# generated using pymatgen
data_Nb6Fe16Si7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.88599292
_cell_length_b   7.88599419
_cell_length_c   7.88599183
_cell_angle_alpha   60.00004467
_cell_angle_beta   60.00003814
_cell_angle_gamma   60.00006181
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6Fe16Si7
_chemical_formula_sum   'Nb6 Fe16 Si7'
_cell_volume   346.78047366
_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  0.79298729  0.20701812  0.79298605  1.0
  Nb  Nb1  1  0.79298080  0.79298777  0.20701947  1.0
  Nb  Nb2  1  0.20701497  0.79298213  0.20701788  1.0
  Nb  Nb3  1  0.20701233  0.20701656  0.79297971  1.0
  Nb  Nb4  1  0.20701875  0.79298844  0.79298002  1.0
  Nb  Nb5  1  0.79298086  0.20701477  0.20701329  1.0
  Fe  Fe6  1  0.86105478  0.37965346  0.37964543  1.0
  Fe  Fe7  1  0.62034594  0.62035446  0.13894909  1.0
  Fe  Fe8  1  0.37964547  0.37965497  0.86105172  1.0
  Fe  Fe9  1  0.82566402  0.52300639  0.82566053  1.0
  Fe  Fe10  1  0.82566954  0.82566207  0.82566636  1.0
  Fe  Fe11  1  0.82566445  0.82565680  0.52300927  1.0
  Fe  Fe12  1  0.37964283  0.37965267  0.37964468  1.0
  Fe  Fe13  1  0.13894754  0.62035408  0.62034803  1.0
  Fe  Fe14  1  0.62034949  0.62035804  0.62035150  1.0
  Fe  Fe15  1  0.17434011  0.17432956  0.17434020  1.0
  Fe  Fe16  1  0.17434233  0.47698629  0.17434247  1.0
  Fe  Fe17  1  0.52300782  0.82565835  0.82566267  1.0
  Fe  Fe18  1  0.62034996  0.13894306  0.62035224  1.0
  Fe  Fe19  1  0.17434636  0.17433581  0.47698487  1.0
  Fe  Fe20  1  0.37964742  0.86105443  0.37964872  1.0
  Fe  Fe21  1  0.47698532  0.17433570  0.17434626  1.0
  Si  Si22  1  0.49999626  1.00000584  1.00000206  1.0
  Si  Si23  1  1.00000536  0.49999351  1.00000578  1.0
  Si  Si24  1  0.49999629  0.49999384  1.00000463  1.0
  Si  Si25  1  0.50000017  0.49999940  0.49999989  1.0
  Si  Si26  1  1.00000448  0.49999389  0.49999570  1.0
  Si  Si27  1  1.00000240  1.00000628  0.49999563  1.0
  Si  Si28  1  0.49999666  1.00000532  0.49999583  1.0