data_[Li4Pr4C4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pr  1.1300  1.8500  1.0600
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [7.9005]
_cell_length_b [3.6756]
_cell_length_c [10.0632]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.5341]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiPrC]
_chemical_formula_sum '[Li4 Pr4 C4]'
_cell_volume [278.6491]
_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
[
  Li  Li0  2  0.1223  0.5000  0.5880  1
  Li  Li1  2  0.4755  0.5000  0.7327  1
  Pr  Pr2  2  0.2276  0.0000  0.3198  1
  Pr  Pr3  2  0.3167  0.5000  0.0220  1
  C  C4  2  0.0830  0.5000  0.1354  1
  C  C5  2  0.4619  0.0000  0.2060  1
]