# generated using pymatgen
data_NdTh2(AlNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.09331448
_cell_length_b   7.05313755
_cell_length_c   4.01230337
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.81281192
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdTh2(AlNi)3
_chemical_formula_sum   'Nd1 Th2 Al3 Ni3'
_cell_volume   174.16948032
_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  1.00000000  0.42091799  0.50000000  1.0
  Th  Th1  1  0.57433397  0.57571982  0.50000000  1.0
  Th  Th2  1  0.42566603  0.00138685  0.50000000  1.0
  Al  Al3  1  0.00000000  0.77096271  0.00000000  1.0
  Al  Al4  1  0.22266882  0.22331065  0.00000000  1.0
  Al  Al5  1  0.77733118  0.00064183  0.00000000  1.0
  Ni  Ni6  1  0.35251369  0.68401767  0.00000000  1.0
  Ni  Ni7  1  0.64748631  0.33150297  0.00000000  1.0
  Ni  Ni8  1  0.00000000  0.99153851  0.50000000  1.0