data_[Er16In4Pb4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [6.7920]
_cell_length_b [15.7311]
_cell_length_c [6.7858]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [Er4InPbC]
_chemical_formula_sum '[Er16 In4 Pb4 C4]'
_cell_volume [725.0345]
_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
[
  Er  Er0  8  0.2500  0.2500  0.0000  1
  Er  Er1  4  0.0000  0.0918  0.7500  1
  Er  Er2  4  0.0000  0.4096  0.7500  1
  In  In3  4  0.0000  0.3877  0.2500  1
  Pb  Pb4  4  0.0000  0.1094  0.2500  1
  C  C5  4  0.0000  0.2508  0.7500  1
]