data_[Pr12Mg4Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Mg  1.3100  1.5000  0.8600
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.9891]
_cell_length_b [6.9501]
_cell_length_c [11.0139]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4136]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Pr3MgGa]
_chemical_formula_sum '[Pr12 Mg4 Ga4]'
_cell_volume [592.2931]
_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  0.2032  0.0336  0.2723  1.0
  Pr  Pr1  4  0.2582  0.5396  0.3598  1.0
  Pr  Pr2  4  0.3749  0.1520  0.5834  1.0
  Mg  Mg3  4  0.0511  0.7159  0.0344  1.0
  Ga  Ga4  4  0.4239  0.7121  0.6288  1.0
]