data_[Zr4Cr2Te8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  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 [14.9915]
_cell_length_b [3.9658]
_cell_length_c [6.9057]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.7587]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr2CrTe4]
_chemical_formula_sum '[Zr4 Cr2 Te8]'
_cell_volume [366.6024]
_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
[
  Zr  Zr0  4  0.2497  0.0000  0.2712  1.0
  Cr  Cr1  2  0.0000  0.0000  0.0000  1.0
  Te  Te2  4  0.1095  0.0000  0.4487  1.0
  Te  Te3  4  0.1194  0.5000  0.9496  1.0
]