data_[K4Cu12Ag4Mo16O64]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cu  1.9000  1.3500  0.8200
  Ag  1.9300  1.6000  1.0867
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.1143]
_cell_length_b [14.7529]
_cell_length_c [20.0621]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5631]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [KCu3Ag(MoO4)4]
_chemical_formula_sum '[K4 Cu12 Ag4 Mo16 O64]'
_cell_volume [1510.7908]
_cell_formula_units_Z [4]
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  4  0.1922  0.5279  0.5992  1
  Cu  Cu1  4  0.1932  0.6754  0.0719  1
  Cu  Cu2  4  0.2264  0.2057  0.1725  1
  Cu  Cu3  4  0.2914  0.0600  0.3874  1
  Ag  Ag4  4  0.2750  0.6381  0.7911  1
  Mo  Mo5  4  0.1933  0.0844  0.5704  1
  Mo  Mo6  4  0.2495  0.5999  0.2288  1
  Mo  Mo7  4  0.2787  0.2300  0.8295  1
  Mo  Mo8  4  0.3235  0.6779  0.4397  1
  O  O9  4  0.0165  0.6283  0.1515  1
  O  O10  4  0.0430  0.5615  0.2894  1
  O  O11  4  0.0687  0.2383  0.7505  1
  O  O12  4  0.0750  0.1890  0.8897  1
  O  O13  4  0.0952  0.7315  0.3795  1
  O  O14  4  0.0962  0.1266  0.4873  1
  O  O15  4  0.0981  0.5532  0.8863  1
  O  O16  4  0.1917  0.5759  0.4679  1
  O  O17  4  0.3749  0.1443  0.0983  1
  O  O18  4  0.3756  0.7469  0.0104  1
  O  O19  4  0.3816  0.1646  0.6183  1
  O  O20  4  0.3924  0.5156  0.0621  1
  O  O21  4  0.4465  0.5065  0.2104  1
  O  O22  4  0.4647  0.6878  0.2671  1
  O  O23  4  0.4881  0.1711  0.3666  1
  O  O24  4  0.4931  0.6430  0.6817  1
]