data_LiP3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.93
_cell_length_b   10.93
_cell_length_c   10.93
_cell_angle_alpha   161.62
_cell_angle_beta   161.62
_cell_angle_gamma   26.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiP3
_chemical_formula_sum   'Li2 P6'
_cell_volume   129.69
_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  0.84  1.0
  Li  Li1  1  0.0  0.0  0.45  1.0
  P  P2  1  0.0  0.75  0.0  1.0
  P  P3  1  0.75  0.0  0.0  1.0
  P  P4  1  0.75  0.0  0.32  1.0
  P  P5  1  0.0  0.75  0.32  1.0
  P  P6  1  0.0  0.0  0.56  1.0
  P  P7  1  0.0  0.0  0.73  1.0

data_LiP3
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.94
_cell_length_b   4.94
_cell_length_c   10.93
_cell_angle_alpha   90.0
_cell_angle_beta   103.05
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiP3
_chemical_formula_sum   'Li4 P12'
_cell_volume   259.38
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.16  1.0
  Li  Li1  2  0.0  0.0  0.55  1.0
  P  P2  4  0.37  0.37  0.42  1.0
  P  P3  4  0.37  0.37  0.75  1.0
  P  P4  2  0.0  0.0  0.27  1.0
  P  P5  2  0.0  0.0  0.44  1.0

Li Li P P P P P P