data_[Ac12Pr8Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pr  1.1300  1.8500  1.0600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [13.3318]
_cell_length_b [5.8313]
_cell_length_c [14.4472]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.5436]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ac3Pr2Rh3]
_chemical_formula_sum '[Ac12 Pr8 Rh12]'
_cell_volume [1122.7487]
_cell_formula_units_Z [4]
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
[
  Ac  Ac0  2  0.0480  0.0000  0.6185  1
  Ac  Ac1  2  0.0538  0.0000  0.8812  1
  Ac  Ac2  2  0.1511  0.5000  0.4248  1
  Ac  Ac3  2  0.2497  0.5000  0.7517  1
  Ac  Ac4  2  0.2570  0.0000  0.2515  1
  Ac  Ac5  2  0.4573  0.5000  0.1265  1
  Pr  Pr6  2  0.1743  0.5000  0.0615  1
  Pr  Pr7  2  0.3249  0.0000  0.5629  1
  Pr  Pr8  2  0.3353  0.0000  0.9366  1
  Pr  Pr9  2  0.4337  0.5000  0.3866  1
  Rh  Rh10  2  0.1419  0.0000  0.4385  1
  Rh  Rh11  2  0.1587  0.0000  0.0577  1
  Rh  Rh12  2  0.2171  0.0000  0.7501  1
  Rh  Rh13  2  0.2835  0.5000  0.2446  1
  Rh  Rh14  2  0.3406  0.5000  0.5578  1
  Rh  Rh15  2  0.3530  0.5000  0.9453  1
]