data_In2MoRu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34
_cell_length_b   5.34
_cell_length_c   4.85
_cell_angle_alpha   106.8
_cell_angle_beta   106.8
_cell_angle_gamma   33.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2MoRu
_chemical_formula_sum   'In2 Mo1 Ru1'
_cell_volume   72.18
_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  0.66  0.0  0.43  1.0
  In  In1  1  0.38  0.0  0.34  1.0
  Mo  Mo2  1  0.61  0.0  0.24  1.0
  Ru  Ru3  1  0.25  0.0  0.55  1.0

data_In2MoRu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.06
_cell_length_b   4.85
_cell_length_c   5.34
_cell_angle_alpha   106.8
_cell_angle_beta   106.64
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2MoRu
_chemical_formula_sum   'In2 Mo1 Ru1'
_cell_volume   72.18
_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  0.34  0.38  1.0
  In  In1  1  0.0  0.43  0.66  1.0
  Mo  Mo2  1  0.0  0.24  0.61  1.0
  Ru  Ru3  1  0.0  0.55  0.25  1.0

In In Mo Ru