data_[Ba4P4Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  P  2.1900  1.0000  0.5500
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.0829]
_cell_length_b [6.7893]
_cell_length_c [7.9161]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.6432]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ba2P2Rh3]
_chemical_formula_sum '[Ba4 P4 Rh6]'
_cell_volume [313.2270]
_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
[
  Ba  Ba0  4  0.1936  0.1161  0.4011  1
  P  P1  4  0.3474  0.6623  0.6273  1
  Rh  Rh2  4  0.3911  0.6009  0.3447  1
  Rh  Rh3  2  0.0000  0.0000  0.0000  1
]