data_LiGe2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   5.23
_cell_length_c   5.23
_cell_angle_alpha   140.39
_cell_angle_beta   129.65
_cell_angle_gamma   65.89
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGe2P
_chemical_formula_sum   'Li1 Ge2 P1'
_cell_volume   69.15
_cell_formula_units_Z   1
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  Li2  1  0.0  0.0  0.29  1.0
  Ge  Ge0  1  0.0  0.0  0.2  1.0
  Ge  Ge1  1  0.0  0.22  0.18  1.0
  P  P3  1  0.77  0.0  0.11  1.0

data_LiGe2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   4.45
_cell_length_c   5.23
_cell_angle_alpha   115.18
_cell_angle_beta   109.81
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGe2P
_chemical_formula_sum   'Li1 Ge2 P1'
_cell_volume   69.15
_cell_formula_units_Z   1
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  0.71  0.71  0.71  1.0
  Ge  Ge1  1  0.8  0.8  0.8  1.0
  Ge  Ge2  1  0.82  0.05  0.05  1.0
  P  P3  1  0.67  0.89  0.67  1.0

Li Ge Ge P
Li Ge Ge P 0 1 o o o 0 3 - o o 1 2 o o o 1 3 - o o 