data_[V1Ga1Cu2O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.3552]
_cell_length_b [3.0435]
_cell_length_c [5.9957]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1196]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [VGa(CuO2)2]
_chemical_formula_sum '[V1 Ga1 Cu2 O4]'
_cell_volume [93.3920]
_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  1  0.0000  0.5000  0.5000  1.0
  Ga  Ga1  1  0.5000  0.0000  0.5000  1.0
  Cu  Cu2  1  0.0000  0.0000  0.0000  1.0
  Cu  Cu3  1  0.5000  0.5000  0.0000  1.0
  O  O4  2  0.1149  0.0000  0.3247  1.0
  O  O5  2  0.3982  0.5000  0.6765  1.0
]