data_[K12Rb6Mo6Cl36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  Mo  2.1600  1.4500  0.7750
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [7.2379]
_cell_length_b [7.2379]
_cell_length_c [47.5168]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [K2RbMoCl6]
_chemical_formula_sum '[K12 Rb6 Mo6 Cl36]'
_cell_volume [2155.7469]
_cell_formula_units_Z [6]
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
[
  K  K0  6  0.0000  0.0000  0.1482  1.0
  K  K1  6  0.0000  0.0000  0.3148  1.0
  Rb  Rb2  6  0.0000  0.0000  0.4150  1.0
  Mo  Mo3  3  -0.0000  -0.0000  0.5000  1.0
  Mo  Mo4  3  0.0000  0.0000  0.0000  1.0
  Cl  Cl5  18  0.0135  0.5067  0.1363  1.0
  Cl  Cl6  18  0.0145  0.5072  0.6970  1.0
]