data_[Ta2Fe2Mo2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Fe  1.8300  1.4000  0.8525
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [4.7609]
_cell_length_b [4.7609]
_cell_length_c [9.4512]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [TaFeMoO6]
_chemical_formula_sum '[Ta2 Fe2 Mo2 O12]'
_cell_volume [214.2251]
_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
[
  Ta  Ta0  2  0.0000  0.0000  0.3356  1.0
  Fe  Fe1  2  0.0000  0.0000  0.9996  1.0
  Mo  Mo2  2  0.0000  0.0000  0.6666  1.0
  O  O3  4  0.1901  0.8099  0.4974  1.0
  O  O4  4  0.2074  0.7926  0.8221  1.0
  O  O5  4  0.2121  0.7879  0.1795  1.0
]