data_Fe2RuPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21
_cell_length_b   5.21
_cell_length_c   5.21
_cell_angle_alpha   143.91
_cell_angle_beta   130.31
_cell_angle_gamma   62.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2RuPb
_chemical_formula_sum   'Fe2 Ru1 Pb1'
_cell_volume   62.83
_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  0.0  0.19  0.32  1.0
  Fe  Fe1  1  0.61  0.0  0.13  1.0
  Ru  Ru3  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.0  0.0  0.44  1.0

data_Fe2RuPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   4.38
_cell_length_c   5.21
_cell_angle_alpha   114.84
_cell_angle_beta   108.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2RuPb
_chemical_formula_sum   'Fe2 Ru1 Pb1'
_cell_volume   62.83
_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  0.0  0.13  0.51  1.0
  Fe  Fe1  1  0.81  0.13  0.13  1.0
  Ru  Ru2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.0  0.44  0.44  1.0

Fe Fe Ru Pb
Fe Fe Ru Pb 0 2 o o o 0 3 o o o 1 3 + o o 