# generated using pymatgen
data_IN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15877875
_cell_length_b   7.15877875
_cell_length_c   7.15877875
_cell_angle_alpha   140.16855391
_cell_angle_beta   140.16855391
_cell_angle_gamma   57.59746282
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IN2
_chemical_formula_sum   'I2 N4'
_cell_volume   149.21872115
_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
  I  I0  1  0.25000000  0.25000000  0.00000000  1.0
  I  I1  1  0.75000000  0.75000000  0.00000000  1.0
  N  N2  1  0.58062000  0.08062000  0.66124100  1.0
  N  N3  1  0.41938000  0.91938000  0.33875900  1.0
  N  N4  1  0.08062000  0.41938000  0.50000000  1.0
  N  N5  1  0.91938000  0.58062000  0.50000000  1.0