data_Li2PNO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   4.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   61.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2PNO2
_chemical_formula_sum   'Li4 P2 N2 O4'
_cell_volume   118.73
_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  0.52  0.87  0.38  1.0
  Li  Li1  1  0.64  0.87  0.38  1.0
  Li  Li2  1  0.64  0.13  0.01  1.0
  Li  Li3  1  0.52  0.13  0.01  1.0
  P  P4  1  0.58  0.84  0.37  1.0
  P  P5  1  0.58  0.16  0.74  1.0
  N  N6  1  0.58  0.38  0.62  1.0
  N  N7  1  0.58  0.62  0.99  1.0
  O  O8  1  0.85  0.67  0.99  1.0
  O  O9  1  0.3  0.67  0.99  1.0
  O  O10  1  0.3  0.33  0.36  1.0
  O  O11  1  0.85  0.33  0.36  1.0

data_Li2PNO2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.75
_cell_length_b   5.33
_cell_length_c   5.33
_cell_angle_alpha   118.37
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2PNO2
_chemical_formula_sum   'Li4 P2 N2 O4'
_cell_volume   118.73
_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  0.62  0.52  0.13  1.0
  Li  Li1  1  0.62  0.64  0.13  1.0
  Li  Li2  1  0.99  0.52  0.87  1.0
  Li  Li3  1  0.99  0.64  0.87  1.0
  P  P4  1  0.26  0.58  0.84  1.0
  P  P5  1  0.63  0.58  0.16  1.0
  N  N6  1  0.01  0.58  0.38  1.0
  N  N7  1  0.38  0.58  0.62  1.0
  O  O8  1  0.01  0.3  0.33  1.0
  O  O9  1  0.01  0.85  0.33  1.0
  O  O10  1  0.64  0.3  0.67  1.0
  O  O11  1  0.64  0.85  0.67  1.0

Li Li Li Li P P N N O O O O