data_MgReGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78
_cell_length_b   2.78
_cell_length_c   9.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   108.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgReGe2
_chemical_formula_sum   'Mg1 Re1 Ge2'
_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
  Mg  Mg2  1  0.0  0.0  0.71  1.0
  Re  Re3  1  0.62  0.0  0.43  1.0
  Ge  Ge0  1  0.0  0.0  0.34  1.0
  Ge  Ge1  1  0.62  0.0  0.14  1.0

data_MgReGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   2.78
_cell_length_c   9.75
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   108.5
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgReGe2
_chemical_formula_sum   'Mg1 Re1 Ge2'
_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
  Mg  Mg0  1  0.0  0.0  0.71  1.0
  Re  Re1  1  0.62  0.0  0.43  1.0
  Ge  Ge2  1  0.0  0.0  0.34  1.0
  Ge  Ge3  1  0.62  0.0  0.14  1.0

Mg Re Ge Ge