# generated using pymatgen
data_Zr3FeSi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31672097
_cell_length_b   5.31672170
_cell_length_c   12.86919564
_cell_angle_alpha   70.84262988
_cell_angle_beta   70.84262776
_cell_angle_gamma   42.63571482
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3FeSi3
_chemical_formula_sum   'Zr6 Fe2 Si6'
_cell_volume   230.60663223
_cell_formula_units_Z   2
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
  Zr  Zr0  1  0.74541193  0.74541193  0.77371564  1.0
  Zr  Zr1  1  0.25458807  0.25458807  0.22628436  1.0
  Zr  Zr2  1  0.52572184  0.52572184  0.61875173  1.0
  Zr  Zr3  1  0.47427816  0.47427816  0.38124827  1.0
  Zr  Zr4  1  0.39607092  0.39607092  0.91849522  1.0
  Zr  Zr5  1  0.60392908  0.60392908  0.08150478  1.0
  Fe  Fe6  1  0.76038513  0.76038513  0.41435375  1.0
  Fe  Fe7  1  0.23961487  0.23961487  0.58564625  1.0
  Si  Si8  1  0.13794834  0.13794834  0.45038580  1.0
  Si  Si9  1  0.86205166  0.86205166  0.54961420  1.0
  Si  Si10  1  0.11471626  0.11471626  0.92518104  1.0
  Si  Si11  1  0.88528374  0.88528374  0.07481896  1.0
  Si  Si12  1  0.04379672  0.04379672  0.75982926  1.0
  Si  Si13  1  0.95620328  0.95620328  0.24017074  1.0