data_Ge2OsPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.93
_cell_length_b   4.93
_cell_length_c   3.03
_cell_angle_alpha   105.51
_cell_angle_beta   105.51
_cell_angle_gamma   105.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2OsPd
_chemical_formula_sum   'Ge2 Os1 Pd1'
_cell_volume   63.86
_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  0.83  0.04  0.36  1.0
  Ge  Ge1  1  0.83  0.96  0.36  1.0
  Os  Os2  1  0.99  0.0  0.0  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

data_Ge2OsPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   4.93
_cell_length_c   4.93
_cell_angle_alpha   105.41
_cell_angle_beta   105.51
_cell_angle_gamma   105.51
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ge2OsPd
_chemical_formula_sum   'Ge2 Os1 Pd1'
_cell_volume   63.86
_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  0.36  0.83  0.96  1.0
  Ge  Ge1  1  0.36  0.83  0.04  1.0
  Pd  Pd2  1  0.0  0.0  0.0  1.0
  Os  Os3  1  0.0  0.99  0.0  1.0

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