# generated using pymatgen
data_LaNd6ThSe12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.49233896
_cell_length_b   4.17299861
_cell_length_c   11.24992455
_cell_angle_alpha   90.00000000
_cell_angle_beta   89.83955019
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaNd6ThSe12
_chemical_formula_sum   'La1 Nd6 Th1 Se12'
_cell_volume   539.51630384
_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
  La  La0  1  0.30784770  0.25000000  0.50628948  1.0
  Nd  Nd1  1  0.48364472  0.25000000  0.18650059  1.0
  Nd  Nd2  1  0.98940088  0.25000000  0.31583271  1.0
  Nd  Nd3  1  0.51248123  0.75000000  0.81083820  1.0
  Nd  Nd4  1  0.01068851  0.75000000  0.68588787  1.0
  Nd  Nd5  1  0.69203784  0.75000000  0.48826966  1.0
  Nd  Nd6  1  0.19572829  0.75000000  0.99876752  1.0
  Th  Th7  1  0.80767459  0.25000000  0.00474440  1.0
  Se  Se8  1  0.55193806  0.25000000  0.62636042  1.0
  Se  Se9  1  0.04130518  0.25000000  0.87568047  1.0
  Se  Se10  1  0.45477513  0.75000000  0.37153154  1.0
  Se  Se11  1  0.95382657  0.75000000  0.12557151  1.0
  Se  Se12  1  0.61984505  0.75000000  0.05483208  1.0
  Se  Se13  1  0.11982133  0.75000000  0.44513647  1.0
  Se  Se14  1  0.38192932  0.25000000  0.94393238  1.0
  Se  Se15  1  0.87526586  0.25000000  0.55583867  1.0
  Se  Se16  1  0.73036906  0.25000000  0.29099770  1.0
  Se  Se17  1  0.22458414  0.25000000  0.19497335  1.0
  Se  Se18  1  0.26947114  0.75000000  0.70616956  1.0
  Se  Se19  1  0.77736639  0.75000000  0.81184641  1.0