0.0000  0.2475  1.0
  Mo  Mo4  4  0.1540  0.0000  0.9302  1.0
  Mo  Mo5  4  0.1890  0.5000  0.8149  1.0
  Mo  Mo6  4  0.2142  0.5000  0.1120  1.0
]