# generated using pymatgen
data_Fe5Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.83000000
_cell_length_b   5.66300000
_cell_length_c   4.68500000
_cell_angle_alpha   107.18900000
_cell_angle_beta   96.39600000
_cell_angle_gamma   82.43100000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5Si
_chemical_formula_sum   'Fe20 Si4'
_cell_volume   271.30904408
_cell_formula_units_Z   4
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
  Fe  Fe0  1  0.91908000  0.16984000  0.58801000  1
  Fe  Fe1  1  0.25357000  0.01147000  0.26612000  1
  Fe  Fe2  1  0.99994000  0.00003000  0.00036000  1
  Fe  Fe3  1  0.66827000  0.17126000  0.33627000  1
  Fe  Fe4  1  0.17022000  0.17281000  0.84513000  1
  Fe  Fe5  1  0.08746000  0.83624000  0.42259000  1
  Fe  Fe6  1  0.33462000  0.34147000  0.67514000  1
  Fe  Fe7  1  0.83785000  0.33837000  0.17391000  1
  Fe  Fe8  1  0.66880000  0.67060000  0.34086000  1
  Fe  Fe9  1  0.41864000  0.67422000  0.09563000  1
  Fe  Fe10  1  0.58630000  0.34036000  0.92764000  1
  Fe  Fe11  1  0.92208000  0.66645000  0.58813000  1
  Fe  Fe12  1  0.83604000  0.83729000  0.17728000  1
  Fe  Fe13  1  0.50305000  0.00631000  0.51591000  1
  Fe  Fe14  1  0.50230000  0.50733000  0.51206000  1
  Fe  Fe15  1  0.25223000  0.50615000  0.26855000  1
  Fe  Fe16  1  0.75224000  0.50429000  0.75724000  1
  Fe  Fe17  1  0.33660000  0.83957000  0.67851000  1
  Fe  Fe18  1  0.58543000  0.83854000  0.92447000  1
  Fe  Fe19  1  0.00401000  0.50352000  0.99963000  1
  Si  Si20  1  0.17392000  0.68523000  0.86290000  1
  Si  Si21  1  0.41945000  0.17382000  0.09400000  1
  Si  Si22  1  0.08200000  0.32382000  0.40518000  1
  Si  Si23  1  0.75328000  0.00432000  0.75670000  1
