data_[Sm6Co2Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Co  1.8800  1.3500  0.7683
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3877]
_cell_length_b [3.8918]
_cell_length_c [8.4796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.9580]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Sm3CoAu]
_chemical_formula_sum '[Sm6 Co2 Au2]'
_cell_volume [261.7855]
_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  0.0542  0.7500  0.2388  1.0
  Sm  Sm1  2  0.3174  0.7500  0.9642  1.0
  Sm  Sm2  2  0.3312  0.2500  0.6046  1.0
  Co  Co3  2  0.0620  0.7500  0.5771  1.0
  Au  Au4  2  0.3558  0.2500  0.2441  1.0
]