# generated using pymatgen
data_NdTh7(Si3Ni)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.00612597
_cell_length_b   8.00612554
_cell_length_c   8.60144474
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999362
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdTh7(Si3Ni)4
_chemical_formula_sum   'Nd1 Th7 Si12 Ni4'
_cell_volume   477.47086700
_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  0.00000000  0.25000000  1.0
  Th  Th1  1  0.49999223  0.50000777  0.75000000  1.0
  Th  Th2  1  0.50001362  0.49998638  0.25000000  1.0
  Th  Th3  1  0.00001554  0.50000777  0.75000000  1.0
  Th  Th4  1  0.99997276  0.49998638  0.25000000  1.0
  Th  Th5  1  0.49999223  0.99998446  0.75000000  1.0
  Th  Th6  1  0.50001362  0.00002724  0.25000000  1.0
  Th  Th7  1  0.00000000  0.00000000  0.75000000  1.0
  Si  Si8  1  0.82869874  0.17130126  0.00008396  1.0
  Si  Si9  1  0.17130505  0.82869495  0.00017549  1.0
  Si  Si10  1  0.34260251  0.17130126  0.00008396  1.0
  Si  Si11  1  0.17130505  0.82869495  0.49982451  1.0
  Si  Si12  1  0.65738991  0.82869495  0.00017549  1.0
  Si  Si13  1  0.82869874  0.17130126  0.49991604  1.0
  Si  Si14  1  0.82869874  0.65739749  0.00008396  1.0
  Si  Si15  1  0.65738991  0.82869495  0.49982451  1.0
  Si  Si16  1  0.17130505  0.34261009  0.00017549  1.0
  Si  Si17  1  0.34260251  0.17130126  0.49991604  1.0
  Si  Si18  1  0.17130505  0.34261009  0.49982451  1.0
  Si  Si19  1  0.82869874  0.65739749  0.49991604  1.0
  Ni  Ni20  1  0.66666700  0.33333300  0.99879027  1.0
  Ni  Ni21  1  0.33333300  0.66666700  0.00012806  1.0
  Ni  Ni22  1  0.33333300  0.66666700  0.49987194  1.0
  Ni  Ni23  1  0.66666700  0.33333300  0.50120973  1.0