# generated using pymatgen
data_Nb3FeSe10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.40664691
_cell_length_b   3.53167719
_cell_length_c   10.21165122
_cell_angle_alpha   90.00000000
_cell_angle_beta   113.16446116
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3FeSe10
_chemical_formula_sum   'Nb3 Fe1 Se10'
_cell_volume   311.89372534
_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  0.27693400  0.00000000  0.36816700  1
  Nb  Nb1  1  0.72160400  0.50000000  0.64006900  1
  Nb  Nb2  1  0.45528400  0.50000000  0.08321700  1
  Fe  Fe3  1  0.54690200  0.00000000  0.90027100  1
  Se  Se4  1  0.04602200  0.50000000  0.24494900  1
  Se  Se5  1  0.95395900  0.00000000  0.76057800  1
  Se  Se6  1  0.48866000  0.50000000  0.36992500  1
  Se  Se7  1  0.51477100  0.00000000  0.64730100  1
  Se  Se8  1  0.16131200  0.50000000  0.49703000  1
  Se  Se9  1  0.83464200  0.00000000  0.50915200  1
  Se  Se10  1  0.24282200  0.00000000  0.08749300  1
  Se  Se11  1  0.73339000  0.50000000  0.91127700  1
  Se  Se12  1  0.66942600  0.00000000  0.15617700  1
  Se  Se13  1  0.35427200  0.50000000  0.82439300  1
