data_[La6Au2C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Au  2.5400  1.3500  1.0700
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.5081]
_cell_length_b [3.8750]
_cell_length_c [9.8699]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.4304]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La3AuC]
_chemical_formula_sum '[La6 Au2 C2]'
_cell_volume [275.4294]
_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
[
  La  La0  2  0.0831  0.2500  0.8735  1.0
  La  La1  2  0.2231  0.2500  0.4161  1.0
  La  La2  2  0.4129  0.7500  0.1733  1.0
  Au  Au3  2  0.2508  0.7500  0.6697  1.0
  C  C4  2  0.1704  0.2500  0.1518  1.0
]