The structure described by LiCN5H2 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a tetrahedral geometry to one N(1), one N(3), one N(4), and one N(5) atom. C(1) is bonded in a trigonal planar geometry to one N(1), one N(3), and one N(4) atom. There are five inequivalent N sites. In the first N site, N(5) is bonded in a distorted trigonal planar geometry to one Li(1), one N(2), and one N(3) atom. In the second N site, N(1) is bonded in a distorted tetrahedral geometry to one Li(1), one C(1), one H(1), and one H(2) atom. In the third N site, N(2) is bonded in a water-like geometry to one N(4) and one N(5) atom. In the fourth N site, N(3) is bonded in a distorted trigonal planar geometry to one Li(1), one C(1), and one N(5) atom. In the fifth N site, N(4) is bonded in a distorted trigonal planar geometry to one Li(1), one C(1), and one N(2) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one N(1) atom. is represented by the CIF card [CIF]
data_LiH2CN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.707
_cell_length_b   4.836
_cell_length_c   7.180
_cell_angle_alpha   76.284
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   361.215
_cell_formula_units_Z   4
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
  Li  Li0  1  0.884  0.795  0.629  1.0
  Li  Li1  1  0.116  0.205  0.371  1.0
  Li  Li2  1  0.384  0.205  0.871  1.0
  Li  Li3  1  0.616  0.795  0.129  1.0
  H  H4  1  0.450  0.814  0.677  1.0
  H  H5  1  0.550  0.186  0.323  1.0
  H  H6  1  0.950  0.186  0.823  1.0
  H  H7  1  0.050  0.814  0.177  1.0
  H  H8  1  0.874  0.909  0.969  1.0
  H  H9  1  0.126  0.091  0.031  1.0
  H  H10  1  0.374  0.091  0.531  1.0
  H  H11  1  0.626  0.909  0.469  1.0
  C  C12  1  0.262  0.781  0.681  1.0
  C  C13  1  0.738  0.219  0.319  1.0
  C  C14  1  0.762  0.219  0.819  1.0
  C  C15  1  0.238  0.781  0.181  1.0
  N  N16  1  0.371  0.937  0.656  1.0
  N  N17  1  0.629  0.063  0.344  1.0
  N  N18  1  0.871  0.063  0.844  1.0
  N  N19  1  0.129  0.937  0.156  1.0
  N  N20  1  0.127  0.455  0.786  1.0
  N  N21  1  0.873  0.545  0.214  1.0
  N  N22  1  0.627  0.545  0.714  1.0
  N  N23  1  0.373  0.455  0.286  1.0
  N  N24  1  0.151  0.885  0.609  1.0
  N  N25  1  0.849  0.115  0.391  1.0
  N  N26  1  0.651  0.115  0.891  1.0
  N  N27  1  0.349  0.885  0.109  1.0
  N  N28  1  0.250  0.514  0.790  1.0
  N  N29  1  0.750  0.486  0.210  1.0
  N  N30  1  0.750  0.486  0.710  1.0
  N  N31  1  0.250  0.514  0.290  1.0
  N  N32  1  0.068  0.674  0.679  1.0
  N  N33  1  0.932  0.326  0.321  1.0
  N  N34  1  0.568  0.326  0.821  1.0
  N  N35  1  0.432  0.674  0.179  1.0
[/CIF]
.
The structure described by LiCN5H2 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a tetrahedral geometry to one N(1), one N(3), one N(4), and one N(5) atom. C(1) is bonded in a trigonal planar geometry to one N(1), one N(3), and one N(4) atom. There are five inequivalent N sites. In the first N site, N(5) is bonded in a distorted trigonal planar geometry to one Li(1), one N(2), and one N(3) atom. In the second N site, N(1) is bonded in a distorted tetrahedral geometry to one Li(1), one C(1), one H(1), and one H(2) atom. In the third N site, N(2) is bonded in a water-like geometry to one N(4) and one N(5) atom. In the fourth N site, N(3) is bonded in a distorted trigonal planar geometry to one Li(1), one C(1), and one N(5) atom. In the fifth N site, N(4) is bonded in a distorted trigonal planar geometry to one Li(1), one C(1), and one N(2) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one N(1) atom. is represented by the CIF card [CIF]
data_LiH2CN5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.707
_cell_length_b   4.836
_cell_length_c   7.180
_cell_angle_alpha   76.284
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   361.215
_cell_formula_units_Z   4
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
  Li  Li0  1  0.884  0.795  0.629  1.0
  Li  Li1  1  0.116  0.205  0.371  1.0
  Li  Li2  1  0.384  0.205  0.871  1.0
  Li  Li3  1  0.616  0.795  0.129  1.0
  H  H4  1  0.450  0.814  0.677  1.0
  H  H5  1  0.550  0.186  0.323  1.0
  H  H6  1  0.950  0.186  0.823  1.0
  H  H7  1  0.050  0.814  0.177  1.0
  H  H8  1  0.874  0.909  0.969  1.0
  H  H9  1  0.126  0.091  0.031  1.0
  H  H10  1  0.374  0.091  0.531  1.0
  H  H11  1  0.626  0.909  0.469  1.0
  C  C12  1  0.262  0.781  0.681  1.0
  C  C13  1  0.738  0.219  0.319  1.0
  C  C14  1  0.762  0.219  0.819  1.0
  C  C15  1  0.238  0.781  0.181  1.0
  N  N16  1  0.371  0.937  0.656  1.0
  N  N17  1  0.629  0.063  0.344  1.0
  N  N18  1  0.871  0.063  0.844  1.0
  N  N19  1  0.129  0.937  0.156  1.0
  N  N20  1  0.127  0.455  0.786  1.0
  N  N21  1  0.873  0.545  0.214  1.0
  N  N22  1  0.627  0.545  0.714  1.0
  N  N23  1  0.373  0.455  0.286  1.0
  N  N24  1  0.151  0.885  0.609  1.0
  N  N25  1  0.849  0.115  0.391  1.0
  N  N26  1  0.651  0.115  0.891  1.0
  N  N27  1  0.349  0.885  0.109  1.0
  N  N28  1  0.250  0.514  0.790  1.0
  N  N29  1  0.750  0.486  0.210  1.0
  N  N30  1  0.750  0.486  0.710  1.0
  N  N31  1  0.250  0.514  0.290  1.0
  N  N32  1  0.068  0.674  0.679  1.0
  N  N33  1  0.932  0.326  0.321  1.0
  N  N34  1  0.568  0.326  0.821  1.0
  N  N35  1  0.432  0.674  0.179  1.0
[/CIF]
.