The crystal structure described by YbCN3H3 crystallizes in the hexagonal P6_3/m space group. Yb(1) is bonded to six equivalent N(1) atoms to form face-sharing YbN6 octahedra. C(1) is bonded in a trigonal planar geometry to three equivalent N(1) atoms. N(1) is bonded in a 4-coordinate geometry to two equivalent Yb(1), one C(1), and one H(1) atom. H(1) is bonded in a single-bond geometry to one N(1) atom. is represented by the CIF file [CIF]
data_YbH3CN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.210
_cell_length_b   5.210
_cell_length_c   6.560
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   154.223
_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
  Yb  Yb0  1  0.000  0.000  0.500  1.0
  Yb  Yb1  1  0.000  0.000  0.000  1.0
  H  H2  1  0.091  0.563  0.750  1.0
  H  H3  1  0.437  0.528  0.750  1.0
  H  H4  1  0.472  0.909  0.750  1.0
  H  H5  1  0.909  0.437  0.250  1.0
  H  H6  1  0.563  0.472  0.250  1.0
  H  H7  1  0.528  0.091  0.250  1.0
  C  C8  1  0.667  0.333  0.750  1.0
  C  C9  1  0.333  0.667  0.250  1.0
  N  N10  1  0.919  0.604  0.750  1.0
  N  N11  1  0.396  0.315  0.750  1.0
  N  N12  1  0.685  0.081  0.750  1.0
  N  N13  1  0.081  0.396  0.250  1.0
  N  N14  1  0.604  0.685  0.250  1.0
  N  N15  1  0.315  0.919  0.250  1.0
[/CIF]
.
The crystal structure described by YbCN3H3 crystallizes in the hexagonal P6_3/m space group. Yb(1) is bonded to six equivalent N(1) atoms to form face-sharing YbN6 octahedra. C(1) is bonded in a trigonal planar geometry to three equivalent N(1) atoms. N(1) is bonded in a 4-coordinate geometry to two equivalent Yb(1), one C(1), and one H(1) atom. H(1) is bonded in a single-bond geometry to one N(1) atom. is represented by the CIF file [CIF]
data_YbH3CN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.210
_cell_length_b   5.210
_cell_length_c   6.560
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   154.223
_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
  Yb  Yb0  1  0.000  0.000  0.500  1.0
  Yb  Yb1  1  0.000  0.000  0.000  1.0
  H  H2  1  0.091  0.563  0.750  1.0
  H  H3  1  0.437  0.528  0.750  1.0
  H  H4  1  0.472  0.909  0.750  1.0
  H  H5  1  0.909  0.437  0.250  1.0
  H  H6  1  0.563  0.472  0.250  1.0
  H  H7  1  0.528  0.091  0.250  1.0
  C  C8  1  0.667  0.333  0.750  1.0
  C  C9  1  0.333  0.667  0.250  1.0
  N  N10  1  0.919  0.604  0.750  1.0
  N  N11  1  0.396  0.315  0.750  1.0
  N  N12  1  0.685  0.081  0.750  1.0
  N  N13  1  0.081  0.396  0.250  1.0
  N  N14  1  0.604  0.685  0.250  1.0
  N  N15  1  0.315  0.919  0.250  1.0
[/CIF]
.