# generated using pymatgen
data_Tl(CuO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.50139553
_cell_length_b   6.08504851
_cell_length_c   6.07606229
_cell_angle_alpha   120.04573286
_cell_angle_beta   116.90891719
_cell_angle_gamma   90.00243320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl(CuO)2
_chemical_formula_sum   'Tl2 Cu4 O4'
_cell_volume   150.08755336
_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
  Tl  Tl0  1  0.89471492  0.64443968  0.78887972  1.0
  Tl  Tl1  1  0.10528508  0.35556032  0.21112028  1.0
  Cu  Cu2  1  0.00000000  -0.00000000  0.50000000  1.0
  Cu  Cu3  1  0.50000000  -0.00000000  0.50000000  1.0
  Cu  Cu4  1  0.50000000  -0.00000000  -0.00000000  1.0
  Cu  Cu5  1  0.50000000  0.50000000  -0.00000000  1.0
  O  O6  1  0.29814358  0.26448166  0.59622771  1.0
  O  O7  1  0.70185642  0.73551834  0.40377229  1.0
  O  O8  1  0.70187953  0.16826790  0.40377602  1.0
  O  O9  1  0.29812047  0.83173210  0.59622398  1.0