data_[Mn4V4Cu4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  V  1.6300  1.3500  0.7775
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [5.9245]
_cell_length_b [8.8752]
_cell_length_c [6.4384]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [MnVCuO4]
_chemical_formula_sum '[Mn4 V4 Cu4 O16]'
_cell_volume [338.5387]
_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
[
  Mn  Mn0  4  0.0000  0.5000  0.0000  1.0
  V  V1  4  0.0000  0.1391  0.2500  1.0
  Cu  Cu2  4  0.0000  0.1763  0.7500  1.0
  O  O3  8  0.0000  0.2529  0.0296  1.0
  O  O4  8  0.2460  0.0205  0.2500  1.0
]