# generated using pymatgen
data_Fe5SiC
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.92591050
_cell_length_b   7.94061418
_cell_length_c   7.41387032
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe5SiC
_chemical_formula_sum   'Fe40 Si8 C8'
_cell_volume   584.34513839
_cell_formula_units_Z   8
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  0.81352300  0.87918700  0.01338600  1
  Fe  Fe1  1  0.18647700  0.12081300  0.51338600  1
  Fe  Fe2  1  0.18647700  0.87918700  0.51338600  1
  Fe  Fe3  1  0.81352300  0.12081300  0.01338600  1
  Fe  Fe4  1  0.50220000  0.62466700  0.26240800  1
  Fe  Fe5  1  0.49780000  0.37533300  0.76240800  1
  Fe  Fe6  1  0.49780000  0.62466700  0.76240800  1
  Fe  Fe7  1  0.50220000  0.37533300  0.26240800  1
  Fe  Fe8  1  0.15214300  0.00000000  0.01213500  1
  Fe  Fe9  1  0.84785700  0.00000000  0.51213500  1
  Fe  Fe10  1  0.66177000  0.85188800  0.32224500  1
  Fe  Fe11  1  0.33823000  0.14811200  0.82224500  1
  Fe  Fe12  1  0.33823000  0.85188800  0.82224500  1
  Fe  Fe13  1  0.66177000  0.14811200  0.32224500  1
  Fe  Fe14  1  0.34090400  0.14727700  0.20119300  1
  Fe  Fe15  1  0.65909600  0.85272300  0.70119300  1
  Fe  Fe16  1  0.65909600  0.14727700  0.70119300  1
  Fe  Fe17  1  0.34090400  0.85272300  0.20119300  1
  Fe  Fe18  1  0.53330500  0.00000000  0.00354900  1
  Fe  Fe19  1  0.46669500  0.00000000  0.50354800  1
  Fe  Fe20  1  0.31352300  0.37918700  0.01338600  1
  Fe  Fe21  1  0.68647700  0.62081300  0.51338600  1
  Fe  Fe22  1  0.68647700  0.37918700  0.51338600  1
  Fe  Fe23  1  0.31352300  0.62081300  0.01338600  1
  Fe  Fe24  1  0.00220000  0.12466700  0.26240800  1
  Fe  Fe25  1  0.99780000  0.87533300  0.76240800  1
  Fe  Fe26  1  0.99780000  0.12466700  0.76240800  1
  Fe  Fe27  1  0.00220000  0.87533300  0.26240800  1
  Fe  Fe28  1  0.65214300  0.50000000  0.01213500  1
  Fe  Fe29  1  0.34785700  0.50000000  0.51213500  1
  Fe  Fe30  1  0.16177000  0.35188800  0.32224500  1
  Fe  Fe31  1  0.83823000  0.64811200  0.82224500  1
  Fe  Fe32  1  0.83823000  0.35188800  0.82224500  1
  Fe  Fe33  1  0.16177000  0.64811200  0.32224500  1
  Fe  Fe34  1  0.84090400  0.64727700  0.20119300  1
  Fe  Fe35  1  0.15909600  0.35272300  0.70119300  1
  Fe  Fe36  1  0.15909600  0.64727700  0.70119300  1
  Fe  Fe37  1  0.84090400  0.35272300  0.20119300  1
  Fe  Fe38  1  0.03330500  0.50000000  0.00354900  1
  Fe  Fe39  1  0.96669500  0.50000000  0.50354800  1
  Si  Si40  1  0.57379400  0.75274000  0.01169800  1
  Si  Si41  1  0.42620600  0.24726000  0.51169800  1
  Si  Si42  1  0.42620600  0.75274000  0.51169800  1
  Si  Si43  1  0.57379400  0.24726000  0.01169800  1
  Si  Si44  1  0.07379400  0.25274000  0.01169800  1
  Si  Si45  1  0.92620600  0.74726000  0.51169800  1
  Si  Si46  1  0.92620600  0.25274000  0.51169800  1
  Si  Si47  1  0.07379400  0.74726000  0.01169800  1
  C  C48  1  0.18868200  0.00000000  0.72634500  1
  C  C49  1  0.81131800  0.00000000  0.22634500  1
  C  C50  1  0.19393000  0.00000000  0.30091100  1
  C  C51  1  0.80607000  0.00000000  0.80091100  1
  C  C52  1  0.68868200  0.50000000  0.72634500  1
  C  C53  1  0.31131800  0.50000000  0.22634500  1
  C  C54  1  0.69393000  0.50000000  0.30091100  1
  C  C55  1  0.30607000  0.50000000  0.80091100  1
