# generated using pymatgen
data_Ba2Tl2CuO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.30049119
_cell_length_b   12.30049119
_cell_length_c   12.30049119
_cell_angle_alpha   161.72343198
_cell_angle_beta   161.72343198
_cell_angle_gamma   25.95898528
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Tl2CuO6
_chemical_formula_sum   'Ba2 Tl2 Cu1 O6'
_cell_volume   182.97237207
_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  0.91875100  0.91875100  0.00000000  1.0
  Ba  Ba1  1  0.08124900  0.08124900  0.00000000  1.0
  Tl  Tl2  1  0.70227200  0.70227200  0.00000000  1.0
  Tl  Tl3  1  0.29772800  0.29772800  0.00000000  1.0
  Cu  Cu4  1  0.50000000  0.50000000  0.00000000  1.0
  O  O5  1  0.78881300  0.78881300  0.00000000  1.0
  O  O6  1  0.21118700  0.21118700  0.00000000  1.0
  O  O7  1  0.38216100  0.38216100  0.00000000  1.0
  O  O8  1  0.61783900  0.61783900  0.00000000  1.0
  O  O9  1  0.50000000  0.00000000  0.50000000  1.0
  O  O10  1  0.00000000  0.50000000  0.50000000  1.0