data_Li3Ge2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.19
_cell_length_b   11.25
_cell_length_c   3.78
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ge2P
_chemical_formula_sum   'Li12 Ge8 P4'
_cell_volume   433.66
_cell_formula_units_Z   4
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  Li8  1  0.06  0.63  0.0  1.0
  Li  Li9  1  0.13  0.63  0.0  1.0
  Li  Li10  1  0.03  0.0  0.89  1.0
  Li  Li11  1  0.16  0.25  0.89  1.0
  Li  Li12  1  0.05  0.52  0.0  1.0
  Li  Li13  1  0.14  0.73  0.0  1.0
  Li  Li14  1  0.05  0.9  0.89  1.0
  Li  Li15  1  0.15  0.35  0.89  1.0
  Li  Li16  1  0.13  0.11  0.0  1.0
  Li  Li17  1  0.06  0.14  0.0  1.0
  Li  Li18  1  0.16  0.49  0.89  1.0
  Li  Li19  1  0.03  0.77  0.89  1.0
  Ge  Ge0  1  0.13  0.56  0.0  1.0
  Ge  Ge1  1  0.06  0.69  0.0  1.0
  Ge  Ge2  1  0.97  0.19  0.89  1.0
  Ge  Ge3  1  0.22  0.07  0.89  1.0
  Ge  Ge4  1  0.3  0.94  0.0  1.0
  Ge  Ge5  1  0.89  0.31  0.0  1.0
  Ge  Ge6  1  0.8  0.32  0.89  1.0
  Ge  Ge7  1  0.39  0.94  0.89  1.0
  P  P20  1  0.79  0.63  0.0  1.0
  P  P21  1  0.4  0.63  0.0  1.0
  P  P22  1  0.5  1.0  0.89  1.0
  P  P23  1  0.69  0.25  0.89  1.0

data_Li3Ge2P
_symmetry_space_group_name_H-M   P2
_cell_length_a   10.19
_cell_length_b   3.78
_cell_length_c   11.25
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   3
_chemical_formula_structural   Li3Ge2P
_chemical_formula_sum   'Li12 Ge8 P4'
_cell_volume   433.66
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.03  0.0  0.5  1.0
  Li  Li1  2  0.03  0.0  0.99  1.0
  Li  Li2  2  0.05  0.0  0.6  1.0
  Li  Li3  2  0.05  0.11  0.23  1.0
  Li  Li4  2  0.06  0.11  0.36  1.0
  Li  Li5  2  0.06  0.11  0.13  1.0
  Ge  Ge6  2  0.03  0.0  0.43  1.0
  Ge  Ge7  2  0.13  0.11  0.94  1.0
  Ge  Ge8  2  0.2  0.0  0.82  1.0
  Ge  Ge9  2  0.3  0.11  0.81  1.0
  P  P10  2  0.31  0.0  0.5  1.0
  P  P11  2  0.4  0.11  0.87  1.0

Li Li Li Li Li Li Li Li Li Li Li Li Ge Ge Ge Ge Ge Ge Ge Ge P P P P