The crystal structure described by BC2N is Chalcopyrite-like structured and crystallizes in the tetragonal P-4m2 space group. B(1) is bonded to four equivalent C(1) atoms to form BC4 tetrahedra that share corners with four equivalent B(1)C4 tetrahedra and corners with eight equivalent N(1)C4 tetrahedra. C(1) is bonded to two equivalent B(1) and two equivalent N(1) atoms to form corner-sharing CB2N2 tetrahedra. N(1) is bonded to four equivalent C(1) atoms to form NC4 tetrahedra that share corners with four equivalent N(1)C4 tetrahedra and corners with eight equivalent B(1)C4 tetrahedra. is represented by the CIF card [CIF]
data_BC2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.569
_cell_length_b   2.569
_cell_length_c   3.676
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   24.250
_cell_formula_units_Z   1
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
  B  B0  1  0.500  0.500  0.500  1.0
  C  C1  1  0.500  0.000  0.248  1.0
  C  C2  1  0.000  0.500  0.752  1.0
  N  N3  1  0.000  0.000  0.000  1.0
[/CIF]
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The crystal structure described by BC2N is Chalcopyrite-like structured and crystallizes in the tetragonal P-4m2 space group. B(1) is bonded to four equivalent C(1) atoms to form BC4 tetrahedra that share corners with four equivalent B(1)C4 tetrahedra and corners with eight equivalent N(1)C4 tetrahedra. C(1) is bonded to two equivalent B(1) and two equivalent N(1) atoms to form corner-sharing CB2N2 tetrahedra. N(1) is bonded to four equivalent C(1) atoms to form NC4 tetrahedra that share corners with four equivalent N(1)C4 tetrahedra and corners with eight equivalent B(1)C4 tetrahedra. is represented by the CIF card [CIF]
data_BC2N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.569
_cell_length_b   2.569
_cell_length_c   3.676
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   24.250
_cell_formula_units_Z   1
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
  B  B0  1  0.500  0.500  0.500  1.0
  C  C1  1  0.500  0.000  0.248  1.0
  C  C2  1  0.000  0.500  0.752  1.0
  N  N3  1  0.000  0.000  0.000  1.0
[/CIF]
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