data_[Sm3Dy1Tm6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4687]
_cell_length_b [6.4783]
_cell_length_c [9.4395]
_cell_angle_alpha [89.9574]
_cell_angle_beta [70.3265]
_cell_angle_gamma [60.3152]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sm3DyTm6]
_chemical_formula_sum '[Sm3 Dy1 Tm6]'
_cell_volume [316.8682]
_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
[
  Sm  Sm0  2  0.3012  0.5576  0.6910  1
  Sm  Sm1  1  0.0000  0.0000  0.0000  1
  Dy  Dy2  1  0.0000  0.5000  0.5000  1
  Tm  Tm3  2  0.1262  0.8677  0.3133  1
  Tm  Tm4  2  0.3043  0.3489  0.0514  1
  Tm  Tm5  2  0.4477  0.9911  0.6865  1
]