data_[Ac4Ir3Rh1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Ir  2.2000  1.3500  0.7650
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [4.1713]
_cell_length_b [4.3740]
_cell_length_c [11.5882]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Ac4Ir3Rh]
_chemical_formula_sum '[Ac4 Ir3 Rh1]'
_cell_volume [211.4292]
_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
[
  Ac  Ac0  1  0.0000  0.0000  0.1383  1
  Ac  Ac1  1  0.0000  0.5000  0.8592  1
  Ac  Ac2  1  0.5000  0.0000  0.6402  1
  Ac  Ac3  1  0.5000  0.5000  0.3611  1
  Ir  Ir4  1  0.0000  0.0000  0.4210  1
  Ir  Ir5  1  0.0000  0.5000  0.5787  1
  Ir  Ir6  1  0.5000  0.0000  0.9197  1
  Rh  Rh7  1  0.5000  0.5000  0.0819  1
]