data_[Y8Tm12In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Tm  1.2500  1.7500  1.0950
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [17.1435]
_cell_length_b [6.1178]
_cell_length_c [6.9702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Y2Tm3In]
_chemical_formula_sum '[Y8 Tm12 In4]'
_cell_volume [731.0310]
_cell_formula_units_Z [4]
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
[
  Y  Y0  8  0.1860  0.4781  0.2500  1.0
  Tm  Tm1  8  0.1368  0.0000  0.0000  1.0
  Tm  Tm2  4  0.0000  0.3147  0.7500  1.0
  In  In3  4  0.0000  0.1979  0.2500  1.0
]