# generated using pymatgen
data_CeNdI4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.90599681
_cell_length_b   8.90599681
_cell_length_c   7.68065077
_cell_angle_alpha   69.34013244
_cell_angle_beta   69.34013244
_cell_angle_gamma   110.20717446
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CeNdI4
_chemical_formula_sum   'Ce2 Nd2 I8'
_cell_volume   450.04047641
_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
  Ce  Ce0  1  0.49459700  0.50540300  0.25000000  1.0
  Ce  Ce1  1  0.50540300  0.49459700  0.75000000  1.0
  Nd  Nd2  1  0.13067900  0.86932100  0.25000000  1.0
  Nd  Nd3  1  0.86932100  0.13067900  0.75000000  1.0
  I  I4  1  0.87441400  0.75421100  0.75530300  1.0
  I  I5  1  0.24578900  0.12558600  0.74469700  1.0
  I  I6  1  0.12558600  0.24578900  0.24469700  1.0
  I  I7  1  0.55539400  0.19384900  0.08976100  1.0
  I  I8  1  0.44460600  0.80615100  0.91023900  1.0
  I  I9  1  0.75421100  0.87441400  0.25530300  1.0
  I  I10  1  0.80615100  0.44460600  0.41023900  1.0
  I  I11  1  0.19384900  0.55539400  0.58976100  1.0