data_[Nd6Al2Ga2Fe8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Al  1.6100  1.2500  0.6750
  Ga  1.8100  1.3000  0.7600
  Fe  1.8300  1.4000  0.8525
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [10.4619]
_cell_length_b [4.1786]
_cell_length_c [8.2445]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.6502]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Nd3AlGaFe4]
_chemical_formula_sum '[Nd6 Al2 Ga2 Fe8]'
_cell_volume [354.2110]
_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  2  0.0006  0.0000  0.4989  1
  Nd  Nd1  2  0.1253  0.5000  0.8752  1
  Nd  Nd2  2  0.3728  0.0000  0.1220  1
  Al  Al3  2  0.1731  0.5000  0.2759  1
  Ga  Ga4  2  0.3269  0.0000  0.7262  1
  Fe  Fe5  2  0.0796  0.0000  0.1317  1
  Fe  Fe6  2  0.2490  0.0000  0.4235  1
  Fe  Fe7  2  0.2523  0.5000  0.5773  1
  Fe  Fe8  2  0.4204  0.5000  0.8692  1
]