data_[Li1Pr2Sn1Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pr  1.1300  1.8500  1.0600
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5151]
_cell_length_b [6.6538]
_cell_length_c [7.0168]
_cell_angle_alpha [79.7254]
_cell_angle_beta [68.6453]
_cell_angle_gamma [71.5964]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiPr2SnAu6]
_chemical_formula_sum '[Li1 Pr2 Sn1 Au6]'
_cell_volume [226.9614]
_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
[
  Li  Li0  1  0.0000  0.5000  0.5000  1
  Pr  Pr1  2  0.4971  0.2411  0.7510  1
  Sn  Sn2  1  0.0000  0.0000  0.0000  1
  Au  Au3  2  0.0178  0.1706  0.3411  1
  Au  Au4  2  0.1459  0.5586  0.1087  1
  Au  Au5  2  0.4941  0.7424  0.6991  1
]