# generated using pymatgen
data_LiY(TlCl3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.38016139
_cell_length_b   10.38016139
_cell_length_c   10.38016139
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiY(TlCl3)2
_chemical_formula_sum   'Li4 Y4 Tl8 Cl24'
_cell_volume   1118.43903942
_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
  Li  Li0  1  0.50000000  0.00000000  -0.00000000  1
  Li  Li1  1  0.50000000  0.50000000  0.50000000  1
  Li  Li2  1  0.00000000  0.00000000  0.50000000  1
  Li  Li3  1  0.00000000  0.50000000  -0.00000000  1
  Y  Y4  1  0.00000000  0.00000000  -0.00000000  1
  Y  Y5  1  0.00000000  0.50000000  0.50000000  1
  Y  Y6  1  0.50000000  0.00000000  0.50000000  1
  Y  Y7  1  0.50000000  0.50000000  -0.00000000  1
  Tl  Tl8  1  0.25000000  0.25000000  0.25000000  1
  Tl  Tl9  1  0.25000000  0.25000000  0.75000000  1
  Tl  Tl10  1  0.25000000  0.75000000  0.75000000  1
  Tl  Tl11  1  0.25000000  0.75000000  0.25000000  1
  Tl  Tl12  1  0.75000000  0.25000000  0.75000000  1
  Tl  Tl13  1  0.75000000  0.25000000  0.25000000  1
  Tl  Tl14  1  0.75000000  0.75000000  0.25000000  1
  Tl  Tl15  1  0.75000000  0.75000000  0.75000000  1
  Cl  Cl16  1  0.50000000  0.24686526  -0.00000000  1
  Cl  Cl17  1  0.50000000  0.00000000  0.24686526  1
  Cl  Cl18  1  0.25313474  0.00000000  -0.00000000  1
  Cl  Cl19  1  0.00000000  0.25313474  -0.00000000  1
  Cl  Cl20  1  0.50000000  0.00000000  0.75313474  1
  Cl  Cl21  1  0.74686526  0.00000000  -0.00000000  1
  Cl  Cl22  1  0.50000000  0.74686526  0.50000000  1
  Cl  Cl23  1  0.50000000  0.50000000  0.74686526  1
  Cl  Cl24  1  0.25313474  0.50000000  0.50000000  1
  Cl  Cl25  1  0.00000000  0.75313474  0.50000000  1
  Cl  Cl26  1  0.50000000  0.50000000  0.25313474  1
  Cl  Cl27  1  0.74686526  0.50000000  0.50000000  1
  Cl  Cl28  1  0.00000000  0.24686526  0.50000000  1
  Cl  Cl29  1  0.00000000  0.00000000  0.74686526  1
  Cl  Cl30  1  0.75313474  0.00000000  0.50000000  1
  Cl  Cl31  1  0.50000000  0.25313474  0.50000000  1
  Cl  Cl32  1  0.00000000  0.00000000  0.25313474  1
  Cl  Cl33  1  0.24686526  0.00000000  0.50000000  1
  Cl  Cl34  1  0.00000000  0.74686526  -0.00000000  1
  Cl  Cl35  1  0.00000000  0.50000000  0.24686526  1
  Cl  Cl36  1  0.75313474  0.50000000  -0.00000000  1
  Cl  Cl37  1  0.50000000  0.75313474  -0.00000000  1
  Cl  Cl38  1  0.00000000  0.50000000  0.75313474  1
  Cl  Cl39  1  0.24686526  0.50000000  -0.00000000  1
