# generated using pymatgen
data_NdTh(SnSe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.17038003
_cell_length_b   4.17038003
_cell_length_c   9.26051787
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdTh(SnSe)2
_chemical_formula_sum   'Nd1 Th1 Sn2 Se2'
_cell_volume   161.05957146
_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  0.00000000  0.50000000  0.70852796  1.0
  Th  Th1  1  0.50000000  0.00000000  0.29432708  1.0
  Sn  Sn2  1  0.00000000  0.00000000  0.00215910  1.0
  Sn  Sn3  1  0.50000000  0.50000000  0.00215910  1.0
  Se  Se4  1  0.00000000  0.50000000  0.37173144  1.0
  Se  Se5  1  0.50000000  0.00000000  0.62109330  1.0