# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.70784948
_cell_length_b   5.70784948
_cell_length_c   5.85014303
_cell_angle_alpha   83.57574774
_cell_angle_beta   83.57574774
_cell_angle_gamma   101.97760257
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrN2
_chemical_formula_sum   'Cr4 N8'
_cell_volume   183.47645485
_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  0.04436700  0.96385100  0.99740100  1.0
  Cr  Cr1  1  0.96385100  0.04436700  0.49740100  1.0
  Cr  Cr2  1  0.37282000  0.54360900  0.91551200  1.0
  Cr  Cr3  1  0.54360900  0.37282000  0.41551200  1.0
  N  N4  1  0.27846500  0.15356500  0.46608100  1.0
  N  N5  1  0.15356500  0.27846500  0.96608100  1.0
  N  N6  1  0.89817400  0.86307600  0.28116800  1.0
  N  N7  1  0.86307600  0.89817400  0.78116800  1.0
  N  N8  1  0.48050100  0.55035700  0.62577300  1.0
  N  N9  1  0.55035700  0.48050100  0.12577300  1.0
  N  N10  1  0.26212600  0.79881000  0.96359500  1.0
  N  N11  1  0.79881000  0.26212600  0.46359500  1.0