# generated using pymatgen
data_Nb6Sn5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.06206234
_cell_length_b   10.06206234
_cell_length_c   10.06206234
_cell_angle_alpha   147.23423987
_cell_angle_beta   125.04891307
_cell_angle_gamma   65.47024754
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6Sn5
_chemical_formula_sum   'Nb12 Sn10'
_cell_volume   446.05915595
_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  0.65406365  0.65406365  0.00000000  1.0
  Nb  Nb1  1  0.34593635  0.34593635  0.00000000  1.0
  Nb  Nb2  1  -0.00000000  0.75847338  0.75847338  1.0
  Nb  Nb3  1  0.00000000  0.24152662  0.24152662  1.0
  Nb  Nb4  1  0.50000000  0.00000000  0.00000000  1.0
  Nb  Nb5  1  0.00000000  0.50000000  0.00000000  1.0
  Nb  Nb6  1  0.00000000  0.00000000  0.50000000  1.0
  Nb  Nb7  1  0.50000000  0.50000000  0.50000000  1.0
  Nb  Nb8  1  0.64487439  0.91575143  0.72912295  1.0
  Nb  Nb9  1  0.18662948  0.91575143  0.27087705  1.0
  Nb  Nb10  1  0.81337052  0.08424857  0.72912295  1.0
  Nb  Nb11  1  0.35512561  0.08424857  0.27087705  1.0
  Sn  Sn12  1  0.83240470  0.83240470  0.00000000  1.0
  Sn  Sn13  1  0.16759530  0.16759530  0.00000000  1.0
  Sn  Sn14  1  0.29462313  0.79462313  0.50000000  1.0
  Sn  Sn15  1  0.70537687  0.20537687  0.50000000  1.0
  Sn  Sn16  1  0.50000000  0.74449577  0.24449577  1.0
  Sn  Sn17  1  0.50000000  0.25550423  0.75550423  1.0
  Sn  Sn18  1  0.29716897  0.60395523  0.69321373  1.0
  Sn  Sn19  1  0.91074150  0.60395523  0.30678627  1.0
  Sn  Sn20  1  0.08925850  0.39604477  0.69321373  1.0
  Sn  Sn21  1  0.70283103  0.39604477  0.30678627  1.0