data_[Nd2Y4Tm8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Y  1.2200  1.8000  1.0400
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.4742]
_cell_length_b [8.2335]
_cell_length_c [8.8957]
_cell_angle_alpha [87.2556]
_cell_angle_beta [81.9195]
_cell_angle_gamma [71.5867]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Nd(YTm2)2]
_chemical_formula_sum '[Nd2 Y4 Tm8]'
_cell_volume [445.4414]
_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  1  0.3187  0.9272  0.0693  1.0
  Nd  Nd1  1  0.8494  0.8505  0.2631  1.0
  Y  Y2  1  0.3351  0.4411  0.0854  1.0
  Y  Y3  1  0.4687  0.2019  0.4242  1.0
  Y  Y4  1  0.6048  0.8496  0.6697  1.0
  Y  Y5  1  0.6352  0.4044  0.7100  1.0
  Tm  Tm6  1  0.0009  0.4985  0.4671  1.0
  Tm  Tm7  1  0.0299  0.0485  0.5269  1.0
  Tm  Tm8  1  0.1628  0.6952  0.7507  1.0
  Tm  Tm9  1  0.1769  0.2628  0.7926  1.0
  Tm  Tm10  1  0.4572  0.6363  0.3830  1.0
  Tm  Tm11  1  0.7890  0.0522  0.9188  1.0
  Tm  Tm12  1  0.7901  0.6098  0.9891  1.0
  Tm  Tm13  1  0.8813  0.2721  0.2001  1.0
]