data_[V2Cd2Cu1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.3220]
_cell_length_b [5.3337]
_cell_length_c [6.7639]
_cell_angle_alpha [69.6067]
_cell_angle_beta [79.9284]
_cell_angle_gamma [69.7050]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [V2Cd2CuO8]
_chemical_formula_sum '[V2 Cd2 Cu1 O8]'
_cell_volume [168.4753]
_cell_formula_units_Z [1]
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
[
  V  V0  2  0.1120  0.8514  0.2828  1
  Cd  Cd1  2  0.2679  0.4626  0.8381  1
  Cu  Cu2  1  0.5000  0.0000  0.5000  1
  O  O3  2  0.1137  0.1859  0.1308  1
  O  O4  2  0.2113  0.1899  0.6633  1
  O  O5  2  0.2808  0.7757  0.5084  1
  O  O6  2  0.3016  0.6237  0.1471  1
]