data_[Na4Ti2Cr4Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Ti  1.5400  1.4000  0.8517
  Cr  1.6600  1.4000  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.8369]
_cell_length_b [11.7837]
_cell_length_c [8.0859]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3126]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Ti(CrTe3)2]
_chemical_formula_sum '[Na4 Ti2 Cr4 Te12]'
_cell_volume [625.2153]
_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
[
  Na  Na0  4  0.0000  0.1648  0.0000  1.0
  Ti  Ti1  2  0.0000  0.0000  0.5000  1.0
  Cr  Cr2  4  0.0000  0.3320  0.5000  1.0
  Te  Te3  8  0.2375  0.1692  0.7031  1.0
  Te  Te4  4  0.2276  0.5000  0.7029  1.0
]