# generated using pymatgen
data_Y3Fe29
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.63513612
_cell_length_b   8.47552411
_cell_length_c   10.47133245
_cell_angle_alpha   90.00000000
_cell_angle_beta   96.48117632
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y3Fe29
_chemical_formula_sum   'Y6 Fe58'
_cell_volume   849.65355704
_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
  Y  Y0  1  0.00000000  0.00000000  0.00000000  1
  Y  Y1  1  0.68794100  0.50000000  0.59817700  1
  Y  Y2  1  0.31205900  0.50000000  0.40182300  1
  Y  Y3  1  0.50000000  0.50000000  0.00000000  1
  Y  Y4  1  0.18794100  0.00000000  0.59817700  1
  Y  Y5  1  0.81205900  0.00000000  0.40182300  1
  Fe  Fe6  1  0.00000000  0.50000000  0.50000000  1
  Fe  Fe7  1  0.79047200  0.50000000  0.14059100  1
  Fe  Fe8  1  0.20952800  0.50000000  0.85940900  1
  Fe  Fe9  1  0.02029400  0.50000000  0.25417200  1
  Fe  Fe10  1  0.97970600  0.50000000  0.74582800  1
  Fe  Fe11  1  0.90794400  0.21892900  0.19757000  1
  Fe  Fe12  1  0.09205600  0.21892900  0.80243000  1
  Fe  Fe13  1  0.09205600  0.78107100  0.80243000  1
  Fe  Fe14  1  0.90794400  0.78107100  0.19757000  1
  Fe  Fe15  1  0.81267200  0.35200900  0.37814100  1
  Fe  Fe16  1  0.18732800  0.35200900  0.62185900  1
  Fe  Fe17  1  0.18732800  0.64799100  0.62185900  1
  Fe  Fe18  1  0.81267200  0.64799100  0.37814100  1
  Fe  Fe19  1  0.00000000  0.64161500  0.00000000  1
  Fe  Fe20  1  0.00000000  0.35838500  0.00000000  1
  Fe  Fe21  1  0.77796400  0.50000000  0.89198400  1
  Fe  Fe22  1  0.22203600  0.50000000  0.10801600  1
  Fe  Fe23  1  0.15475600  0.25253600  0.19813300  1
  Fe  Fe24  1  0.84524400  0.25253600  0.80186700  1
  Fe  Fe25  1  0.84524400  0.74746400  0.80186700  1
  Fe  Fe26  1  0.15475600  0.74746400  0.19813300  1
  Fe  Fe27  1  0.40781900  0.50000000  0.70834200  1
  Fe  Fe28  1  0.59218100  0.50000000  0.29165800  1
  Fe  Fe29  1  0.06326000  0.25072600  0.40485800  1
  Fe  Fe30  1  0.93674000  0.25072600  0.59514200  1
  Fe  Fe31  1  0.93674000  0.74927400  0.59514200  1
  Fe  Fe32  1  0.06326000  0.74927400  0.40485800  1
  Fe  Fe33  1  0.75000000  0.75000000  0.00000000  1
  Fe  Fe34  1  0.25000000  0.75000000  0.00000000  1
  Fe  Fe35  1  0.50000000  0.00000000  0.50000000  1
  Fe  Fe36  1  0.29047200  0.00000000  0.14059100  1
  Fe  Fe37  1  0.70952800  0.00000000  0.85940900  1
  Fe  Fe38  1  0.52029400  0.00000000  0.25417200  1
  Fe  Fe39  1  0.47970600  0.00000000  0.74582800  1
  Fe  Fe40  1  0.40794400  0.71892900  0.19757000  1
  Fe  Fe41  1  0.59205600  0.71892900  0.80243000  1
  Fe  Fe42  1  0.59205600  0.28107100  0.80243000  1
  Fe  Fe43  1  0.40794400  0.28107100  0.19757000  1
  Fe  Fe44  1  0.31267200  0.85200900  0.37814100  1
  Fe  Fe45  1  0.68732800  0.85200900  0.62185900  1
  Fe  Fe46  1  0.68732800  0.14799100  0.62185900  1
  Fe  Fe47  1  0.31267200  0.14799100  0.37814100  1
  Fe  Fe48  1  0.50000000  0.14161500  0.00000000  1
  Fe  Fe49  1  0.50000000  0.85838500  0.00000000  1
  Fe  Fe50  1  0.27796400  0.00000000  0.89198400  1
  Fe  Fe51  1  0.72203600  0.00000000  0.10801600  1
  Fe  Fe52  1  0.65475600  0.75253600  0.19813300  1
  Fe  Fe53  1  0.34524400  0.75253600  0.80186700  1
  Fe  Fe54  1  0.34524400  0.24746400  0.80186700  1
  Fe  Fe55  1  0.65475600  0.24746400  0.19813300  1
  Fe  Fe56  1  0.90781900  0.00000000  0.70834200  1
  Fe  Fe57  1  0.09218100  0.00000000  0.29165800  1
  Fe  Fe58  1  0.56326000  0.75072600  0.40485800  1
  Fe  Fe59  1  0.43674000  0.75072600  0.59514200  1
  Fe  Fe60  1  0.43674000  0.24927400  0.59514200  1
  Fe  Fe61  1  0.56326000  0.24927400  0.40485800  1
  Fe  Fe62  1  0.25000000  0.25000000  0.00000000  1
  Fe  Fe63  1  0.75000000  0.25000000  0.00000000  1
