data_[Tm2Mn2Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Mn  1.5500  1.4000  0.6483
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.1471]
_cell_length_b [5.3382]
_cell_length_c [7.2407]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5593]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TmMnPd6]
_chemical_formula_sum '[Tm2 Mn2 Pd12]'
_cell_volume [296.7309]
_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
[
  Tm  Tm0  2  0.0000  0.5000  0.5000  1
  Mn  Mn1  2  0.0000  0.0000  0.0000  1
  Pd  Pd2  8  0.1940  0.2566  0.2945  1
  Pd  Pd3  4  0.1432  0.5000  0.9365  1
]