data_LiNbP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.5
_cell_length_b   3.5
_cell_length_c   12.31
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbP2
_chemical_formula_sum   'Li2 Nb2 P4'
_cell_volume   130.73
_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  0.0  0.0  0.15  1.0
  Li  Li1  1  0.0  0.0  0.0  1.0
  Nb  Nb2  1  0.0  0.0  0.23  1.0
  Nb  Nb3  1  0.0  0.0  0.08  1.0
  P  P4  1  0.0  0.02  0.72  1.0
  P  P5  1  0.75  0.01  0.57  1.0
  P  P6  1  0.75  0.01  0.59  1.0
  P  P7  1  0.0  0.02  0.74  1.0

data_LiNbP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   3.5
_cell_length_c   12.31
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNbP2
_chemical_formula_sum   'Li2 Nb2 P4'
_cell_volume   130.73
_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  0.0  0.0  0.0  1.0
  Li  Li1  1  0.0  0.0  0.15  1.0
  Nb  Nb2  1  0.0  0.0  0.08  1.0
  Nb  Nb3  1  0.0  0.0  0.23  1.0
  P  P4  1  0.0  0.02  0.72  1.0
  P  P5  1  0.0  0.02  0.74  1.0
  P  P6  1  0.75  0.01  0.57  1.0
  P  P7  1  0.75  0.01  0.59  1.0

Li Li Nb Nb P P P P