# generated using pymatgen
data_CsTlCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57995427
_cell_length_b   5.57995427
_cell_length_c   5.57995021
_cell_angle_alpha   89.98883282
_cell_angle_beta   89.98883282
_cell_angle_gamma   89.99737164
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsTlCl3
_chemical_formula_sum   'Cs1 Tl1 Cl3'
_cell_volume   173.73670712
_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
  Cs  Cs0  1  0.99811200  0.99811200  0.99450000  1.0
  Tl  Tl1  1  0.49797700  0.49797700  0.48666000  1.0
  Cl  Cl2  1  0.49450900  0.99912800  0.48493600  1.0
  Cl  Cl3  1  0.50252900  0.50252900  0.98638100  1.0
  Cl  Cl4  1  0.99912800  0.49450900  0.48493600  1.0