data_FeBRu2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.7
_cell_length_b   3.45
_cell_length_c   5.06
_cell_angle_alpha   90.0
_cell_angle_beta   103.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeBRu2
_chemical_formula_sum   'Fe1 B1 Ru2'
_cell_volume   45.84
_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
  Fe  Fe1  1  0.42  0.0  0.46  1.0
  B  B0  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.84  0.73  0.79  1.0
  Ru  Ru3  1  0.69  0.73  0.13  1.0

data_FeBRu2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.7
_cell_length_b   3.45
_cell_length_c   5.06
_cell_angle_alpha   90.0
_cell_angle_beta   103.27
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeBRu2
_chemical_formula_sum   'Fe1 B1 Ru2'
_cell_volume   45.84
_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
  Fe  Fe0  1  0.42  0.0  0.46  1.0
  B  B1  1  0.0  0.0  0.0  1.0
  Ru  Ru2  1  0.69  0.73  0.13  1.0
  Ru  Ru3  1  0.84  0.73  0.79  1.0

Fe B Ru Ru