data_[Sm12Ag4Ru2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.6007]
_cell_length_b [7.7234]
_cell_length_c [11.9597]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5145]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sm6Ag2Ru]
_chemical_formula_sum '[Sm12 Ag4 Ru2]'
_cell_volume [530.5804]
_cell_formula_units_Z [2]
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
[
  Sm  Sm0  4  0.1235  0.0196  0.2526  1
  Sm  Sm1  4  0.2079  0.6800  0.0617  1
  Sm  Sm2  4  0.3768  0.1794  0.0492  1
  Ag  Ag3  4  0.3269  0.1134  0.7542  1
  Ru  Ru4  2  0.5000  0.0000  0.5000  1
]