# generated using pymatgen
data_CaTl2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.05266739
_cell_length_b   13.05266739
_cell_length_c   13.05266739
_cell_angle_alpha   122.95028102
_cell_angle_beta   117.70521691
_cell_angle_gamma   89.49385819
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaTl2Pb
_chemical_formula_sum   'Ca1 Tl2 Pb1'
_cell_volume   1560.47083243
_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
  Ca  Ca0  1  0.00000000  0.00000000  0.00000000  1.0
  Tl  Tl1  1  0.00000000  0.26609700  0.26609700  1.0
  Tl  Tl2  1  0.00000000  0.73390300  0.73390300  1.0
  Pb  Pb3  1  0.00000000  0.50000000  0.50000000  1.0