data_[Tb12Sm6Y4Zr2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Zr  1.3300  1.5500  0.8600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1488]
_cell_length_b [10.6094]
_cell_length_c [11.7383]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.9807]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6Sm3Y2Zr]
_chemical_formula_sum '[Tb12 Sm6 Y4 Zr2]'
_cell_volume [754.1677]
_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
[
  Tb  Tb0  8  0.2441  0.1634  0.2433  1.0
  Tb  Tb1  4  0.2455  0.0000  0.7570  1.0
  Sm  Sm2  4  0.0000  0.1664  0.5000  1.0
  Sm  Sm3  2  0.0000  0.5000  0.5000  1.0
  Y  Y4  4  0.0000  0.3335  0.0000  1.0
  Zr  Zr5  2  0.0000  0.0000  0.0000  1.0
]