data_[Sm4Re6B10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Re  1.9000  1.3500  0.7125
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [10.6890]
_cell_length_b [4.1130]
_cell_length_c [8.2348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.1614]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Sm2Re3B5]
_chemical_formula_sum '[Sm4 Re6 B10]'
_cell_volume [292.2952]
_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  0.1632  0.7691  0.2586  1.0
  Re  Re1  4  0.1319  0.2530  0.9007  1.0
  Re  Re2  2  0.0000  0.9979  0.5000  1.0
  B  B3  4  0.0239  0.4998  0.6166  1.0
  B  B4  4  0.1388  0.7652  0.8095  1.0
  B  B5  2  0.0000  0.2718  0.0000  1.0
]