# generated using pymatgen
data_Nb2PdS5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.43315761
_cell_length_b   6.43315761
_cell_length_c   15.67453703
_cell_angle_alpha   74.12318312
_cell_angle_beta   74.12318312
_cell_angle_gamma   29.86794106
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2PdS5
_chemical_formula_sum   'Nb4 Pd2 S10'
_cell_volume   309.83452342
_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
  Nb  Nb0  1  0.57278059  0.57278059  0.81852621  1.0
  Nb  Nb1  1  0.42721941  0.42721941  0.18147379  1.0
  Nb  Nb2  1  0.14719633  0.14719633  0.62498587  1.0
  Nb  Nb3  1  0.85280367  0.85280367  0.37501413  1.0
  Pd  Pd4  1  0.00000000  0.00000000  -0.00000000  1.0
  Pd  Pd5  1  0.00000000  0.00000000  0.50000000  1.0
  S  S6  1  0.35490913  0.35490913  0.50363068  1.0
  S  S7  1  0.64509087  0.64509087  0.49636932  1.0
  S  S8  1  0.74690992  0.74690992  0.69359111  1.0
  S  S9  1  0.25309008  0.25309008  0.30640889  1.0
  S  S10  1  0.17057712  0.17057712  0.88790137  1.0
  S  S11  1  0.82942288  0.82942288  0.11209863  1.0
  S  S12  1  0.92327942  0.92327942  0.88033120  1.0
  S  S13  1  0.07672058  0.07672058  0.11966880  1.0
  S  S14  1  0.49629181  0.49629181  0.68944728  1.0
  S  S15  1  0.50370819  0.50370819  0.31055272  1.0