# generated using pymatgen
data_NaTl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28824196
_cell_length_b   5.28824299
_cell_length_c   5.28824366
_cell_angle_alpha   60.00000206
_cell_angle_beta   59.99999564
_cell_angle_gamma   59.99999987
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaTl
_chemical_formula_sum   'Na2 Tl2'
_cell_volume   104.57290480
_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
  Na  Na0  1  0.87500000  0.87500000  0.87500000  1.0
  Na  Na1  1  0.12500000  0.12500000  0.12500000  1.0
  Tl  Tl2  1  0.37500000  0.37500000  0.37500000  1.0
  Tl  Tl3  1  0.62500000  0.62500000  0.62500000  1.0