# generated using pymatgen
data_LaYTl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.83186494
_cell_length_b   12.83186494
_cell_length_c   12.83186494
_cell_angle_alpha   123.40920786
_cell_angle_beta   119.01241328
_cell_angle_gamma   87.95903669
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaYTl2
_chemical_formula_sum   'La1 Y1 Tl2'
_cell_volume   1462.83931302
_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
  La  La0  1  0.00000000  0.50000000  0.50000000  1.0
  Y  Y1  1  0.00000000  0.00000000  0.00000000  1.0
  Tl  Tl2  1  0.00000000  0.24961700  0.24961700  1.0
  Tl  Tl3  1  0.00000000  0.75038300  0.75038300  1.0