# generated using pymatgen
data_Nb2TlO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.59005069
_cell_length_b   7.59005069
_cell_length_c   7.59005069
_cell_angle_alpha   121.77140512
_cell_angle_beta   120.04004604
_cell_angle_gamma   88.44498825
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2TlO7
_chemical_formula_sum   'Nb4 Tl2 O14'
_cell_volume   304.74086217
_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
  Nb  Nb0  1  0.50000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.50000000  0.50000000  0.50000000  1.0
  Nb  Nb2  1  0.50000000  0.00000000  0.50000000  1.0
  Nb  Nb3  1  0.00000000  0.00000000  0.00000000  1.0
  Tl  Tl4  1  0.00000000  0.50000000  0.00000000  1.0
  Tl  Tl5  1  0.00000000  0.00000000  0.50000000  1.0
  O  O6  1  0.81032500  0.06032500  0.75000000  1.0
  O  O7  1  0.43800500  0.68800500  0.75000000  1.0
  O  O8  1  0.81232500  0.68679500  0.75723500  1.0
  O  O9  1  0.42956000  0.05508900  0.74276500  1.0
  O  O10  1  0.81232500  0.05508900  0.12553000  1.0
  O  O11  1  0.42956000  0.68679500  0.37447000  1.0
  O  O12  1  0.18967500  0.93967500  0.25000000  1.0
  O  O13  1  0.56199500  0.31199500  0.25000000  1.0
  O  O14  1  0.18767500  0.31320500  0.24276500  1.0
  O  O15  1  0.57044000  0.94491100  0.25723500  1.0
  O  O16  1  0.18767500  0.94491100  0.87447000  1.0
  O  O17  1  0.57044000  0.31320500  0.62553000  1.0
  O  O18  1  0.91168000  0.66168000  0.25000000  1.0
  O  O19  1  0.08832000  0.33832000  0.75000000  1.0