data_LiGeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.44
_cell_length_b   5.44
_cell_length_c   5.44
_cell_angle_alpha   145.8
_cell_angle_beta   132.92
_cell_angle_gamma   59.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGeP2
_chemical_formula_sum   'Li1 Ge1 P2'
_cell_volume   65.6
_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  Li1  1  0.0  0.0  0.15  1.0
  Ge  Ge0  1  0.6  0.0  0.36  1.0
  P  P2  1  0.6  0.0  0.5  1.0
  P  P3  1  0.0  0.0  0.16  1.0

data_LiGeP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   4.34
_cell_length_c   5.44
_cell_angle_alpha   113.54
_cell_angle_beta   107.1
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiGeP2
_chemical_formula_sum   'Li1 Ge1 P2'
_cell_volume   65.6
_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  0.0  0.15  0.15  1.0
  Ge  Ge1  1  0.0  0.36  0.76  1.0
  P  P2  1  0.0  0.16  0.16  1.0
  P  P3  1  0.0  0.5  0.9  1.0

Li Ge P P