# generated using pymatgen
data_NdThInPt2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.89738080
_cell_length_b   7.92174206
_cell_length_c   3.83539770
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdThInPt2
_chemical_formula_sum   'Nd2 Th2 In2 Pt4'
_cell_volume   239.94636792
_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
  Nd  Nd0  1  0.67531555  0.82616922  0.50000000  1.0
  Nd  Nd1  1  0.82468445  0.32616922  0.50000000  1.0
  Th  Th2  1  0.33091848  0.17334408  0.50000000  1.0
  Th  Th3  1  0.16908152  0.67334408  0.50000000  1.0
  In  In4  1  0.50429450  0.50372916  0.00000000  1.0
  In  In5  1  0.99570550  0.00372916  0.00000000  1.0
  Pt  Pt6  1  0.61572956  0.12802875  0.00000000  1.0
  Pt  Pt7  1  0.88427044  0.62802875  0.00000000  1.0
  Pt  Pt8  1  0.14115689  0.36872878  0.00000000  1.0
  Pt  Pt9  1  0.35884311  0.86872878  0.00000000  1.0