data_HgGe2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.0
_cell_length_b   3.34
_cell_length_c   7.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgGe2Rh
_chemical_formula_sum   'Hg1 Ge2 Rh1'
_cell_volume   75.44
_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
  Hg  Hg2  1  0.5  0.67  0.0  1.0
  Ge  Ge0  1  0.5  0.67  0.25  1.0
  Ge  Ge1  1  0.0  0.0  0.51  1.0
  Rh  Rh3  1  0.0  0.0  0.06  1.0

data_HgGe2Rh
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.34
_cell_length_b   3.0
_cell_length_c   7.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   HgGe2Rh
_chemical_formula_sum   'Hg1 Ge2 Rh1'
_cell_volume   75.44
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Hg  Hg0  1  0.67  0.0  0.0  1.0
  Ge  Ge1  1  0.0  0.5  0.51  1.0
  Ge  Ge2  1  0.67  0.0  0.25  1.0
  Rh  Rh3  1  0.0  0.5  0.06  1.0

Hg Ge Ge Rh
Hg Ge Ge Rh 0 3 o + o 0 3 + + o 0 1 o o o 1 2 + + o 1 2 + o o 1 2 o + o 1 2 o o o 2 2 + o o 2 2 o + o 2 3 o o o 