data_InNiRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   2.78
_cell_angle_alpha   103.45
_cell_angle_beta   103.45
_cell_angle_gamma   120.47
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InNiRu2
_chemical_formula_sum   'In1 Ni1 Ru2'
_cell_volume   60.21
_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  In0  1  0.65  0.0  0.0  1.0
  Ni  Ni1  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.67  0.31  0.23  1.0
  Ru  Ru3  1  0.67  0.69  0.23  1.0

data_InNiRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.78
_cell_length_b   4.69
_cell_length_c   5.33
_cell_angle_alpha   115.01
_cell_angle_beta   103.45
_cell_angle_gamma   93.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InNiRu2
_chemical_formula_sum   'In1 Ni1 Ru2'
_cell_volume   60.21
_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  In0  1  0.0  0.0  0.65  1.0
  Ni  Ni1  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.54  0.31  0.99  1.0
  Ru  Ru3  1  0.91  0.69  0.36  1.0

In Ni Ru Ru