data_[Pr8Ga8Ni4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.2717]
_cell_length_b [4.1421]
_cell_length_c [11.4209]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.8048]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2Ga2Ni]
_chemical_formula_sum '[Pr8 Ga8 Ni4]'
_cell_volume [471.6665]
_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
[
  Pr  Pr0  4  0.0913  0.0000  0.8844  1.0
  Pr  Pr1  4  0.2104  0.5000  0.6458  1.0
  Ga  Ga2  4  0.0429  0.0000  0.4157  1.0
  Ga  Ga3  4  0.1226  0.5000  0.1160  1.0
  Ni  Ni4  4  0.0718  0.5000  0.3130  1.0
]