# generated using pymatgen
data_CsCrI2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11088333
_cell_length_b   8.11088333
_cell_length_c   6.51495600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   114.71883006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsCrI2
_chemical_formula_sum   'Cs2 Cr2 I4'
_cell_volume   389.32380523
_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  0.34040700  0.65959300  0.75000000  1.0
  Cs  Cs1  1  0.65959300  0.34040700  0.25000000  1.0
  Cr  Cr2  1  0.00000000  0.00000000  0.50000000  1.0
  Cr  Cr3  1  0.00000000  0.00000000  0.00000000  1.0
  I  I4  1  0.14125000  0.32977100  0.25000000  1.0
  I  I5  1  0.67022900  0.85875000  0.25000000  1.0
  I  I6  1  0.32977100  0.14125000  0.75000000  1.0
  I  I7  1  0.85875000  0.67022900  0.75000000  1.0