# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65347885
_cell_length_b   5.65347885
_cell_length_c   9.12371700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.31873936
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrN2
_chemical_formula_sum   'Cr4 N8'
_cell_volume   251.72718635
_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  0.33030200  0.66238000  0.56128200  1.0
  Cr  Cr1  1  0.66238000  0.33030200  0.43871800  1.0
  Cr  Cr2  1  0.33030200  0.66238000  0.93871800  1.0
  Cr  Cr3  1  0.66238000  0.33030200  0.06128200  1.0
  N  N4  1  0.67787500  0.34824400  0.25000000  1.0
  N  N5  1  0.34824400  0.67787500  0.75000000  1.0
  N  N6  1  0.47307300  0.47307300  0.50000000  1.0
  N  N7  1  0.47307300  0.47307300  0.00000000  1.0
  N  N8  1  0.50525600  0.98892900  0.49143900  1.0
  N  N9  1  0.98892900  0.50525600  0.50856100  1.0
  N  N10  1  0.50525600  0.98892900  0.00856100  1.0
  N  N11  1  0.98892900  0.50525600  0.99143900  1.0