data_[La16Zn4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.5754]
_cell_length_b [14.8663]
_cell_length_c [6.3979]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5235]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [La4ZnC]
_chemical_formula_sum '[La16 Zn4 C4]'
_cell_volume [709.7263]
_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  8  0.1359  0.2009  0.1317  1.0
  La  La1  8  0.2231  0.0466  0.6849  1.0
  Zn  Zn2  4  0.0000  0.3819  0.7500  1.0
  C  C3  4  0.0000  0.0778  0.2500  1.0
]