data_[Sm2Cd10Au14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [5.8019]
_cell_length_b [10.2812]
_cell_length_c [9.3364]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [SmCd5Au7]
_chemical_formula_sum '[Sm2 Cd10 Au14]'
_cell_volume [556.9170]
_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  2  0.0000  0.0000  0.9968  1.0
  Cd  Cd1  8  0.2494  0.2550  0.2510  1.0
  Cd  Cd2  2  0.0000  0.5000  0.7769  1.0
  Au  Au3  4  0.0000  0.3064  0.9996  1.0
  Au  Au4  4  0.0000  0.3550  0.5037  1.0
  Au  Au5  2  0.0000  0.0000  0.3286  1.0
  Au  Au6  2  0.0000  0.0000  0.6628  1.0
  Au  Au7  2  0.0000  0.5000  0.2241  1.0
]