data_[Ce9Sm3Ho12P24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [8.0336]
_cell_length_b [8.0336]
_cell_length_c [19.6359]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ce3Sm(HoP2)4]
_chemical_formula_sum '[Ce9 Sm3 Ho12 P24]'
_cell_volume [1097.4890]
_cell_formula_units_Z [3]
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
[
  Ce  Ce0  9  0.0000  0.5000  0.0000  1.0
  Sm  Sm1  3  0.0000  0.0000  0.0000  1.0
  Ho  Ho2  9  0.0000  0.5000  0.5000  1.0
  Ho  Ho3  3  -0.0000  -0.0000  0.5000  1.0
  P  P4  18  0.0018  0.5009  0.2484  1.0
  P  P5  6  0.0000  0.0000  0.2483  1.0
]