# generated using pymatgen
data_Ba4Tl2Cu2HgO10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.93821717
_cell_length_b   21.93821717
_cell_length_c   21.93821717
_cell_angle_alpha   169.74654220
_cell_angle_beta   169.74654220
_cell_angle_gamma   14.52006133
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba4Tl2Cu2HgO10
_chemical_formula_sum   'Ba4 Tl2 Cu2 Hg1 O10'
_cell_volume   334.53706061
_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  0.34196300  0.34196300  0.00000000  1.0
  Ba  Ba1  1  0.56909500  0.56909500  0.00000000  1.0
  Ba  Ba2  1  0.43090500  0.43090500  0.00000000  1.0
  Ba  Ba3  1  0.65803700  0.65803700  0.00000000  1.0
  Tl  Tl4  1  0.22390700  0.22390700  0.00000000  1.0
  Tl  Tl5  1  0.77609300  0.77609300  0.00000000  1.0
  Cu  Cu6  1  0.11392500  0.11392500  0.00000000  1.0
  Cu  Cu7  1  0.88607500  0.88607500  0.00000000  1.0
  Hg  Hg8  1  0.00000000  0.00000000  0.00000000  1.0
  O  O9  1  0.38670100  0.88670100  0.50000000  1.0
  O  O10  1  0.95369800  0.95369800  0.00000000  1.0
  O  O11  1  0.72842100  0.72842100  0.00000000  1.0
  O  O12  1  0.04630200  0.04630200  0.00000000  1.0
  O  O13  1  0.82268600  0.82268600  0.00000000  1.0
  O  O14  1  0.61329900  0.11329900  0.50000000  1.0
  O  O15  1  0.88670100  0.38670100  0.50000000  1.0
  O  O16  1  0.27157900  0.27157900  0.00000000  1.0
  O  O17  1  0.17731400  0.17731400  0.00000000  1.0
  O  O18  1  0.11329900  0.61329900  0.50000000  1.0