data_[La4Ga16Fe36C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Fe  1.8300  1.4000  0.8525
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [8.3589]
_cell_length_b [8.3589]
_cell_length_c [11.6426]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [LaGa4Fe9C]
_chemical_formula_sum '[La4 Ga16 Fe36 C4]'
_cell_volume [813.4868]
_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
[
  La  La0  4  0.0000  0.0000  0.2500  1
  Ga  Ga1  16  0.1833  0.6833  0.3770  1
  Fe  Fe2  16  0.0650  0.2121  0.5000  1
  Fe  Fe3  16  0.1080  0.3920  0.3260  1
  Fe  Fe4  4  0.0000  0.5000  0.0000  1
  C  C5  4  0.0000  0.0000  0.0000  1
]