# generated using pymatgen
data_KTl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.81422038
_cell_length_b   8.81422038
_cell_length_c   8.81422038
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTl2
_chemical_formula_sum   'K4 Tl8'
_cell_volume   484.21330261
_cell_formula_units_Z   4
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
  K  K0  1  0.62500000  0.62500000  0.62500000  1.0
  K  K1  1  0.62500000  0.62500000  0.12500000  1.0
  K  K2  1  0.62500000  0.12500000  0.62500000  1.0
  K  K3  1  0.12500000  0.62500000  0.62500000  1.0
  Tl  Tl4  1  0.90665000  0.90665000  0.90665000  1.0
  Tl  Tl5  1  0.90665000  0.90665000  0.28005100  1.0
  Tl  Tl6  1  0.90665000  0.28005100  0.90665000  1.0
  Tl  Tl7  1  0.34335000  0.34335000  0.96994900  1.0
  Tl  Tl8  1  0.34335000  0.34335000  0.34335000  1.0
  Tl  Tl9  1  0.28005100  0.90665000  0.90665000  1.0
  Tl  Tl10  1  0.34335000  0.96994900  0.34335000  1.0
  Tl  Tl11  1  0.96994900  0.34335000  0.34335000  1.0