data_[Ca2Tb6Ho4Bi12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Tb  1.1000  1.7500  0.9815
  Ho  1.2300  1.7500  1.0410
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.6280]
_cell_length_b [4.4940]
_cell_length_c [9.0193]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1985]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CaTb3(HoBi3)2]
_chemical_formula_sum '[Ca2 Tb6 Ho4 Bi12]'
_cell_volume [774.5679]
_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
[
  Ca  Ca0  2  0.0000  0.5000  0.0000  1
  Tb  Tb1  4  0.1647  0.0000  0.8340  1
  Tb  Tb2  2  0.0000  0.5000  0.5000  1
  Ho  Ho3  4  0.1664  0.0000  0.3321  1
  Bi  Bi4  4  0.0012  0.0000  0.2556  1
  Bi  Bi5  4  0.1675  0.5000  0.5821  1
  Bi  Bi6  4  0.1690  0.5000  0.0867  1
]