# generated using pymatgen
data_Cs3Ti2Cl9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.37346492
_cell_length_b   7.36934408
_cell_length_c   17.96458542
_cell_angle_alpha   89.99396055
_cell_angle_beta   89.99986809
_cell_angle_gamma   119.98744329
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs3Ti2Cl9
_chemical_formula_sum   'Cs6 Ti4 Cl18'
_cell_volume   845.47976476
_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  0.66650532  0.33329829  0.92431978  1.0
  Cs  Cs1  1  0.33308569  0.66657142  0.42436255  1.0
  Cs  Cs2  1  0.00081713  0.00043486  0.24996176  1.0
  Cs  Cs3  1  0.33308922  0.66663501  0.07571073  1.0
  Cs  Cs4  1  0.99974091  0.99971180  0.75008299  1.0
  Cs  Cs5  1  0.66649603  0.33324512  0.57565078  1.0
  Ti  Ti6  1  0.33314027  0.66644014  0.66232336  1.0
  Ti  Ti7  1  0.66743572  0.33372392  0.16213142  1.0
  Ti  Ti8  1  0.33312306  0.66645146  0.83786940  1.0
  Ti  Ti9  1  0.66748066  0.33372674  0.33756069  1.0
  Cl  Cl10  1  0.48789172  0.51197196  0.75008744  1.0
  Cl  Cl11  1  0.51191039  0.48742556  0.24992064  1.0
  Cl  Cl12  1  0.17664021  0.35353695  0.90690442  1.0
  Cl  Cl13  1  0.35450129  0.17726348  0.40704100  1.0
  Cl  Cl14  1  0.64595129  0.82316282  0.90704187  1.0
  Cl  Cl15  1  0.97658582  0.48831122  0.24991175  1.0
  Cl  Cl16  1  0.48763739  0.97556678  0.75010605  1.0
  Cl  Cl17  1  0.02389211  0.51199920  0.75011085  1.0
  Cl  Cl18  1  0.82279325  0.17630887  0.40659630  1.0
  Cl  Cl19  1  0.82278901  0.64650056  0.40658458  1.0
  Cl  Cl20  1  0.17678319  0.35374079  0.59320442  1.0
  Cl  Cl21  1  0.17689474  0.82298833  0.59318990  1.0
  Cl  Cl22  1  0.35437501  0.17724448  0.09281717  1.0
  Cl  Cl23  1  0.64576315  0.82292456  0.59315047  1.0
  Cl  Cl24  1  0.51192075  0.02462818  0.24993379  1.0
  Cl  Cl25  1  0.17692706  0.82316231  0.90705256  1.0
  Cl  Cl26  1  0.82291655  0.64661059  0.09318098  1.0
  Cl  Cl27  1  0.82291207  0.17641160  0.09319238  1.0