# generated using pymatgen
data_Th4B16MoW3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.11855837
_cell_length_b   11.82009188
_cell_length_c   3.77684792
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   89.98930700
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th4B16MoW3
_chemical_formula_sum   'Th4 B16 Mo1 W3'
_cell_volume   273.14889657
_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
  Th  Th0  1  0.62352019  0.34825096  0.00000000  1.0
  Th  Th1  1  0.37656281  0.65142904  0.00000000  1.0
  Th  Th2  1  0.12324613  0.15094353  0.00000000  1.0
  Th  Th3  1  0.87658229  0.84919698  0.00000000  1.0
  B  B4  1  0.78189935  0.18333982  0.50000000  1.0
  B  B5  1  0.21792982  0.81647430  0.50000000  1.0
  B  B6  1  0.28219033  0.31622810  0.50000000  1.0
  B  B7  1  0.71779803  0.68372731  0.50000000  1.0
  B  B8  1  0.86024343  0.03212405  0.50000000  1.0
  B  B9  1  0.13990130  0.96818478  0.50000000  1.0
  B  B10  1  0.36031715  0.46806123  0.50000000  1.0
  B  B11  1  0.63970551  0.53181235  0.50000000  1.0
  B  B12  1  0.88783337  0.45432259  0.50000000  1.0
  B  B13  1  0.11197647  0.54552899  0.50000000  1.0
  B  B14  1  0.38837293  0.04577063  0.50000000  1.0
  B  B15  1  0.61201891  0.95478354  0.50000000  1.0
  B  B16  1  0.97329725  0.31017204  0.50000000  1.0
  B  B17  1  0.02650175  0.68976578  0.50000000  1.0
  B  B18  1  0.47375480  0.18967949  0.50000000  1.0
  B  B19  1  0.52655237  0.81045212  0.50000000  1.0
  Mo  Mo20  1  0.62902252  0.08516243  0.00000000  1.0
  W  W21  1  0.37070458  0.91472121  0.00000000  1.0
  W  W22  1  0.12939246  0.41476370  0.00000000  1.0
  W  W23  1  0.87067926  0.58510704  0.00000000  1.0