The structure described by LaNiBN crystallizes in the tetragonal P4/nmm space group. La(1) is bonded to five equivalent N(1) atoms to form a mixture of distorted corner and edge-sharing LaN5 square pyramids. Ni(1) is bonded in a 4-coordinate geometry to four equivalent B(1) atoms. B(1) is bonded in a single-bond geometry to four equivalent Ni(1) and one N(1) atom. N(1) is bonded to five equivalent La(1) and one B(1) atom to form a mixture of distorted corner and edge-sharing NLa5B octahedra. The corner-sharing octahedral tilt angles are 3°. is represented by the CIF card [CIF]
data_LaNiBN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.780
_cell_length_b   3.780
_cell_length_c   7.307
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   104.384
_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
  La  La0  1  0.500  0.000  0.178  1.0
  La  La1  1  0.000  0.500  0.822  1.0
  Ni  Ni2  1  0.500  0.500  0.500  1.0
  Ni  Ni3  1  0.000  0.000  0.500  1.0
  B  B4  1  0.500  0.000  0.634  1.0
  B  B5  1  0.000  0.500  0.366  1.0
  N  N6  1  0.000  0.500  0.168  1.0
  N  N7  1  0.500  0.000  0.832  1.0
[/CIF]
.
The structure described by LaNiBN crystallizes in the tetragonal P4/nmm space group. La(1) is bonded to five equivalent N(1) atoms to form a mixture of distorted corner and edge-sharing LaN5 square pyramids. Ni(1) is bonded in a 4-coordinate geometry to four equivalent B(1) atoms. B(1) is bonded in a single-bond geometry to four equivalent Ni(1) and one N(1) atom. N(1) is bonded to five equivalent La(1) and one B(1) atom to form a mixture of distorted corner and edge-sharing NLa5B octahedra. The corner-sharing octahedral tilt angles are 3°. is represented by the CIF card [CIF]
data_LaNiBN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.780
_cell_length_b   3.780
_cell_length_c   7.307
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   104.384
_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
  La  La0  1  0.500  0.000  0.178  1.0
  La  La1  1  0.000  0.500  0.822  1.0
  Ni  Ni2  1  0.500  0.500  0.500  1.0
  Ni  Ni3  1  0.000  0.000  0.500  1.0
  B  B4  1  0.500  0.000  0.634  1.0
  B  B5  1  0.000  0.500  0.366  1.0
  N  N6  1  0.000  0.500  0.168  1.0
  N  N7  1  0.500  0.000  0.832  1.0
[/CIF]
.