data_[Pr2Zn6Ga6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Zn  1.6500  1.3500  0.8800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.0633]
_cell_length_b [4.3957]
_cell_length_c [9.1303]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3222]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr(ZnGa)3]
_chemical_formula_sum '[Pr2 Zn6 Ga6]'
_cell_volume [264.0765]
_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
[
  Pr  Pr0  2  0.3553  0.7500  0.7539  1
  Zn  Zn1  2  0.0403  0.7500  0.3172  1
  Zn  Zn2  2  0.0593  0.2500  0.1614  1
  Zn  Zn3  2  0.2776  0.7500  0.1139  1
  Ga  Ga4  2  0.1389  0.2500  0.4811  1
  Ga  Ga5  2  0.2382  0.2500  0.9542  1
  Ga  Ga6  2  0.4522  0.7500  0.4176  1
]