data_[Co2Cu1Te1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Cu  1.9000  1.3500  0.8200
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1110]
_cell_length_b [5.1200]
_cell_length_c [5.4998]
_cell_angle_alpha [101.9020]
_cell_angle_beta [103.0203]
_cell_angle_gamma [119.2894]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Co2CuTeO6]
_chemical_formula_sum '[Co2 Cu1 Te1 O6]'
_cell_volume [113.4978]
_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
[
  Co  Co0  1  0.0070  0.0029  0.0035  1
  Co  Co1  1  0.5200  0.8468  0.3758  1
  Cu  Cu2  1  0.1188  0.4574  0.6136  1
  Te  Te3  1  0.6648  0.3410  0.9993  1
  O  O4  1  0.0773  0.4043  0.2332  1
  O  O5  1  0.2278  0.2048  0.7910  1
  O  O6  1  0.4342  0.1237  0.2150  1
  O  O7  1  0.6095  0.9407  0.7741  1
  O  O8  1  0.7989  0.7734  0.2173  1
  O  O9  1  0.8800  0.5818  0.7923  1
]