data_[Sm2Pa4Rh9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Pa  1.5000  1.8000  1.0400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.5864]
_cell_length_b [4.5864]
_cell_length_c [17.1022]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Sm2Pa4Rh9]
_chemical_formula_sum '[Sm2 Pa4 Rh9]'
_cell_volume [311.5481]
_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
[
  Sm  Sm0  2  0.3333  0.6667  0.7512  1
  Pa  Pa1  2  0.3333  0.6667  0.4080  1
  Pa  Pa2  2  0.3333  0.6667  0.1003  1
  Rh  Rh3  2  0.0000  0.0000  0.1597  1
  Rh  Rh4  2  0.0000  0.0000  0.3344  1
  Rh  Rh5  2  0.3333  0.6667  0.5797  1
  Rh  Rh6  2  0.3333  0.6667  0.9314  1
  Rh  Rh7  1  0.0000  0.0000  0.5000  1
]