# generated using pymatgen
data_BaTl(WO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.89057100
_cell_length_b   3.89165078
_cell_length_c   22.76302248
_cell_angle_alpha   94.86016289
_cell_angle_beta   94.86240650
_cell_angle_gamma   90.11454303
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTl(WO3)2
_chemical_formula_sum   'Ba2 Tl2 W4 O12'
_cell_volume   342.15936488
_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  0.16947400  0.16291300  0.32675100  1.0
  Ba  Ba1  1  0.83648300  0.83816900  0.67287700  1.0
  Tl  Tl2  1  0.72457200  0.71822600  0.45120200  1.0
  Tl  Tl3  1  0.27185100  0.26569200  0.54796200  1.0
  W  W4  1  0.54372900  0.54116200  0.08220400  1.0
  W  W5  1  0.39079500  0.39366900  0.78492800  1.0
  W  W6  1  0.61413100  0.60769800  0.21521500  1.0
  W  W7  1  0.45775000  0.46002600  0.91852400  1.0
  O  O8  1  0.89091700  0.39295100  0.78577800  1.0
  O  O9  1  0.04176300  0.53983400  0.07948000  1.0
  O  O10  1  0.21087800  0.22695400  0.44040900  1.0
  O  O11  1  0.45895900  0.96119500  0.92104600  1.0
  O  O12  1  0.77168100  0.79088100  0.55907200  1.0
  O  O13  1  0.61466100  0.10719800  0.21464100  1.0
  O  O14  1  0.11448500  0.60716600  0.21548000  1.0
  O  O15  1  0.34741100  0.34962500  0.69600600  1.0
  O  O16  1  0.38948200  0.89324200  0.78504800  1.0
  O  O17  1  0.54176300  0.04050500  0.08086600  1.0
  O  O18  1  0.95842000  0.46057500  0.91973000  1.0
  O  O19  1  0.65863200  0.65187000  0.30427500  1.0