# generated using pymatgen
data_Nd3Th2Sn3C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37348129
_cell_length_b   9.30995102
_cell_length_c   6.68650337
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.22598749
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd3Th2Sn3C
_chemical_formula_sum   'Nd6 Th4 Sn6 C2'
_cell_volume   504.17873673
_cell_formula_units_Z   2
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  0.33282138  0.66564377  0.50000000  1.0
  Nd  Nd1  1  0.66717862  0.33435623  0.50000000  1.0
  Nd  Nd2  1  0.66717862  0.33435623  0.00000000  1.0
  Nd  Nd3  1  0.33282138  0.66564377  0.00000000  1.0
  Nd  Nd4  1  0.22843710  0.00000000  0.75000000  1.0
  Nd  Nd5  1  0.77156290  1.00000000  0.25000000  1.0
  Th  Th6  1  0.00281315  0.21537908  0.75000000  1.0
  Th  Th7  1  0.99718685  0.78462092  0.25000000  1.0
  Th  Th8  1  0.78743406  0.78462092  0.75000000  1.0
  Th  Th9  1  0.21256594  0.21537908  0.25000000  1.0
  Sn  Sn10  1  0.60122256  0.00000000  0.75000000  1.0
  Sn  Sn11  1  0.39877744  1.00000000  0.25000000  1.0
  Sn  Sn12  1  0.00079646  0.59777598  0.75000000  1.0
  Sn  Sn13  1  0.99920354  0.40222402  0.25000000  1.0
  Sn  Sn14  1  0.40301948  0.40222402  0.75000000  1.0
  Sn  Sn15  1  0.59698052  0.59777598  0.25000000  1.0
  C  C16  1  0.00000000  0.00000000  0.50000000  1.0
  C  C17  1  0.00000000  0.00000000  0.00000000  1.0