data_[Mg2V4Co2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  V  1.6300  1.3500  0.7775
  Co  1.8800  1.3500  0.7683
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.4036]
_cell_length_b [3.8220]
_cell_length_c [6.8175]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.6527]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [MgV2CoO6]
_chemical_formula_sum '[Mg2 V4 Co2 O12]'
_cell_volume [269.2589]
_cell_formula_units_Z [2]
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
[
  Mg  Mg0  2  0.1499  0.0000  0.8953  1
  V  V1  2  0.2224  0.0000  0.3241  1
  V  V2  2  0.3065  0.5000  0.6653  1
  Co  Co3  2  0.3819  0.5000  0.0773  1
  O  O4  2  0.0697  0.0000  0.1978  1
  O  O5  2  0.1968  0.5000  0.8638  1
  O  O6  2  0.2545  0.0000  0.6165  1
  O  O7  2  0.2735  0.5000  0.3760  1
  O  O8  2  0.3252  0.0000  0.1136  1
  O  O9  2  0.4589  0.5000  0.7961  1
]