data_AlMoRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89
_cell_length_b   4.89
_cell_length_c   4.4
_cell_angle_alpha   107.92
_cell_angle_beta   107.92
_cell_angle_gamma   35.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlMoRu2
_chemical_formula_sum   'Al1 Mo1 Ru2'
_cell_volume   58.45
_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
  Al  Al0  1  0.96  0.0  0.87  1.0
  Mo  Mo1  1  0.22  0.0  0.33  1.0
  Ru  Ru2  1  0.91  0.0  0.94  1.0
  Ru  Ru3  1  0.6  0.0  0.27  1.0

data_AlMoRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   4.4
_cell_length_c   4.89
_cell_angle_alpha   107.92
_cell_angle_beta   107.99
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlMoRu2
_chemical_formula_sum   'Al1 Mo1 Ru2'
_cell_volume   58.45
_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
  Al  Al0  1  0.0  0.87  0.96  1.0
  Mo  Mo1  1  0.0  0.33  0.22  1.0
  Ru  Ru2  1  0.0  0.27  0.6  1.0
  Ru  Ru3  1  0.0  0.94  0.91  1.0

Al Mo Ru Ru
Al Mo Ru Ru 0 2 o o o 0 1 + o + 1 2 - o - 1 3 o o o 