# generated using pymatgen
data_Ba2MgTl2CuO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.84292159
_cell_length_b   3.84292159
_cell_length_c   14.98667059
_cell_angle_alpha   90.11021245
_cell_angle_beta   74.98718486
_cell_angle_gamma   89.84607505
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2MgTl2CuO6
_chemical_formula_sum   'Ba2 Mg1 Tl2 Cu1 O6'
_cell_volume   213.76804390
_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  0.29897212  0.43689028  0.13834609  1.0
  Ba  Ba1  1  0.57523637  0.43731821  0.86165391  1.0
  Mg  Mg2  1  0.92558571  0.42558571  0.50000000  1.0
  Tl  Tl3  1  0.68142514  0.92412433  0.34889509  1.0
  Tl  Tl4  1  0.27301942  0.03032023  0.65110491  1.0
  Cu  Cu5  1  0.93747212  0.93747212  0.00000000  1.0
  O  O6  1  0.71848731  0.93647914  0.19925223  1.0
  O  O7  1  0.13573036  0.91773853  0.80074777  1.0
  O  O8  1  0.93715075  0.43731803  -0.00001783  1.0
  O  O9  1  0.43730021  0.93713293  0.00001783  1.0
  O  O10  1  0.86711518  0.92235141  0.55681889  1.0
  O  O11  1  0.47917230  0.42393607  0.44318111  1.0