The compound described by LiPN2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. Li(1) is bonded to four equivalent N(1) atoms to form distorted LiN4 tetrahedra that share corners with four equivalent Li(1)N4 tetrahedra and corners with eight equivalent P(1)N4 tetrahedra. P(1) is bonded to four equivalent N(1) atoms to form PN4 tetrahedra that share corners with four equivalent P(1)N4 tetrahedra and corners with eight equivalent Li(1)N4 tetrahedra. N(1) is bonded to two equivalent Li(1) and two equivalent P(1) atoms to form distorted corner-sharing NLi2P2 trigonal pyramids. is represented by the CIF file [CIF]
data_LiPN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.524
_cell_length_b   4.524
_cell_length_c   4.820
_cell_angle_alpha   117.986
_cell_angle_beta   117.986
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   73.793
_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
  Li  Li0  1  0.500  0.500  0.000  1.0
  Li  Li1  1  0.750  0.250  0.500  1.0
  P  P2  1  0.000  0.000  0.000  1.0
  P  P3  1  0.250  0.750  0.500  1.0
  N  N4  1  0.293  0.375  0.250  1.0
  N  N5  1  0.957  0.875  0.250  1.0
  N  N6  1  0.125  0.707  0.750  1.0
  N  N7  1  0.625  0.043  0.750  1.0
[/CIF]
.
The compound described by LiPN2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. Li(1) is bonded to four equivalent N(1) atoms to form distorted LiN4 tetrahedra that share corners with four equivalent Li(1)N4 tetrahedra and corners with eight equivalent P(1)N4 tetrahedra. P(1) is bonded to four equivalent N(1) atoms to form PN4 tetrahedra that share corners with four equivalent P(1)N4 tetrahedra and corners with eight equivalent Li(1)N4 tetrahedra. N(1) is bonded to two equivalent Li(1) and two equivalent P(1) atoms to form distorted corner-sharing NLi2P2 trigonal pyramids. is represented by the CIF file [CIF]
data_LiPN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.524
_cell_length_b   4.524
_cell_length_c   4.820
_cell_angle_alpha   117.986
_cell_angle_beta   117.986
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   73.793
_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
  Li  Li0  1  0.500  0.500  0.000  1.0
  Li  Li1  1  0.750  0.250  0.500  1.0
  P  P2  1  0.000  0.000  0.000  1.0
  P  P3  1  0.250  0.750  0.500  1.0
  N  N4  1  0.293  0.375  0.250  1.0
  N  N5  1  0.957  0.875  0.250  1.0
  N  N6  1  0.125  0.707  0.750  1.0
  N  N7  1  0.625  0.043  0.750  1.0
[/CIF]
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