data_Ce2Ir7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.56
_cell_length_b   13.56
_cell_length_c   13.56
_cell_angle_alpha   22.66
_cell_angle_beta   22.66
_cell_angle_gamma   22.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce2Ir7
_chemical_formula_sum   'Ce4 Ir14'
_cell_volume   324.44
_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  1  0.0  0.0  0.81  1.0
  Ce  Ce1  1  0.0  0.0  0.8  1.0
  Ce  Ce2  1  0.0  0.0  0.98  1.0
  Ce  Ce3  1  0.0  0.0  0.64  1.0
  Ir  Ir4  1  0.0  0.0  0.0  1.0
  Ir  Ir5  1  0.0  0.0  0.8  1.0
  Ir  Ir6  1  0.0  0.0  0.81  1.0
  Ir  Ir7  1  0.0  0.0  0.39  1.0
  Ir  Ir8  1  0.0  0.0  0.22  1.0
  Ir  Ir9  1  0.0  0.46  0.6  1.0
  Ir  Ir10  1  0.33  0.77  0.6  1.0
  Ir  Ir11  1  0.67  0.77  0.6  1.0
  Ir  Ir12  1  0.32  0.24  0.64  1.0
  Ir  Ir13  1  0.0  0.53  0.64  1.0
  Ir  Ir14  1  0.68  0.24  0.64  1.0
  Ir  Ir15  1  0.68  0.76  0.98  1.0
  Ir  Ir16  1  0.0  0.47  0.98  1.0
  Ir  Ir17  1  0.32  0.76  0.98  1.0

data_Ce2Ir7
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   13.56
_cell_angle_alpha   78.67
_cell_angle_beta   78.67
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ce2Ir7
_chemical_formula_sum   'Ce4 Ir14'
_cell_volume   324.44
_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  1  0.0  0.02  0.98  1.0
  Ce  Ce1  1  0.0  0.19  0.81  1.0
  Ce  Ce2  1  0.0  0.2  0.8  1.0
  Ce  Ce3  1  0.0  0.36  0.64  1.0
  Ir  Ir4  1  0.0  0.0  0.0  1.0
  Ir  Ir5  1  0.0  0.19  0.81  1.0
  Ir  Ir6  1  0.0  0.2  0.8  1.0
  Ir  Ir7  1  0.0  0.61  0.39  1.0
  Ir  Ir8  1  0.0  0.78  0.22  1.0
  Ir  Ir9  1  0.23  0.4  0.7  1.0
  Ir  Ir10  1  0.23  0.4  0.04  1.0
  Ir  Ir11  1  0.24  0.02  0.42  1.0
  Ir  Ir12  1  0.24  0.02  0.07  1.0
  Ir  Ir13  1  0.47  0.36  0.16  1.0
  Ir  Ir14  1  0.53  0.02  0.45  1.0
  Ir  Ir15  1  0.54  0.4  0.06  1.0
  Ir  Ir16  1  0.76  0.36  0.55  1.0
  Ir  Ir17  1  0.76  0.36  0.19  1.0
