# generated using pymatgen
data_I(NO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89971754
_cell_length_b   4.89971754
_cell_length_c   6.79205341
_cell_angle_alpha   68.85711669
_cell_angle_beta   68.85711669
_cell_angle_gamma   60.00000626
_symmetry_Int_Tables_number   1
_chemical_formula_structural   I(NO3)2
_chemical_formula_sum   'I1 N2 O6'
_cell_volume   128.38187634
_cell_formula_units_Z   1
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
  I  I0  1  0.00000000  0.00000000  0.00000000  1.0
  N  N1  1  0.42666100  0.42666100  0.72001700  1.0
  N  N2  1  0.57333900  0.57333900  0.27998300  1.0
  O  O3  1  0.43406400  0.68300100  0.71984100  1.0
  O  O4  1  0.16309400  0.43406400  0.71984100  1.0
  O  O5  1  0.68300100  0.16309400  0.71984100  1.0
  O  O6  1  0.56593600  0.31699900  0.28015900  1.0
  O  O7  1  0.83690600  0.56593600  0.28015900  1.0
  O  O8  1  0.31699900  0.83690600  0.28015900  1.0