# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78417000
_cell_length_b   3.90178600
_cell_length_c   4.80951200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrN2
_chemical_formula_sum   'Cr2 N4'
_cell_volume   52.24686163
_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
  Cr  Cr0  1  0.50000000  0.50000000  0.50000000  1.0
  Cr  Cr1  1  0.00000000  0.00000000  0.00000000  1.0
  N  N2  1  0.50000000  0.63383000  0.08877500  1.0
  N  N3  1  0.50000000  0.36617000  0.91122500  1.0
  N  N4  1  0.00000000  0.13383000  0.41122500  1.0
  N  N5  1  0.00000000  0.86617000  0.58877500  1.0