# generated using pymatgen
data_Nd2Th5Te12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.59949694
_cell_length_b   12.57870540
_cell_length_c   4.39102737
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.65960543
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd2Th5Te12
_chemical_formula_sum   'Nd2 Th5 Te12'
_cell_volume   604.73538219
_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  0.72671874  0.15963975  0.00000000  1.0
  Nd  Nd1  1  0.84519163  0.56592937  0.00000000  1.0
  Th  Th2  1  0.43159901  0.27604640  0.00000000  1.0
  Th  Th3  1  0.55133139  0.71149157  0.50000000  1.0
  Th  Th4  1  0.29022552  0.84160064  0.50000000  1.0
  Th  Th5  1  0.15767835  0.44893319  0.50000000  1.0
  Th  Th6  1  0.99363736  0.99418818  0.00000000  1.0
  Te  Te7  1  0.74208857  0.74691959  0.00000000  1.0
  Te  Te8  1  0.24708960  0.99397919  0.00000000  1.0
  Te  Te9  1  0.00876026  0.25426544  0.00000000  1.0
  Te  Te10  1  0.49306456  0.86695211  0.00000000  1.0
  Te  Te11  1  0.13699275  0.62919965  0.00000000  1.0
  Te  Te12  1  0.37261879  0.50862579  0.00000000  1.0
  Te  Te13  1  0.86541497  0.38769256  0.50000000  1.0
  Te  Te14  1  0.21528277  0.21282077  0.50000000  1.0
  Te  Te15  1  0.99964491  0.79143524  0.50000000  1.0
  Te  Te16  1  0.79151931  0.99954332  0.50000000  1.0
  Te  Te17  1  0.52171339  0.13720029  0.50000000  1.0
  Te  Te18  1  0.60943113  0.47353396  0.50000000  1.0