# generated using pymatgen
data_Co4N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03100000
_cell_length_b   4.51400000
_cell_length_c   4.93400000
_cell_angle_alpha   90.00000000
_cell_angle_beta   62.93100000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co4N
_chemical_formula_sum   'Co8 N2'
_cell_volume   99.77667266
_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
  N  N0  1  -0.00000000  0.00000000  0.50000000  1
  N  N1  1  0.00000000  0.50000000  0.00000000  1
  Co  Co2  1  0.38604000  0.66167000  0.86789000  1
  Co  Co3  1  0.61396000  0.33833000  0.13211000  1
  Co  Co4  1  0.61396000  0.16167000  0.63211000  1
  Co  Co5  1  0.38604000  0.83833000  0.36789000  1
  Co  Co6  1  0.85981000  0.82910000  0.88080000  1
  Co  Co7  1  0.14019000  0.17090000  0.11920000  1
  Co  Co8  1  0.14019000  0.32910000  0.61920000  1
  Co  Co9  1  0.85981000  0.67090000  0.38080000  1
