data_InHg2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.56
_cell_length_b   5.56
_cell_length_c   5.56
_cell_angle_alpha   136.97
_cell_angle_beta   136.97
_cell_angle_gamma   62.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InHg2Ru
_chemical_formula_sum   'In1 Hg2 Ru1'
_cell_volume   78.87
_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
  In  In2  1  0.0  0.0  0.75  1.0
  Hg  Hg0  1  0.04  0.0  0.37  1.0
  Hg  Hg1  1  0.0  0.04  0.37  1.0
  Ru  Ru3  1  0.0  0.0  0.0  1.0

data_InHg2Ru
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.76
_cell_length_b   5.76
_cell_length_c   5.56
_cell_angle_alpha   90.0
_cell_angle_beta   121.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   InHg2Ru
_chemical_formula_sum   'In2 Hg4 Ru2'
_cell_volume   157.73
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  In  In0  2  0.25  0.0  0.25  1.0
  Hg  Hg1  4  0.14  0.48  0.66  1.0
  Ru  Ru2  2  0.0  0.0  0.0  1.0

In Hg Hg Ru
In Hg Hg Ru 0 3 o o + 1 2 o o o 