# generated using pymatgen
data_Al3Fe2Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.74612782
_cell_length_b   10.74612782
_cell_length_c   10.74612782
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Fe2Si
_chemical_formula_sum   'Al48 Fe32 Si16'
_cell_volume   1240.95492209
_cell_formula_units_Z   16
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
  Al  Al0  1  0.50000000  0.00000000  0.30023300  1
  Al  Al1  1  0.50000000  0.00000000  0.69976700  1
  Al  Al2  1  0.50000000  0.80023300  0.50000000  1
  Al  Al3  1  0.50000000  0.19976700  0.50000000  1
  Al  Al4  1  0.30023300  0.00000000  0.50000000  1
  Al  Al5  1  0.19976700  0.00000000  0.00000000  1
  Al  Al6  1  0.25000000  0.25000000  0.44976700  1
  Al  Al7  1  0.25000000  0.25000000  0.05023300  1
  Al  Al8  1  0.25000000  0.44976700  0.25000000  1
  Al  Al9  1  0.25000000  0.05023300  0.25000000  1
  Al  Al10  1  0.44976700  0.25000000  0.25000000  1
  Al  Al11  1  0.55023300  0.25000000  0.75000000  1
  Al  Al12  1  0.50000000  0.50000000  0.80023300  1
  Al  Al13  1  0.50000000  0.50000000  0.19976700  1
  Al  Al14  1  0.50000000  0.30023300  0.00000000  1
  Al  Al15  1  0.50000000  0.69976700  0.00000000  1
  Al  Al16  1  0.30023300  0.50000000  0.00000000  1
  Al  Al17  1  0.19976700  0.50000000  0.50000000  1
  Al  Al18  1  0.25000000  0.75000000  0.94976700  1
  Al  Al19  1  0.25000000  0.75000000  0.55023300  1
  Al  Al20  1  0.25000000  0.94976700  0.75000000  1
  Al  Al21  1  0.25000000  0.55023300  0.75000000  1
  Al  Al22  1  0.44976700  0.75000000  0.75000000  1
  Al  Al23  1  0.55023300  0.75000000  0.25000000  1
  Al  Al24  1  0.00000000  0.00000000  0.80023300  1
  Al  Al25  1  0.00000000  0.00000000  0.19976700  1
  Al  Al26  1  0.00000000  0.80023300  0.00000000  1
  Al  Al27  1  0.00000000  0.19976700  0.00000000  1
  Al  Al28  1  0.80023300  0.00000000  0.00000000  1
  Al  Al29  1  0.69976700  0.00000000  0.50000000  1
  Al  Al30  1  0.75000000  0.25000000  0.94976700  1
  Al  Al31  1  0.75000000  0.25000000  0.55023300  1
  Al  Al32  1  0.75000000  0.44976700  0.75000000  1
  Al  Al33  1  0.75000000  0.05023300  0.75000000  1
  Al  Al34  1  0.94976700  0.25000000  0.75000000  1
  Al  Al35  1  0.05023300  0.25000000  0.25000000  1
  Al  Al36  1  0.00000000  0.50000000  0.30023300  1
  Al  Al37  1  0.00000000  0.50000000  0.69976700  1
  Al  Al38  1  0.00000000  0.30023300  0.50000000  1
  Al  Al39  1  0.00000000  0.69976700  0.50000000  1
  Al  Al40  1  0.80023300  0.50000000  0.50000000  1
  Al  Al41  1  0.69976700  0.50000000  0.00000000  1
  Al  Al42  1  0.75000000  0.75000000  0.44976700  1
  Al  Al43  1  0.75000000  0.75000000  0.05023300  1
  Al  Al44  1  0.75000000  0.94976700  0.25000000  1
  Al  Al45  1  0.75000000  0.55023300  0.25000000  1
  Al  Al46  1  0.94976700  0.75000000  0.25000000  1
  Al  Al47  1  0.05023300  0.75000000  0.75000000  1
  Fe  Fe48  1  0.41006200  0.08993800  0.08993800  1
  Fe  Fe49  1  0.58993800  0.41006200  0.58993800  1
  Fe  Fe50  1  0.58993800  0.08993800  0.91006200  1
  Fe  Fe51  1  0.41006200  0.41006200  0.41006200  1
  Fe  Fe52  1  0.33993800  0.16006200  0.66006200  1
  Fe  Fe53  1  0.16006200  0.83993800  0.16006200  1
  Fe  Fe54  1  0.16006200  0.16006200  0.83993800  1
  Fe  Fe55  1  0.33993800  0.83993800  0.33993800  1
  Fe  Fe56  1  0.41006200  0.58993800  0.58993800  1
  Fe  Fe57  1  0.58993800  0.91006200  0.08993800  1
  Fe  Fe58  1  0.58993800  0.58993800  0.41006200  1
  Fe  Fe59  1  0.41006200  0.91006200  0.91006200  1
  Fe  Fe60  1  0.33993800  0.66006200  0.16006200  1
  Fe  Fe61  1  0.16006200  0.33993800  0.66006200  1
  Fe  Fe62  1  0.16006200  0.66006200  0.33993800  1
  Fe  Fe63  1  0.33993800  0.33993800  0.83993800  1
  Fe  Fe64  1  0.91006200  0.08993800  0.58993800  1
  Fe  Fe65  1  0.08993800  0.41006200  0.08993800  1
  Fe  Fe66  1  0.08993800  0.08993800  0.41006200  1
  Fe  Fe67  1  0.91006200  0.41006200  0.91006200  1
  Fe  Fe68  1  0.83993800  0.16006200  0.16006200  1
  Fe  Fe69  1  0.66006200  0.83993800  0.66006200  1
  Fe  Fe70  1  0.66006200  0.16006200  0.33993800  1
  Fe  Fe71  1  0.83993800  0.83993800  0.83993800  1
  Fe  Fe72  1  0.91006200  0.58993800  0.08993800  1
  Fe  Fe73  1  0.08993800  0.91006200  0.58993800  1
  Fe  Fe74  1  0.08993800  0.58993800  0.91006200  1
  Fe  Fe75  1  0.91006200  0.91006200  0.41006200  1
  Fe  Fe76  1  0.83993800  0.66006200  0.66006200  1
  Fe  Fe77  1  0.66006200  0.33993800  0.16006200  1
  Fe  Fe78  1  0.66006200  0.66006200  0.83993800  1
  Fe  Fe79  1  0.83993800  0.33993800  0.33993800  1
  Si  Si80  1  0.12500000  0.87500000  0.37500000  1
  Si  Si81  1  0.37500000  0.12500000  0.87500000  1
  Si  Si82  1  0.37500000  0.37500000  0.62500000  1
  Si  Si83  1  0.12500000  0.12500000  0.62500000  1
  Si  Si84  1  0.12500000  0.37500000  0.87500000  1
  Si  Si85  1  0.37500000  0.62500000  0.37500000  1
  Si  Si86  1  0.37500000  0.87500000  0.12500000  1
  Si  Si87  1  0.12500000  0.62500000  0.12500000  1
  Si  Si88  1  0.62500000  0.87500000  0.87500000  1
  Si  Si89  1  0.87500000  0.12500000  0.37500000  1
  Si  Si90  1  0.87500000  0.37500000  0.12500000  1
  Si  Si91  1  0.62500000  0.12500000  0.12500000  1
  Si  Si92  1  0.62500000  0.37500000  0.37500000  1
  Si  Si93  1  0.87500000  0.62500000  0.87500000  1
  Si  Si94  1  0.87500000  0.87500000  0.62500000  1
  Si  Si95  1  0.62500000  0.62500000  0.62500000  1
