# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.36585823
_cell_length_b   6.36585823
_cell_length_c   5.10404600
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   96.89204583
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrN2
_chemical_formula_sum   'Cr4 N8'
_cell_volume   205.34252766
_cell_formula_units_Z   4
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
  Cr  Cr0  1  0.03416500  0.34739400  0.13348000  1.0
  Cr  Cr1  1  0.34739400  0.03416500  0.86652000  1.0
  Cr  Cr2  1  0.96583500  0.65260600  0.63348000  1.0
  Cr  Cr3  1  0.65260600  0.96583500  0.36652000  1.0
  N  N4  1  0.08908500  0.52217800  0.39141600  1.0
  N  N5  1  0.52217800  0.08908500  0.60858400  1.0
  N  N6  1  0.91091500  0.47782200  0.89141600  1.0
  N  N7  1  0.47782200  0.91091500  0.10858400  1.0
  N  N8  1  0.86261200  0.13738800  0.25000000  1.0
  N  N9  1  0.13738800  0.86261200  0.75000000  1.0
  N  N10  1  0.74272700  0.74272700  0.50000000  1.0
  N  N11  1  0.25727300  0.25727300  0.00000000  1.0