# generated using pymatgen
data_Zr6Fe23
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.69650346
_cell_length_b   11.69650346
_cell_length_c   11.69650346
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr6Fe23
_chemical_formula_sum   'Zr24 Fe92'
_cell_volume   1600.17750500
_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
  Zr  Zr0  1  0.00000000  0.00000000  0.20589500  1
  Zr  Zr1  1  0.29410500  0.00000000  0.50000000  1
  Zr  Zr2  1  0.00000000  0.20589500  0.00000000  1
  Zr  Zr3  1  0.70589500  0.00000000  0.50000000  1
  Zr  Zr4  1  0.00000000  0.29410500  0.50000000  1
  Zr  Zr5  1  0.00000000  0.00000000  0.79410500  1
  Zr  Zr6  1  0.00000000  0.50000000  0.70589500  1
  Zr  Zr7  1  0.29410500  0.50000000  0.00000000  1
  Zr  Zr8  1  0.00000000  0.70589500  0.50000000  1
  Zr  Zr9  1  0.70589500  0.50000000  0.00000000  1
  Zr  Zr10  1  0.00000000  0.79410500  0.00000000  1
  Zr  Zr11  1  0.00000000  0.50000000  0.29410500  1
  Zr  Zr12  1  0.50000000  0.00000000  0.70589500  1
  Zr  Zr13  1  0.79410500  0.00000000  0.00000000  1
  Zr  Zr14  1  0.50000000  0.20589500  0.50000000  1
  Zr  Zr15  1  0.20589500  0.00000000  0.00000000  1
  Zr  Zr16  1  0.50000000  0.29410500  0.00000000  1
  Zr  Zr17  1  0.50000000  0.00000000  0.29410500  1
  Zr  Zr18  1  0.50000000  0.50000000  0.20589500  1
  Zr  Zr19  1  0.79410500  0.50000000  0.50000000  1
  Zr  Zr20  1  0.50000000  0.70589500  0.00000000  1
  Zr  Zr21  1  0.20589500  0.50000000  0.50000000  1
  Zr  Zr22  1  0.50000000  0.79410500  0.50000000  1
  Zr  Zr23  1  0.50000000  0.50000000  0.79410500  1
  Fe  Fe24  1  0.17255900  0.17255900  0.17255900  1
  Fe  Fe25  1  0.82744100  0.32744100  0.32744100  1
  Fe  Fe26  1  0.25000000  0.00000000  0.25000000  1
  Fe  Fe27  1  0.87835100  0.12164900  0.37835100  1
  Fe  Fe28  1  0.67255900  0.17255900  0.32744100  1
  Fe  Fe29  1  0.87835100  0.12164900  0.62164900  1
  Fe  Fe30  1  0.75000000  0.25000000  0.00000000  1
  Fe  Fe31  1  0.32744100  0.17255900  0.32744100  1
  Fe  Fe32  1  0.17255900  0.32744100  0.32744100  1
  Fe  Fe33  1  0.87835100  0.37835100  0.87835100  1
  Fe  Fe34  1  0.00000000  0.00000000  0.50000000  1
  Fe  Fe35  1  0.82744100  0.17255900  0.17255900  1
  Fe  Fe36  1  0.12164900  0.37835100  0.87835100  1
  Fe  Fe37  1  0.67255900  0.32744100  0.17255900  1
  Fe  Fe38  1  0.75000000  0.00000000  0.25000000  1
  Fe  Fe39  1  0.00000000  0.25000000  0.75000000  1
  Fe  Fe40  1  0.12164900  0.12164900  0.37835100  1
  Fe  Fe41  1  0.32744100  0.32744100  0.17255900  1
  Fe  Fe42  1  0.12164900  0.37835100  0.12164900  1
  Fe  Fe43  1  0.12164900  0.12164900  0.62164900  1
  Fe  Fe44  1  0.00000000  0.25000000  0.25000000  1
  Fe  Fe45  1  0.87835100  0.37835100  0.12164900  1
  Fe  Fe46  1  0.25000000  0.25000000  0.00000000  1
  Fe  Fe47  1  0.17255900  0.67255900  0.67255900  1
  Fe  Fe48  1  0.82744100  0.82744100  0.82744100  1
  Fe  Fe49  1  0.25000000  0.50000000  0.75000000  1
  Fe  Fe50  1  0.87835100  0.62164900  0.87835100  1
  Fe  Fe51  1  0.67255900  0.67255900  0.82744100  1
  Fe  Fe52  1  0.87835100  0.62164900  0.12164900  1
  Fe  Fe53  1  0.75000000  0.75000000  0.50000000  1
  Fe  Fe54  1  0.32744100  0.67255900  0.82744100  1
  Fe  Fe55  1  0.17255900  0.82744100  0.82744100  1
  Fe  Fe56  1  0.87835100  0.87835100  0.37835100  1
  Fe  Fe57  1  0.00000000  0.50000000  0.00000000  1
  Fe  Fe58  1  0.82744100  0.67255900  0.67255900  1
  Fe  Fe59  1  0.12164900  0.87835100  0.37835100  1
  Fe  Fe60  1  0.67255900  0.82744100  0.67255900  1
  Fe  Fe61  1  0.75000000  0.50000000  0.75000000  1
  Fe  Fe62  1  0.00000000  0.75000000  0.25000000  1
  Fe  Fe63  1  0.12164900  0.62164900  0.87835100  1
  Fe  Fe64  1  0.32744100  0.82744100  0.67255900  1
  Fe  Fe65  1  0.12164900  0.87835100  0.62164900  1
  Fe  Fe66  1  0.12164900  0.62164900  0.12164900  1
  Fe  Fe67  1  0.00000000  0.75000000  0.75000000  1
  Fe  Fe68  1  0.87835100  0.87835100  0.62164900  1
  Fe  Fe69  1  0.25000000  0.75000000  0.50000000  1
  Fe  Fe70  1  0.67255900  0.17255900  0.67255900  1
  Fe  Fe71  1  0.32744100  0.32744100  0.82744100  1
  Fe  Fe72  1  0.75000000  0.00000000  0.75000000  1
  Fe  Fe73  1  0.37835100  0.12164900  0.87835100  1
  Fe  Fe74  1  0.17255900  0.17255900  0.82744100  1
  Fe  Fe75  1  0.37835100  0.12164900  0.12164900  1
  Fe  Fe76  1  0.25000000  0.25000000  0.50000000  1
  Fe  Fe77  1  0.82744100  0.17255900  0.82744100  1
  Fe  Fe78  1  0.67255900  0.32744100  0.82744100  1
  Fe  Fe79  1  0.37835100  0.37835100  0.37835100  1
  Fe  Fe80  1  0.50000000  0.00000000  0.00000000  1
  Fe  Fe81  1  0.32744100  0.17255900  0.67255900  1
  Fe  Fe82  1  0.62164900  0.37835100  0.37835100  1
  Fe  Fe83  1  0.17255900  0.32744100  0.67255900  1
  Fe  Fe84  1  0.25000000  0.00000000  0.75000000  1
  Fe  Fe85  1  0.50000000  0.25000000  0.25000000  1
  Fe  Fe86  1  0.62164900  0.12164900  0.87835100  1
  Fe  Fe87  1  0.82744100  0.32744100  0.67255900  1
  Fe  Fe88  1  0.62164900  0.37835100  0.62164900  1
  Fe  Fe89  1  0.62164900  0.12164900  0.12164900  1
  Fe  Fe90  1  0.50000000  0.25000000  0.75000000  1
  Fe  Fe91  1  0.37835100  0.37835100  0.62164900  1
  Fe  Fe92  1  0.75000000  0.25000000  0.50000000  1
  Fe  Fe93  1  0.67255900  0.67255900  0.17255900  1
  Fe  Fe94  1  0.32744100  0.82744100  0.32744100  1
  Fe  Fe95  1  0.75000000  0.50000000  0.25000000  1
  Fe  Fe96  1  0.37835100  0.62164900  0.37835100  1
  Fe  Fe97  1  0.17255900  0.67255900  0.32744100  1
  Fe  Fe98  1  0.37835100  0.62164900  0.62164900  1
  Fe  Fe99  1  0.25000000  0.75000000  0.00000000  1
  Fe  Fe100  1  0.82744100  0.67255900  0.32744100  1
  Fe  Fe101  1  0.67255900  0.82744100  0.32744100  1
  Fe  Fe102  1  0.37835100  0.87835100  0.87835100  1
  Fe  Fe103  1  0.50000000  0.50000000  0.50000000  1
  Fe  Fe104  1  0.32744100  0.67255900  0.17255900  1
  Fe  Fe105  1  0.62164900  0.87835100  0.87835100  1
  Fe  Fe106  1  0.17255900  0.82744100  0.17255900  1
  Fe  Fe107  1  0.25000000  0.50000000  0.25000000  1
  Fe  Fe108  1  0.50000000  0.75000000  0.75000000  1
  Fe  Fe109  1  0.62164900  0.62164900  0.37835100  1
  Fe  Fe110  1  0.82744100  0.82744100  0.17255900  1
  Fe  Fe111  1  0.62164900  0.87835100  0.12164900  1
  Fe  Fe112  1  0.62164900  0.62164900  0.62164900  1
  Fe  Fe113  1  0.50000000  0.75000000  0.25000000  1
  Fe  Fe114  1  0.37835100  0.87835100  0.12164900  1
  Fe  Fe115  1  0.75000000  0.75000000  0.00000000  1
