# generated using pymatgen
data_LiTlO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.69121038
_cell_length_b   5.69121038
_cell_length_c   5.69121038
_cell_angle_alpha   131.93144121
_cell_angle_beta   131.93144121
_cell_angle_gamma   70.33732962
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTlO2
_chemical_formula_sum   'Li2 Tl2 O4'
_cell_volume   99.98464043
_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
  Li  Li0  1  0.50000000  0.50000000  0.00000000  1
  Li  Li1  1  0.25000000  0.75000000  0.50000000  1
  Tl  Tl2  1  0.00000000  0.00000000  0.00000000  1
  Tl  Tl3  1  0.75000000  0.25000000  0.50000000  1
  O  O4  1  0.24343700  0.24343700  0.00000000  1
  O  O5  1  0.75656300  0.75656300  0.00000000  1
  O  O6  1  0.99343700  0.49343700  0.50000000  1
  O  O7  1  0.50656300  0.00656300  0.50000000  1
