data_[In4Sn4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [6.7148]
_cell_length_b [6.0401]
_cell_length_c [8.6147]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4562]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [InSnSb]
_chemical_formula_sum '[In4 Sn4 Sb4]'
_cell_volume [349.3810]
_cell_formula_units_Z [4]
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  0.1143  0.5000  0.9132  1.0
  In  In1  2  0.3423  0.5000  0.2680  1.0
  Sn  Sn2  2  0.1106  0.0000  0.9738  1.0
  Sn  Sn3  2  0.3364  0.0000  0.6129  1.0
  Sb  Sb4  2  0.4000  0.0000  0.2608  1.0
  Sb  Sb5  2  0.4001  0.5000  0.6212  1.0
]