# generated using pymatgen
data_CsTiCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.40115554
_cell_length_b   7.40115624
_cell_length_c   5.92382661
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999241
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsTiCl3
_chemical_formula_sum   'Cs2 Ti2 Cl6'
_cell_volume   281.01668524
_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
  Cs  Cs0  1  0.66666700  0.33333300  0.25001079  1.0
  Cs  Cs1  1  0.33333300  0.66666700  0.74998921  1.0
  Ti  Ti2  1  0.00000000  0.00000000  0.50000000  1.0
  Ti  Ti3  1  0.00000000  0.00000000  -0.00000000  1.0
  Cl  Cl4  1  0.83951421  0.67902743  0.74995559  1.0
  Cl  Cl5  1  0.16048679  0.83951321  0.25004441  1.0
  Cl  Cl6  1  0.67902743  0.83951321  0.25004441  1.0
  Cl  Cl7  1  0.32097257  0.16048679  0.74995559  1.0
  Cl  Cl8  1  0.16048679  0.32097257  0.25004441  1.0
  Cl  Cl9  1  0.83951421  0.16048679  0.74995559  1.0