data_[B16Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  B  2.0400  0.8500  0.4100
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [Cmm2]
_cell_length_a [16.6177]
_cell_length_b [18.6269]
_cell_length_c [16.7146]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [35]
_chemical_formula_structural [B2Te3]
_chemical_formula_sum '[B16 Te24]'
_cell_volume [5173.8021]
_cell_formula_units_Z [8]
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
[
  B  B0  8  0.1952  0.1925  0.4823  1
  B  B1  8  0.2117  0.2778  0.4794  1
  Te  Te2  8  0.1157  0.1086  0.5026  1
  Te  Te3  8  0.1307  0.3701  0.4863  1
  Te  Te4  4  0.0000  0.3308  0.5820  1
  Te  Te5  4  0.2389  0.0000  0.5167  1
]