# generated using pymatgen
data_Ba2TlV2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.81133800
_cell_length_b   3.88421500
_cell_length_c   13.58242393
_cell_angle_alpha   89.57201218
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2TlV2O7
_chemical_formula_sum   'Ba2 Tl1 V2 O7'
_cell_volume   201.06935789
_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  0.00000000  0.00165600  0.70587600  1.0
  Ba  Ba1  1  0.00000000  0.00596000  0.29665200  1.0
  Tl  Tl2  1  0.50000000  0.50270700  0.50047800  1.0
  V  V3  1  0.50000000  0.49896600  0.85339000  1.0
  V  V4  1  0.50000000  0.53066800  0.14569500  1.0
  O  O5  1  0.00000000  0.99787300  0.49939400  1.0
  O  O6  1  0.00000000  0.49925800  0.86928900  1.0
  O  O7  1  0.50000000  0.99914000  0.85968000  1.0
  O  O8  1  0.00000000  0.48085300  0.13881400  1.0
  O  O9  1  0.50000000  0.98085200  0.13086000  1.0
  O  O10  1  0.50000000  0.50168900  0.71788900  1.0
  O  O11  1  0.50000000  0.50038200  0.28194800  1.0