# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36250400
_cell_length_b   9.29904300
_cell_length_c   11.40417200
_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   'Cr12 N24'
_cell_volume   568.68221183
_cell_formula_units_Z   12
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  0.75000000  0.50000000  0.71462000  1.0
  Cr  Cr1  1  0.75000000  0.00000000  0.21462000  1.0
  Cr  Cr2  1  0.25000000  0.50000000  0.28538000  1.0
  Cr  Cr3  1  0.25000000  0.00000000  0.78538000  1.0
  Cr  Cr4  1  0.93881600  0.70482400  0.08373100  1.0
  Cr  Cr5  1  0.56118400  0.29517600  0.08373100  1.0
  Cr  Cr6  1  0.56118400  0.20482400  0.58373100  1.0
  Cr  Cr7  1  0.93881600  0.79517600  0.58373100  1.0
  Cr  Cr8  1  0.06118400  0.20482400  0.41626900  1.0
  Cr  Cr9  1  0.43881600  0.79517600  0.41626900  1.0
  Cr  Cr10  1  0.43881600  0.70482400  0.91626900  1.0
  Cr  Cr11  1  0.06118400  0.29517600  0.91626900  1.0
  N  N12  1  0.85776200  0.32756900  0.03081800  1.0
  N  N13  1  0.64223800  0.67243100  0.03081800  1.0
  N  N14  1  0.64223800  0.82756900  0.53081800  1.0
  N  N15  1  0.85776200  0.17243100  0.53081800  1.0
  N  N16  1  0.14223800  0.82756900  0.46918200  1.0
  N  N17  1  0.35776200  0.17243100  0.46918200  1.0
  N  N18  1  0.35776200  0.32756900  0.96918200  1.0
  N  N19  1  0.14223800  0.67243100  0.96918200  1.0
  N  N20  1  0.95249500  0.09586500  0.30079600  1.0
  N  N21  1  0.54750500  0.90413500  0.30079600  1.0
  N  N22  1  0.54750500  0.59586500  0.80079600  1.0
  N  N23  1  0.95249500  0.40413500  0.80079600  1.0
  N  N24  1  0.07309200  0.38074300  0.37127500  1.0
  N  N25  1  0.42690800  0.61925700  0.37127500  1.0
  N  N26  1  0.42690800  0.88074300  0.87127500  1.0
  N  N27  1  0.07309200  0.11925700  0.87127500  1.0
  N  N28  1  0.92690800  0.88074300  0.12872500  1.0
  N  N29  1  0.57309200  0.11925700  0.12872500  1.0
  N  N30  1  0.57309200  0.38074300  0.62872500  1.0
  N  N31  1  0.92690800  0.61925700  0.62872500  1.0
  N  N32  1  0.04750500  0.59586500  0.19920400  1.0
  N  N33  1  0.45249500  0.40413500  0.19920400  1.0
  N  N34  1  0.45249500  0.09586500  0.69920400  1.0
  N  N35  1  0.04750500  0.90413500  0.69920400  1.0