data_[Te2Os1Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Te  2.1000  1.4000  1.2933
  Os  2.2000  1.3000  0.6730
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.7710]
_cell_length_b [7.1538]
_cell_length_c [11.2993]
_cell_angle_alpha [71.6798]
_cell_angle_beta [75.6374]
_cell_angle_gamma [62.7606]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Te2OsCl12]
_chemical_formula_sum '[Te2 Os1 Cl12]'
_cell_volume [458.4269]
_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
[
  Te  Te0  2  0.2616  0.2559  0.2396  1.0
  Os  Os1  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  2  0.0091  0.0377  0.1969  1.0
  Cl  Cl3  2  0.0282  0.6849  0.5916  1.0
  Cl  Cl4  2  0.0520  0.3194  0.9038  1.0
  Cl  Cl5  2  0.3899  0.8018  0.9823  1.0
  Cl  Cl6  2  0.4270  0.4329  0.3002  1.0
  Cl  Cl7  2  0.4849  0.9100  0.3500  1.0
]