data_[Pr2Nd6Tm12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Nd  1.1400  1.8500  1.2765
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [13.1628]
_cell_length_b [3.5028]
_cell_length_c [14.2869]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1891]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr(NdTm2)3]
_chemical_formula_sum '[Pr2 Nd6 Tm12]'
_cell_volume [648.3239]
_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
[
  Pr  Pr0  2  0.0419  0.7500  0.7195  1.0
  Nd  Nd1  2  0.0734  0.7500  0.0976  1.0
  Nd  Nd2  2  0.3714  0.2500  0.4940  1.0
  Nd  Nd3  2  0.4203  0.7500  0.9011  1.0
  Tm  Tm4  2  0.1231  0.7500  0.4854  1.0
  Tm  Tm5  2  0.1961  0.2500  0.9276  1.0
  Tm  Tm6  2  0.2237  0.2500  0.2859  1.0
  Tm  Tm7  2  0.2726  0.2500  0.6970  1.0
  Tm  Tm8  2  0.3486  0.7500  0.1247  1.0
  Tm  Tm9  2  0.4998  0.2500  0.3103  1.0
]