data_[Ce2U4P4Ir14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  U  1.3800  1.7500  0.9913
  P  2.1900  1.0000  0.5500
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.6819]
_cell_length_b [5.6026]
_cell_length_c [13.4438]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.5157]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CeU2P2Ir7]
_chemical_formula_sum '[Ce2 U4 P4 Ir14]'
_cell_volume [422.0784]
_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
[
  Ce  Ce0  2  0.0000  0.0000  0.0000  1
  U  U1  4  0.1229  0.0000  0.3546  1
  P  P2  4  0.1016  0.5000  0.2570  1
  Ir  Ir3  8  0.1850  0.2504  0.8346  1
  Ir  Ir4  4  0.1369  0.5000  0.4287  1
  Ir  Ir5  2  0.0000  0.5000  0.0000  1
]