# generated using pymatgen
data_Ba3SrTl2Cu2HgO10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.66580014
_cell_length_b   21.66580014
_cell_length_c   21.66580014
_cell_angle_alpha   169.67066164
_cell_angle_beta   169.67066164
_cell_angle_gamma   14.62781042
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3SrTl2Cu2HgO10
_chemical_formula_sum   'Ba3 Sr1 Tl2 Cu2 Hg1 O10'
_cell_volume   326.96352384
_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  0.65843300  0.65843300  0.00000000  1.0
  Ba  Ba1  1  0.43032200  0.43032200  0.00000000  1.0
  Ba  Ba2  1  0.56861900  0.56861900  0.00000000  1.0
  Sr  Sr3  1  0.34446600  0.34446600  0.00000000  1.0
  Tl  Tl4  1  0.77768100  0.77768100  0.00000000  1.0
  Tl  Tl5  1  0.22417900  0.22417900  0.00000000  1.0
  Cu  Cu6  1  0.88385200  0.88385200  0.00000000  1.0
  Cu  Cu7  1  0.11405000  0.11405000  0.00000000  1.0
  Hg  Hg8  1  0.99980900  0.99980900  0.00000000  1.0
  O  O9  1  0.27268000  0.27268000  0.00000000  1.0
  O  O10  1  0.72875400  0.72875400  0.00000000  1.0
  O  O11  1  0.95292400  0.95292400  0.00000000  1.0
  O  O12  1  0.04657600  0.04657600  0.00000000  1.0
  O  O13  1  0.38488700  0.88488700  0.50000000  1.0
  O  O14  1  0.88488700  0.38488700  0.50000000  1.0
  O  O15  1  0.61290300  0.11290300  0.50000000  1.0
  O  O16  1  0.11290300  0.61290300  0.50000000  1.0
  O  O17  1  0.82534700  0.82534700  0.00000000  1.0
  O  O18  1  0.17672900  0.17672900  0.00000000  1.0