data_[Nd2Sm4Y12Tm6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.2003]
_cell_length_b [10.7211]
_cell_length_c [11.8379]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0339]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdSm2(Y2Tm)3]
_chemical_formula_sum '[Nd2 Sm4 Y12 Tm6]'
_cell_volume [774.8715]
_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
[
  Nd  Nd0  2  0.0000  0.0000  0.0000  1.0
  Sm  Sm1  4  0.0000  0.3334  0.0000  1.0
  Y  Y2  8  0.2483  0.3332  0.7460  1.0
  Y  Y3  4  0.2486  0.0000  0.7459  1.0
  Tm  Tm4  4  0.0000  0.1668  0.5000  1.0
  Tm  Tm5  2  0.0000  0.5000  0.5000  1.0
]