# generated using pymatgen
data_VFe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.81806444
_cell_length_b   13.08858020
_cell_length_c   47.05615512
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   VFe3
_chemical_formula_sum   'V32 Fe96'
_cell_volume   3583.33576812
_cell_formula_units_Z   32
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
  V  V1  1  1.002810  0.685875  0.312095  1
  V  V2  1  1.002810  0.088147  0.368366  1
  V  V3  1  0.502810  0.886623  0.339124  1
  V  V4  1  0.502810  0.487799  0.285861  1
  V  V5  1  0.502810  0.588147  0.368366  1
  V  V6  1  0.502810  0.185875  0.312095  1
  V  V7  1  1.002810  0.987799  0.285861  1
  V  V8  1  1.002810  0.386623  0.339124  1
  V  V9  1  0.002810  0.487443  0.423808  1
  V  V10  1  1.002810  0.887357  0.479500  1
  V  V11  1  0.502810  0.687411  0.451646  1
  V  V12  1  0.502810  0.287583  0.395988  1
  V  V13  1  0.502810  0.387357  0.479500  1
  V  V14  1  0.502810  0.987443  0.423808  1
  V  V15  1  1.002810  0.787583  0.395988  1
  V  V16  1  1.002810  0.187411  0.451646  1
  V  V17  1  1.002810  0.287324  0.535290  1
  V  V18  1  1.002810  0.686951  0.590941  1
  V  V19  1  0.502810  0.487285  0.563196  1
  V  V20  1  0.502810  0.087307  0.507427  1
  V  V21  1  0.502810  0.186951  0.590941  1
  V  V22  1  0.502810  0.787324  0.535290  1
  V  V23  1  1.002810  0.587307  0.507427  1
  V  V24  1  1.002810  0.987285  0.563196  1
  V  V25  1  1.002810  0.087781  0.647603  1
  V  V26  1  1.002810  0.484583  0.702365  1
  V  V27  1  0.502810  0.287803  0.674609  1
  V  V28  1  0.502810  0.887047  0.618489  1
  V  V29  1  0.502810  0.984583  0.702365  1
  V  V30  1  0.502810  0.587781  0.647603  1
  V  V31  1  1.002810  0.387047  0.618489  1
  V  V32  1  1.002810  0.787803  0.674609  1
  Fe  Fe33  1  0.751208  0.537152  0.327075  1
  Fe  Fe34  1  0.751366  0.937208  0.381851  1
  Fe  Fe35  1  0.254412  0.537152  0.327075  1
  Fe  Fe36  1  0.254254  0.937208  0.381851  1
  Fe  Fe37  1  0.502810  0.684610  0.313611  1
  Fe  Fe38  1  0.502810  0.087687  0.368191  1
  Fe  Fe39  1  0.251537  0.737653  0.353918  1
  Fe  Fe40  1  0.261993  0.338594  0.299177  1
  Fe  Fe41  1  0.754083  0.737653  0.353918  1
  Fe  Fe42  1  0.743627  0.338594  0.299177  1
  Fe  Fe43  1  1.002810  0.887357  0.340636  1
  Fe  Fe44  1  1.002810  0.491435  0.288217  1
  Fe  Fe45  1  0.251366  0.437208  0.381851  1
  Fe  Fe46  1  0.251208  0.037152  0.327075  1
  Fe  Fe47  1  0.754254  0.437208  0.381851  1
  Fe  Fe48  1  0.754412  0.037152  0.327075  1
  Fe  Fe49  1  1.002810  0.587687  0.368191  1
  Fe  Fe50  1  1.002810  0.184610  0.313611  1
  Fe  Fe51  1  0.761993  0.838594  0.299177  1
  Fe  Fe52  1  0.751537  0.237653  0.353918  1
  Fe  Fe53  1  0.243627  0.838594  0.299177  1
  Fe  Fe54  1  0.254083  0.237653  0.353918  1
  Fe  Fe55  1  0.502810  0.991435  0.288217  1
  Fe  Fe56  1  0.502810  0.387357  0.340636  1
  Fe  Fe57  1  0.753018  0.337471  0.437700  1
  Fe  Fe58  1  0.752644  0.737347  0.493469  1
  Fe  Fe59  1  0.252602  0.337471  0.437700  1
  Fe  Fe60  1  0.252976  0.737347  0.493469  1
  Fe  Fe61  1  0.502810  0.487333  0.423693  1
  Fe  Fe62  1  0.502810  0.887379  0.479549  1
  Fe  Fe63  1  0.252777  0.537386  0.465606  1
  Fe  Fe64  1  0.253244  0.137603  0.409927  1
  Fe  Fe65  1  0.752843  0.537386  0.465606  1
  Fe  Fe66  1  0.752375  0.137603  0.409927  1
  Fe  Fe67  1  1.002810  0.687486  0.451725  1
  Fe  Fe68  1  1.002810  0.287503  0.395730  1
  Fe  Fe69  1  0.252644  0.237347  0.493469  1
  Fe  Fe70  1  0.253018  0.837471  0.437700  1
  Fe  Fe71  1  0.752976  0.237347  0.493469  1
  Fe  Fe72  1  0.752602  0.837471  0.437700  1
  Fe  Fe73  1  1.002810  0.387379  0.479549  1
  Fe  Fe74  1  1.002810  0.987333  0.423693  1
  Fe  Fe75  1  0.753244  0.637603  0.409927  1
  Fe  Fe76  1  0.752777  0.037386  0.465606  1
  Fe  Fe77  1  0.252375  0.637603  0.409927  1
  Fe  Fe78  1  0.252843  0.037386  0.465606  1
  Fe  Fe79  1  0.502810  0.787503  0.395730  1
  Fe  Fe80  1  0.502810  0.187486  0.451725  1
  Fe  Fe81  1  0.753008  0.137203  0.549220  1
  Fe  Fe82  1  0.751621  0.537467  0.605154  1
  Fe  Fe83  1  0.252612  0.137203  0.549220  1
  Fe  Fe84  1  0.253999  0.537467  0.605154  1
  Fe  Fe85  1  0.502810  0.287189  0.535211  1
  Fe  Fe86  1  0.502810  0.687179  0.591105  1
  Fe  Fe87  1  0.253404  0.337093  0.577009  1
  Fe  Fe88  1  0.252618  0.937319  0.521343  1
  Fe  Fe89  1  0.752215  0.337093  0.577009  1
  Fe  Fe90  1  0.753002  0.937319  0.521343  1
  Fe  Fe91  1  1.002810  0.487359  0.563218  1
  Fe  Fe92  1  1.002810  0.087324  0.507401  1
  Fe  Fe93  1  0.251621  0.037467  0.605154  1
  Fe  Fe94  1  0.253008  0.637203  0.549220  1
  Fe  Fe95  1  0.753999  0.037467  0.605154  1
  Fe  Fe96  1  0.752612  0.637203  0.549220  1
  Fe  Fe97  1  1.002810  0.187179  0.591105  1
  Fe  Fe98  1  1.002810  0.787189  0.535211  1
  Fe  Fe99  1  0.752618  0.437319  0.521343  1
  Fe  Fe100  1  0.753404  0.837093  0.577009  1
  Fe  Fe101  1  0.253002  0.437319  0.521343  1
  Fe  Fe102  1  0.252215  0.837093  0.577009  1
  Fe  Fe103  1  0.502810  0.587324  0.507401  1
  Fe  Fe104  1  0.502810  0.987359  0.563218  1
  Fe  Fe105  1  0.750796  0.937147  0.660550  1
  Fe  Fe106  1  0.755276  0.336810  0.714357  1
  Fe  Fe107  1  0.254823  0.937147  0.660550  1
  Fe  Fe108  1  0.250344  0.336810  0.714357  1
  Fe  Fe109  1  0.502810  0.087003  0.646754  1
  Fe  Fe110  1  0.502810  0.484305  0.699804  1
  Fe  Fe111  1  0.260156  0.137055  0.688463  1
  Fe  Fe112  1  0.252075  0.736714  0.632827  1
  Fe  Fe113  1  0.745464  0.137055  0.688463  1
  Fe  Fe114  1  0.753544  0.736714  0.632827  1
  Fe  Fe115  1  1.002810  0.288487  0.672891  1
  Fe  Fe116  1  1.002810  0.887227  0.618926  1
  Fe  Fe117  1  0.255276  0.836810  0.714357  1
  Fe  Fe118  1  0.250796  0.437147  0.660550  1
  Fe  Fe119  1  0.750344  0.836810  0.714357  1
  Fe  Fe120  1  0.754823  0.437147  0.660550  1
  Fe  Fe121  1  1.002810  0.984305  0.699804  1
  Fe  Fe122  1  1.002810  0.587003  0.646754  1
  Fe  Fe123  1  0.752075  0.236714  0.632827  1
  Fe  Fe124  1  0.760156  0.637055  0.688463  1
  Fe  Fe125  1  0.253544  0.236714  0.632827  1
  Fe  Fe126  1  0.245464  0.637055  0.688463  1
  Fe  Fe127  1  0.502810  0.387227  0.618926  1
  Fe  Fe128  1  0.502810  0.788487  0.672891  1
