data_[Pr4Y12Tm6In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  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 [C2/m]
_cell_length_a [6.1386]
_cell_length_b [10.6641]
_cell_length_c [11.7832]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0326]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2Y6Tm3In]
_chemical_formula_sum '[Pr4 Y12 Tm6 In2]'
_cell_volume [759.5542]
_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  4  0.0000  0.3331  0.0000  1.0
  Y  Y1  8  0.2472  0.1634  0.2511  1.0
  Y  Y2  4  0.2441  0.0000  0.7474  1.0
  Tm  Tm3  4  0.0000  0.1664  0.5000  1.0
  Tm  Tm4  2  0.0000  0.5000  0.5000  1.0
  In  In5  2  0.0000  0.0000  0.0000  1.0
]