data_[Cr4In4Ga8Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cr  1.6600  1.4000  0.9400
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.6926]
_cell_length_b [11.6516]
_cell_length_c [6.7631]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.0300]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CrIn(GaSe3)2]
_chemical_formula_sum '[Cr4 In4 Ga8 Se24]'
_cell_volume [978.2281]
_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
[
  Cr  Cr0  4  0.0000  0.0887  0.2500  1.0
  In  In1  4  0.0000  0.2653  0.7500  1.0
  Ga  Ga2  8  0.1892  0.4051  0.2952  1.0
  Se  Se3  8  0.1071  0.0779  0.6153  1.0
  Se  Se4  8  0.1298  0.2264  0.1202  1.0
  Se  Se5  8  0.1321  0.4204  0.6124  1.0
]