data_[Ti2V2Cr2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  V  1.6300  1.3500  0.7775
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [4.6216]
_cell_length_b [4.6216]
_cell_length_c [8.8174]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [TiVCrO6]
_chemical_formula_sum '[Ti2 V2 Cr2 O12]'
_cell_volume [188.3307]
_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
[
  Ti  Ti0  2  0.0000  0.0000  0.3268  1.0
  V  V1  2  0.0000  0.0000  0.6645  1.0
  Cr  Cr2  2  0.0000  0.0000  0.9995  1.0
  O  O3  4  0.1912  0.8088  0.5078  1.0
  O  O4  4  0.1934  0.8066  0.8251  1.0
  O  O5  4  0.2015  0.7985  0.1718  1.0
]