data_[Tm4Ga3Pd1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.8115]
_cell_length_b [4.3303]
_cell_length_c [10.9760]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Tm4Ga3Pd]
_chemical_formula_sum '[Tm4 Ga3 Pd1]'
_cell_volume [181.1593]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.1412  1.0
  Tm  Tm1  1  0.0000  0.5000  0.8652  1.0
  Tm  Tm2  1  0.5000  0.0000  0.6492  1.0
  Tm  Tm3  1  0.5000  0.5000  0.3474  1.0
  Ga  Ga4  1  0.0000  0.0000  0.4243  1.0
  Ga  Ga5  1  0.0000  0.5000  0.5750  1.0
  Ga  Ga6  1  0.5000  0.0000  0.9194  1.0
  Pd  Pd7  1  0.5000  0.5000  0.0784  1.0
]