data_[Nd6Ho8Tm2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [11.5625]
_cell_length_b [6.2043]
_cell_length_c [7.1737]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Nd3Ho4Tm]
_chemical_formula_sum '[Nd6 Ho8 Tm2]'
_cell_volume [514.6211]
_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  4  0.2484  0.4970  0.8104  1.0
  Nd  Nd1  2  0.0000  0.1667  0.3105  1.0
  Ho  Ho2  4  0.2497  0.9997  0.0607  1.0
  Ho  Ho3  2  0.0000  0.1658  0.8111  1.0
  Ho  Ho4  2  0.0000  0.6673  0.5619  1.0
  Tm  Tm5  2  0.0000  0.6671  0.0591  1.0
]