data_[Tb4Tm7Sc1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.3847]
_cell_length_b [6.6688]
_cell_length_c [8.9591]
_cell_angle_alpha [85.3159]
_cell_angle_beta [76.5213]
_cell_angle_gamma [81.4950]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb4Tm7Sc]
_chemical_formula_sum '[Tb4 Tm7 Sc1]'
_cell_volume [366.4323]
_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
[
  Tb  Tb0  2  0.1673  0.6201  0.3052  1
  Tb  Tb1  2  0.3494  0.1839  0.7197  1
  Tm  Tm2  2  0.1879  0.1094  0.3838  1
  Tm  Tm3  2  0.3219  0.6941  0.6375  1
  Tm  Tm4  2  0.4964  0.2449  0.0491  1
  Tm  Tm5  1  0.0000  0.5000  0.0000  1
  Sc  Sc6  1  0.0000  0.0000  0.0000  1
]