data_[Co4Ni6B4N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Co  1.8800  1.3500  0.7683
  Ni  1.9100  1.3500  0.7400
  B  2.0400  0.8500  0.4100
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [15.5494]
_cell_length_b [3.0682]
_cell_length_c [3.9233]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.2058]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Co2Ni3B2N3]
_chemical_formula_sum '[Co4 Ni6 B4 N6]'
_cell_volume [185.2565]
_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
[
  Co  Co0  2  0.2317  0.0000  0.7686  1
  Co  Co1  2  0.2579  0.5000  0.2946  1
  Ni  Ni2  2  0.0111  0.0000  0.1384  1
  Ni  Ni3  2  0.1046  0.5000  0.5758  1
  Ni  Ni4  2  0.3878  0.0000  0.5385  1
  B  B5  2  0.1715  0.0000  0.2312  1
  B  B6  2  0.3184  0.5000  0.8633  1
  N  N7  2  0.1166  0.0000  0.8943  1
  N  N8  2  0.4081  0.5000  0.8203  1
  N  N9  2  0.4915  0.0000  0.3751  1
]