data_GaGe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.2
_cell_length_b   3.84
_cell_length_c   5.96
_cell_angle_alpha   90.0
_cell_angle_beta   103.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaGe2Pd
_chemical_formula_sum   'Ga1 Ge2 Pd1'
_cell_volume   71.28
_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
  Ga  Ga0  1  0.45  0.0  0.05  1.0
  Ge  Ge1  1  0.08  0.92  0.08  1.0
  Ge  Ge2  1  0.72  0.0  0.31  1.0
  Pd  Pd3  1  0.05  0.92  0.24  1.0

data_GaGe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.2
_cell_length_b   3.84
_cell_length_c   5.96
_cell_angle_alpha   90.0
_cell_angle_beta   103.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaGe2Pd
_chemical_formula_sum   'Ga1 Ge2 Pd1'
_cell_volume   71.28
_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
  Ga  Ga0  1  0.45  0.0  0.05  1.0
  Ge  Ge1  1  0.08  0.92  0.08  1.0
  Ge  Ge2  1  0.72  0.0  0.31  1.0
  Pd  Pd3  1  0.05  0.92  0.24  1.0

Ga Ge Ge Pd
Ga Ge Ge Pd 0 1 o - o 1 3 o o o 2 3 + - o 