# generated using pymatgen
data_CrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54336900
_cell_length_b   6.03780782
_cell_length_c   6.84007736
_cell_angle_alpha   116.05689007
_cell_angle_beta   88.74332655
_cell_angle_gamma   98.42317353
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrN2
_chemical_formula_sum   'Cr4 N8'
_cell_volume   203.21622745
_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  0.79455500  0.51231700  0.36337800  1.0
  Cr  Cr1  1  0.95756000  0.52970800  0.79476600  1.0
  Cr  Cr2  1  0.30093600  0.67699700  0.00948300  1.0
  Cr  Cr3  1  0.72609800  0.04218700  0.79121000  1.0
  N  N4  1  0.98728400  0.64497400  0.11234600  1.0
  N  N5  1  0.26658500  0.51047200  0.84543300  1.0
  N  N6  1  0.51835800  0.57263500  0.21980400  1.0
  N  N7  1  0.82792000  0.21439400  0.92892800  1.0
  N  N8  1  0.88579200  0.67338500  0.51879300  1.0
  N  N9  1  0.89097300  0.74772500  0.90887400  1.0
  N  N10  1  0.41368800  0.97109100  0.82893600  1.0
  N  N11  1  0.77763200  0.19521600  0.51442800  1.0