# generated using pymatgen
data_Ba2LiTl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.87314147
_cell_length_b   14.22968711
_cell_length_c   14.22968646
_cell_angle_alpha   60.57162323
_cell_angle_beta   60.82545643
_cell_angle_gamma   60.82545270
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2LiTl
_chemical_formula_sum   'Ba2 Li1 Tl1'
_cell_volume   2019.50438573
_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
  Ba  Ba0  1  0.73992053  1.00000000  0.00000000  1
  Ba  Ba1  1  0.26007947  0.00000000  1.00000000  1
  Li  Li2  1  0.00000000  0.00000000  0.00000000  1
  Tl  Tl3  1  0.50000000  0.00000000  0.00000000  1
