data_Cr2GeAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.73
_cell_length_b   2.73
_cell_length_c   8.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2GeAu
_chemical_formula_sum   'Cr2 Ge1 Au1'
_cell_volume   60.42
_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
  Cr  Cr1  1  0.0  0.0  0.44  1.0
  Cr  Cr2  1  0.52  0.0  0.77  1.0
  Ge  Ge3  1  0.0  0.0  0.67  1.0
  Au  Au0  1  0.52  0.0  1.0  1.0

data_Cr2GeAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   2.73
_cell_length_c   8.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   112.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2GeAu
_chemical_formula_sum   'Cr2 Ge1 Au1'
_cell_volume   60.42
_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
  Cr  Cr0  1  0.0  0.0  0.44  1.0
  Cr  Cr1  1  0.52  0.0  0.77  1.0
  Ge  Ge2  1  0.0  0.0  0.67  1.0
  Au  Au3  1  0.52  0.0  1.0  1.0

Cr Cr Ge Au