# generated using pymatgen
data_Nd12B(CCl4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.59796368
_cell_length_b   9.67741789
_cell_length_c   9.67741683
_cell_angle_alpha   109.63693313
_cell_angle_beta   109.30498866
_cell_angle_gamma   109.30499464
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd12B(CCl4)3
_chemical_formula_sum   'Nd12 B1 C3 Cl12'
_cell_volume   693.36675527
_cell_formula_units_Z   1
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  0.47229314  0.48203484  0.23838915  1.0
  Nd  Nd1  1  0.75000000  0.23394960  0.26605040  1.0
  Nd  Nd2  1  0.75000000  0.01718603  0.48281397  1.0
  Nd  Nd3  1  0.23281397  0.46562794  0.48281397  1.0
  Nd  Nd4  1  0.26609601  0.75635431  0.23838915  1.0
  Nd  Nd5  1  0.02770686  0.26161085  0.01796516  1.0
  Nd  Nd6  1  0.01605040  0.03209979  0.26605040  1.0
  Nd  Nd7  1  0.49025830  0.75635431  0.01796516  1.0
  Nd  Nd8  1  0.48394960  0.23394960  0.46790021  1.0
  Nd  Nd9  1  0.00974170  0.48203484  0.74364569  1.0
  Nd  Nd10  1  0.26718603  0.01718603  0.03437206  1.0
  Nd  Nd11  1  0.23390399  0.26161085  0.74364569  1.0
  B  B12  1  0.25000000  0.50000000  0.00000000  1.0
  C  C13  1  0.25000000  0.25035757  0.24964243  1.0
  C  C14  1  0.49964243  0.99928486  0.24964243  1.0
  C  C15  1  0.00035757  0.25035757  0.50071514  1.0
  Cl  Cl16  1  0.25000000  0.75626007  0.74373993  1.0
  Cl  Cl17  1  0.51372045  0.50734353  0.75496929  1.0
  Cl  Cl18  1  0.98627955  0.74503071  0.99265647  1.0
  Cl  Cl19  1  0.74124883  0.24762576  0.75496929  1.0
  Cl  Cl20  1  0.99373993  0.98747886  0.74373993  1.0
  Cl  Cl21  1  0.25000000  0.99304281  0.50695719  1.0
  Cl  Cl22  1  0.75695719  0.51391537  0.50695719  1.0
  Cl  Cl23  1  0.50637692  0.24762576  0.99265647  1.0
  Cl  Cl24  1  0.75875117  0.74503071  0.25237424  1.0
  Cl  Cl25  1  0.74304281  0.99304281  0.98608463  1.0
  Cl  Cl26  1  0.99362308  0.50734353  0.25237424  1.0
  Cl  Cl27  1  0.50626007  0.75626007  0.51252114  1.0