# generated using pymatgen
data_ZrCo5N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.28200000
_cell_length_b   4.52000000
_cell_length_c   4.51500000
_cell_angle_alpha   90.00000000
_cell_angle_beta   103.71100000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrCo5N
_chemical_formula_sum   'Zr2 Co10 N2'
_cell_volume   164.20101766
_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  0.74956000  0.25000000  1
  N  N1  1  0.00000000  0.25044000  0.75000000  1
  Co  Co2  1  0.23597000  0.65032000  0.35631000  1
  Co  Co3  1  0.76403000  0.34968000  0.64369000  1
  Co  Co4  1  0.76403000  0.65032000  0.14369000  1
  Co  Co5  1  0.23597000  0.34968000  0.85631000  1
  Co  Co6  1  0.63138000  0.88385000  0.66467000  1
  Co  Co7  1  0.36862000  0.11615000  0.33533000  1
  Co  Co8  1  0.36862000  0.88385000  0.83533000  1
  Co  Co9  1  0.63138000  0.11615000  0.16467000  1
  Co  Co10  1  0.50000000  0.59224000  0.25000000  1
  Co  Co11  1  0.50000000  0.40776000  0.75000000  1
  Zr  Zr12  1  -0.00000000  0.23471000  0.25000000  1
  Zr  Zr13  1  0.00000000  0.76529000  0.75000000  1
