data_GePtAu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.91
_cell_length_b   5.19
_cell_length_c   4.7
_cell_angle_alpha   90.0
_cell_angle_beta   90.12
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GePtAu2
_chemical_formula_sum   'Ge1 Pt1 Au2'
_cell_volume   70.9
_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
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  Pt  Pt3  1  0.45  0.0  0.35  1.0
  Au  Au0  1  0.19  0.59  0.18  1.0
  Au  Au1  1  0.71  0.59  0.52  1.0

data_GePtAu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.91
_cell_length_b   4.7
_cell_length_c   5.19
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GePtAu2
_chemical_formula_sum   'Ge1 Pt1 Au2'
_cell_volume   70.9
_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
  Ge  Ge0  1  0.0  0.0  0.0  1.0
  Pt  Pt1  1  0.55  0.65  0.0  1.0
  Au  Au2  1  0.29  0.48  0.41  1.0
  Au  Au3  1  0.81  0.82  0.41  1.0

Ge Pt Au Au