# generated using pymatgen
data_Nb5SnSe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.50820259
_cell_length_b   9.50820259
_cell_length_c   9.41326925
_cell_angle_alpha   76.95150374
_cell_angle_beta   76.95150374
_cell_angle_gamma   20.96173087
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5SnSe8
_chemical_formula_sum   'Nb5 Sn1 Se8'
_cell_volume   296.31214163
_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  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.36018300  0.36018300  0.99809600  1.0
  Nb  Nb2  1  0.63981700  0.63981700  0.00190400  1.0
  Nb  Nb3  1  0.28740900  0.28740900  0.36963800  1.0
  Nb  Nb4  1  0.71259100  0.71259100  0.63036200  1.0
  Sn  Sn5  1  0.50000000  0.50000000  0.50000000  1.0
  Se  Se6  1  0.56981400  0.56981400  0.80005300  1.0
  Se  Se7  1  0.43018600  0.43018600  0.19994700  1.0
  Se  Se8  1  0.08342400  0.08342400  0.19573500  1.0
  Se  Se9  1  0.91657600  0.91657600  0.80426500  1.0
  Se  Se10  1  0.14985400  0.14985400  0.49205900  1.0
  Se  Se11  1  0.85014600  0.85014600  0.50794100  1.0
  Se  Se12  1  0.24058700  0.24058700  0.84248700  1.0
  Se  Se13  1  0.75941300  0.75941300  0.15751300  1.0