data_[Li4Mo4Pb4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mo  2.1600  1.4500  0.7750
  Pb  2.3300  1.8000  1.1225
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [6.4010]
_cell_length_b [7.3055]
_cell_length_c [8.4497]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [LiMoPbO4]
_chemical_formula_sum '[Li4 Mo4 Pb4 O16]'
_cell_volume [395.1316]
_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
[
  Li  Li0  4  0.0000  0.0000  0.5000  1
  Mo  Mo1  4  0.2500  0.2500  0.2500  1
  Pb  Pb2  4  0.0000  0.2500  0.8455  1
  O  O3  8  0.0000  0.0690  0.2517  1
  O  O4  8  0.2314  0.2500  0.4764  1
]