# generated using pymatgen
data_CsCrI3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.04458400
_cell_length_b   8.28795100
_cell_length_c   14.11246600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsCrI3
_chemical_formula_sum   'Cs4 Cr4 I12'
_cell_volume   823.95868430
_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
  Cs  Cs0  1  0.75000000  0.00000000  0.66619500  1.0
  Cs  Cs1  1  0.25000000  0.00000000  0.33380500  1.0
  Cs  Cs2  1  0.75000000  0.50000000  0.16619500  1.0
  Cs  Cs3  1  0.25000000  0.50000000  0.83380500  1.0
  Cr  Cr4  1  0.50000000  0.00000000  0.00000000  1.0
  Cr  Cr5  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr6  1  0.00000000  0.50000000  0.50000000  1.0
  Cr  Cr7  1  0.50000000  0.50000000  0.50000000  1.0
  I  I8  1  0.28483600  0.75572200  0.08278800  1.0
  I  I9  1  0.71516400  0.25572200  0.41721200  1.0
  I  I10  1  0.21516400  0.24427800  0.08278800  1.0
  I  I11  1  0.78483600  0.75572200  0.91721200  1.0
  I  I12  1  0.28483600  0.74427800  0.58278800  1.0
  I  I13  1  0.71516400  0.24427800  0.91721200  1.0
  I  I14  1  0.75000000  0.00000000  0.15607400  1.0
  I  I15  1  0.21516400  0.25572200  0.58278800  1.0
  I  I16  1  0.25000000  0.50000000  0.34392600  1.0
  I  I17  1  0.75000000  0.50000000  0.65607400  1.0
  I  I18  1  0.25000000  0.00000000  0.84392600  1.0
  I  I19  1  0.78483600  0.74427800  0.41721200  1.0