# generated using pymatgen
data_Ba2AlTlCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01893885
_cell_length_b   4.32259299
_cell_length_c   11.54127734
_cell_angle_alpha   89.79999567
_cell_angle_beta   81.16261785
_cell_angle_gamma   89.96888194
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2AlTlCo2O7
_chemical_formula_sum   'Ba2 Al1 Tl1 Co2 O7'
_cell_volume   198.11635900
_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  0.38821400  0.51383500  0.22167500  1.0
  Ba  Ba1  1  0.61074500  0.51789100  0.77815200  1.0
  Al  Al2  1  0.50252100  0.37576700  0.50027700  1.0
  Tl  Tl3  1  0.00023900  0.07626100  0.00012000  1.0
  Co  Co4  1  0.86069300  0.98562600  0.37843000  1.0
  Co  Co5  1  0.13925700  0.98573800  0.61760800  1.0
  O  O6  1  0.91784200  0.97863500  0.18603300  1.0
  O  O7  1  0.79930400  0.53492200  0.38772600  1.0
  O  O8  1  0.32826000  0.08609200  0.41106300  1.0
  O  O9  1  0.66899300  0.08586300  0.59191800  1.0
  O  O10  1  0.50001600  0.34686500  0.00041600  1.0
  O  O11  1  0.20115800  0.53531200  0.61100300  1.0
  O  O12  1  0.08275300  0.97718900  0.81557700  1.0