# generated using pymatgen
data_Nb8PtSe20
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.58953195
_cell_length_b   10.58953195
_cell_length_c   19.71667769
_cell_angle_alpha   74.71110018
_cell_angle_beta   74.71110018
_cell_angle_gamma   18.96157369
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb8PtSe20
_chemical_formula_sum   'Nb8 Pt1 Se20'
_cell_volume   692.27787812
_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  0.07889791  0.07889791  0.09297451  1.0
  Nb  Nb1  1  0.92110209  0.92110209  0.90702549  1.0
  Nb  Nb2  1  0.32973698  0.32973698  0.81024832  1.0
  Nb  Nb3  1  0.67026302  0.67026302  0.18975168  1.0
  Nb  Nb4  1  0.26784964  0.26784964  0.28051142  1.0
  Nb  Nb5  1  0.73215036  0.73215036  0.71948858  1.0
  Nb  Nb6  1  0.15497015  0.15497015  0.55562591  1.0
  Nb  Nb7  1  0.84502985  0.84502985  0.44437409  1.0
  Pt  Pt8  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se9  1  0.44218766  0.44218766  0.39266541  1.0
  Se  Se10  1  0.55781234  0.55781234  0.60733459  1.0
  Se  Se11  1  0.40004108  0.40004108  0.51562733  1.0
  Se  Se12  1  0.59995892  0.59995892  0.48437267  1.0
  Se  Se13  1  0.14464987  0.14464987  0.69620423  1.0
  Se  Se14  1  0.85535013  0.85535013  0.30379577  1.0
  Se  Se15  1  0.38122717  0.38122717  0.00844620  1.0
  Se  Se16  1  0.61877283  0.61877283  0.99155380  1.0
  Se  Se17  1  0.20241139  0.20241139  0.82284142  1.0
  Se  Se18  1  0.79758861  0.79758861  0.17715858  1.0
  Se  Se19  1  0.25429748  0.25429748  0.42846082  1.0
  Se  Se20  1  0.74570252  0.74570252  0.57153918  1.0
  Se  Se21  1  0.32951795  0.32951795  0.67745971  1.0
  Se  Se22  1  0.67048205  0.67048205  0.32254029  1.0
  Se  Se23  1  0.48230586  0.48230586  0.12872417  1.0
  Se  Se24  1  0.51769414  0.51769414  0.87127583  1.0
  Se  Se25  1  0.20458300  0.20458300  0.08784978  1.0
  Se  Se26  1  0.79541700  0.79541700  0.91215022  1.0
  Se  Se27  1  0.07304785  0.07304785  0.22774782  1.0
  Se  Se28  1  0.92695215  0.92695215  0.77225218  1.0