data_[In2Co2Te3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Co  1.8800  1.3500  0.7683
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.9738]
_cell_length_b [7.2349]
_cell_length_c [18.2902]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [In2Co2Te3]
_chemical_formula_sum '[In2 Co2 Te3]'
_cell_volume [525.8408]
_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
[
  In  In0  2  0.0000  0.3093  0.5548  1
  Co  Co1  2  0.5000  0.1730  0.4754  1
  Te  Te2  1  0.0000  0.0000  0.4179  1
  Te  Te3  1  0.5000  0.0000  0.5978  1
  Te  Te4  1  0.5000  0.5000  0.4247  1
]