# generated using pymatgen
data_Ba2Tl2CuO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.28312762
_cell_length_b   12.28312762
_cell_length_c   5.58574300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   154.10576399
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Tl2CuO6
_chemical_formula_sum   'Ba4 Tl4 Cu2 O12'
_cell_volume   368.03853860
_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
  Ba  Ba0  1  0.08116500  0.91883500  0.50102600  1.0
  Ba  Ba1  1  0.91883500  0.08116500  0.49897400  1.0
  Ba  Ba2  1  0.41883500  0.58116500  0.00102600  1.0
  Ba  Ba3  1  0.58116500  0.41883500  0.99897400  1.0
  Tl  Tl4  1  0.70207400  0.29792600  0.48078700  1.0
  Tl  Tl5  1  0.29792600  0.70207400  0.51921300  1.0
  Tl  Tl6  1  0.79792600  0.20207400  0.98078700  1.0
  Tl  Tl7  1  0.20207400  0.79792600  0.01921300  1.0
  Cu  Cu8  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu9  1  0.00000000  0.00000000  0.00000000  1.0
  O  O10  1  0.78818200  0.21181800  0.54549200  1.0
  O  O11  1  0.21181800  0.78818200  0.45450800  1.0
  O  O12  1  0.71181800  0.28818200  0.04549200  1.0
  O  O13  1  0.28818200  0.71181800  0.95450800  1.0
  O  O14  1  0.61703900  0.38296100  0.49935300  1.0
  O  O15  1  0.38296100  0.61703900  0.50064700  1.0
  O  O16  1  0.88296100  0.11703900  0.99935300  1.0
  O  O17  1  0.11703900  0.88296100  0.00064700  1.0
  O  O18  1  0.75000700  0.74999300  0.25000000  1.0
  O  O19  1  0.74999300  0.75000700  0.75000000  1.0
  O  O20  1  0.25000700  0.24999300  0.25000000  1.0
  O  O21  1  0.24999300  0.25000700  0.75000000  1.0