# generated using pymatgen
data_Nd3CCl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.61324543
_cell_length_b   9.61324520
_cell_length_c   9.61324639
_cell_angle_alpha   109.47122108
_cell_angle_beta   109.47122059
_cell_angle_gamma   109.47122117
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3CCl3
_chemical_formula_sum   'Nd12 C4 Cl12'
_cell_volume   683.89310974
_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
  Nd  Nd0  1  0.46763183  0.48381541  0.23381541  1.0
  Nd  Nd1  1  0.75000000  0.23381541  0.26618459  1.0
  Nd  Nd2  1  0.75000000  0.01618459  0.48381541  1.0
  Nd  Nd3  1  0.23381541  0.46763183  0.48381541  1.0
  Nd  Nd4  1  0.26618459  0.75000000  0.23381541  1.0
  Nd  Nd5  1  0.03236817  0.26618459  0.01618459  1.0
  Nd  Nd6  1  0.01618459  0.03236817  0.26618459  1.0
  Nd  Nd7  1  0.48381541  0.75000000  0.01618459  1.0
  Nd  Nd8  1  0.48381541  0.23381541  0.46763183  1.0
  Nd  Nd9  1  0.01618459  0.48381541  0.75000000  1.0
  Nd  Nd10  1  0.26618459  0.01618459  0.03236817  1.0
  Nd  Nd11  1  0.23381541  0.26618459  0.75000000  1.0
  C  C12  1  0.25000000  0.25000000  0.25000000  1.0
  C  C13  1  0.50000000  0.00000000  0.25000000  1.0
  C  C14  1  0.00000000  0.25000000  0.50000000  1.0
  C  C15  1  0.25000000  0.50000000  0.00000000  1.0
  Cl  Cl16  1  0.25000000  0.75711601  0.74288399  1.0
  Cl  Cl17  1  0.51423302  0.50711601  0.75711601  1.0
  Cl  Cl18  1  0.98576698  0.74288399  0.99288399  1.0
  Cl  Cl19  1  0.74288399  0.25000000  0.75711601  1.0
  Cl  Cl20  1  0.99288399  0.98576698  0.74288399  1.0
  Cl  Cl21  1  0.25000000  0.99288399  0.50711601  1.0
  Cl  Cl22  1  0.75711601  0.51423302  0.50711601  1.0
  Cl  Cl23  1  0.50711601  0.25000000  0.99288399  1.0
  Cl  Cl24  1  0.75711601  0.74288399  0.25000000  1.0
  Cl  Cl25  1  0.74288399  0.99288399  0.98576698  1.0
  Cl  Cl26  1  0.99288399  0.50711601  0.25000000  1.0
  Cl  Cl27  1  0.50711601  0.75711601  0.51423302  1.0