# generated using pymatgen
data_Nb2PdS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40416835
_cell_length_b   6.40416835
_cell_length_c   10.16624742
_cell_angle_alpha   63.73556336
_cell_angle_beta   63.73556336
_cell_angle_gamma   29.89549621
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2PdS6
_chemical_formula_sum   'Nb2 Pd1 S6'
_cell_volume   184.73805048
_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
  Nb  Nb0  1  0.31686514  0.31686514  0.29251010  1.0
  Nb  Nb1  1  0.68313486  0.68313486  0.70748990  1.0
  Pd  Pd2  1  0.00000000  0.00000000  0.00000000  1.0
  S  S3  1  0.01470241  0.01470241  0.76214015  1.0
  S  S4  1  0.98529759  0.98529759  0.23785985  1.0
  S  S5  1  0.33625240  0.33625240  0.53929344  1.0
  S  S6  1  0.66374760  0.66374760  0.46070656  1.0
  S  S7  1  0.78784361  0.78784361  0.12744974  1.0
  S  S8  1  0.21215639  0.21215639  0.87255026  1.0