data_[Ba2Sn7Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Sn  1.9600  1.4500  0.8300
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-6]
_cell_length_a [10.4473]
_cell_length_b [10.4473]
_cell_length_c [4.3248]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [174]
_chemical_formula_structural [Ba2Sn7Rh12]
_chemical_formula_sum '[Ba2 Sn7 Rh12]'
_cell_volume [408.7968]
_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
[
  Ba  Ba0  1  0.0000  0.0000  0.5000  1
  Ba  Ba1  1  0.6667  0.3333  0.0000  1
  Sn  Sn2  3  0.0815  0.2942  0.0000  1
  Sn  Sn3  3  0.4163  0.3597  0.5000  1
  Sn  Sn4  1  0.3333  0.6667  0.0000  1
  Rh  Rh5  3  0.0509  0.5265  0.0000  1
  Rh  Rh6  3  0.2333  0.4725  0.5000  1
  Rh  Rh7  3  0.2819  0.2013  0.0000  1
  Rh  Rh8  3  0.3862  0.0847  0.5000  1
]