# generated using pymatgen
data_Cd(I3N2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.41789900
_cell_length_b   8.41789900
_cell_length_c   12.18411514
_cell_angle_alpha   110.20899940
_cell_angle_beta   110.20899940
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd(I3N2)2
_chemical_formula_sum   'Cd2 I12 N8'
_cell_volume   753.33686349
_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
  Cd  Cd0  1  0.37500000  0.62500000  0.75000000  1.0
  Cd  Cd1  1  0.62500000  0.37500000  0.25000000  1.0
  I  I2  1  0.56332200  0.81332200  0.12664400  1.0
  I  I3  1  0.81332200  0.56332200  0.62664400  1.0
  I  I4  1  0.43667800  0.18667800  0.87335600  1.0
  I  I5  1  0.18667800  0.43667800  0.37335600  1.0
  I  I6  1  0.80499700  0.23380900  0.96761800  1.0
  I  I7  1  0.23380900  0.80499700  0.46761800  1.0
  I  I8  1  0.23380900  0.16262200  0.46761800  1.0
  I  I9  1  0.16262200  0.23380900  0.96761800  1.0
  I  I10  1  0.19500300  0.76619100  0.03238200  1.0
  I  I11  1  0.76619100  0.19500300  0.53238200  1.0
  I  I12  1  0.76619100  0.83737800  0.53238200  1.0
  I  I13  1  0.83737800  0.76619100  0.03238200  1.0
  N  N14  1  0.19629700  0.44629700  0.75000000  1.0
  N  N15  1  0.19629700  0.80370300  0.75000000  1.0
  N  N16  1  0.44629700  0.19629700  0.25000000  1.0
  N  N17  1  0.44629700  0.55370300  0.25000000  1.0
  N  N18  1  0.55370300  0.44629700  0.75000000  1.0
  N  N19  1  0.55370300  0.80370300  0.75000000  1.0
  N  N20  1  0.80370300  0.19629700  0.25000000  1.0
  N  N21  1  0.80370300  0.55370300  0.25000000  1.0