# generated using pymatgen
data_ThCdN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.06886475
_cell_length_b   4.06886475
_cell_length_c   8.40348172
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThCdN
_chemical_formula_sum   'Th2 Cd2 N2'
_cell_volume   139.12518888
_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
  Th  Th0  1  0.00000000  0.50000000  0.86419648  1.0
  Th  Th1  1  0.50000000  0.00000000  0.13580352  1.0
  Cd  Cd2  1  0.50000000  0.00000000  0.57962845  1.0
  Cd  Cd3  1  0.00000000  0.50000000  0.42037155  1.0
  N  N4  1  0.00000000  0.00000000  0.00000000  1.0
  N  N5  1  0.50000000  0.50000000  0.00000000  1.0