# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.00744682
_cell_length_b   8.53061781
_cell_length_c   48.11271867
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   70.97097583
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe72 Ni72'
_cell_volume   3494.91277149
_cell_formula_units_Z   72
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
  Fe  Fe1  1  0.894721  0.635553  0.308885  1
  Fe  Fe2  1  0.266193  0.680025  0.295806  1
  Fe  Fe3  1  0.632609  0.727291  0.283893  1
  Fe  Fe4  1  0.894721  0.135553  0.308885  1
  Fe  Fe5  1  0.266193  0.180025  0.295806  1
  Fe  Fe6  1  0.632609  0.227291  0.283893  1
  Fe  Fe7  1  0.783637  0.498660  0.345760  1
  Fe  Fe8  1  0.154083  0.543263  0.333866  1
  Fe  Fe9  1  0.525569  0.587481  0.321053  1
  Fe  Fe10  1  0.783637  0.998660  0.345760  1
  Fe  Fe11  1  0.154083  0.043263  0.333866  1
  Fe  Fe12  1  0.525569  0.087481  0.321053  1
  Fe  Fe13  1  0.670585  0.365238  0.382856  1
  Fe  Fe14  1  0.041585  0.409552  0.370479  1
  Fe  Fe15  1  0.412351  0.454338  0.358238  1
  Fe  Fe16  1  0.670585  0.865238  0.382856  1
  Fe  Fe17  1  0.041585  0.909552  0.370479  1
  Fe  Fe18  1  0.412351  0.954338  0.358238  1
  Fe  Fe19  1  0.557875  0.231856  0.419872  1
  Fe  Fe20  1  0.928696  0.276355  0.407555  1
  Fe  Fe21  1  0.299775  0.320781  0.395131  1
  Fe  Fe22  1  0.557875  0.731856  0.419872  1
  Fe  Fe23  1  0.928696  0.776355  0.407555  1
  Fe  Fe24  1  0.299775  0.820781  0.395131  1
  Fe  Fe25  1  0.445140  0.098451  0.456997  1
  Fe  Fe26  1  0.816035  0.142895  0.444622  1
  Fe  Fe27  1  0.186959  0.187440  0.432296  1
  Fe  Fe28  1  0.445140  0.598451  0.456997  1
  Fe  Fe29  1  0.816035  0.642895  0.444622  1
  Fe  Fe30  1  0.186959  0.687440  0.432296  1
  Fe  Fe31  1  0.332405  0.964989  0.494054  1
  Fe  Fe32  1  0.703298  0.009465  0.481710  1
  Fe  Fe33  1  0.074228  0.053924  0.469344  1
  Fe  Fe34  1  0.332405  0.464989  0.494054  1
  Fe  Fe35  1  0.703298  0.509465  0.481710  1
  Fe  Fe36  1  0.074228  0.553924  0.469344  1
  Fe  Fe37  1  0.219636  0.831573  0.531136  1
  Fe  Fe38  1  0.590566  0.876032  0.518770  1
  Fe  Fe39  1  0.961459  0.920508  0.506426  1
  Fe  Fe40  1  0.219636  0.331573  0.531136  1
  Fe  Fe41  1  0.590566  0.376032  0.518770  1
  Fe  Fe42  1  0.961459  0.420508  0.506426  1
  Fe  Fe43  1  0.106905  0.698057  0.568184  1
  Fe  Fe44  1  0.477828  0.742602  0.555858  1
  Fe  Fe45  1  0.848724  0.787046  0.543483  1
  Fe  Fe46  1  0.106905  0.198057  0.568184  1
  Fe  Fe47  1  0.477828  0.242602  0.555858  1
  Fe  Fe48  1  0.848724  0.287046  0.543483  1
  Fe  Fe49  1  0.994089  0.564717  0.605349  1
  Fe  Fe50  1  0.365168  0.609143  0.592925  1
  Fe  Fe51  1  0.735989  0.653642  0.580609  1
  Fe  Fe52  1  0.994089  0.064717  0.605349  1
  Fe  Fe53  1  0.365168  0.109143  0.592925  1
  Fe  Fe54  1  0.735989  0.153642  0.580609  1
  Fe  Fe55  1  0.881513  0.431159  0.642243  1
  Fe  Fe56  1  0.252279  0.475946  0.630001  1
  Fe  Fe57  1  0.623279  0.520259  0.617624  1
  Fe  Fe58  1  0.881513  0.931159  0.642243  1
  Fe  Fe59  1  0.252279  0.975946  0.630001  1
  Fe  Fe60  1  0.623279  0.020259  0.617624  1
  Fe  Fe61  1  0.768295  0.298016  0.679427  1
  Fe  Fe62  1  0.139781  0.342234  0.666614  1
  Fe  Fe63  1  0.510227  0.386837  0.654721  1
  Fe  Fe64  1  0.768295  0.798016  0.679427  1
  Fe  Fe65  1  0.139781  0.842234  0.666614  1
  Fe  Fe66  1  0.510227  0.886837  0.654721  1
  Fe  Fe67  1  0.661255  0.158206  0.716587  1
  Fe  Fe68  1  0.027671  0.205472  0.704674  1
  Fe  Fe69  1  0.399143  0.249944  0.691595  1
  Fe  Fe70  1  0.661255  0.658206  0.716587  1
  Fe  Fe71  1  0.027671  0.705472  0.704674  1
  Fe  Fe72  1  0.399143  0.749944  0.691595  1
  Ni  Ni73  1  0.767086  0.429861  0.296672  1
  Ni  Ni74  1  0.134073  0.475333  0.285216  1
  Ni  Ni75  1  0.393395  0.385355  0.309063  1
  Ni  Ni76  1  0.767086  0.929861  0.296672  1
  Ni  Ni77  1  0.134073  0.975333  0.285216  1
  Ni  Ni78  1  0.393395  0.885355  0.309063  1
  Ni  Ni79  1  0.654065  0.293641  0.333464  1
  Ni  Ni80  1  0.025458  0.337851  0.320908  1
  Ni  Ni81  1  0.283311  0.248563  0.345535  1
  Ni  Ni82  1  0.654065  0.793641  0.333464  1
  Ni  Ni83  1  0.025458  0.837851  0.320908  1
  Ni  Ni84  1  0.283311  0.748563  0.345535  1
  Ni  Ni85  1  0.541484  0.159506  0.370358  1
  Ni  Ni86  1  0.912356  0.204410  0.358084  1
  Ni  Ni87  1  0.170637  0.115553  0.382934  1
  Ni  Ni88  1  0.541484  0.659506  0.370358  1
  Ni  Ni89  1  0.912356  0.704410  0.358084  1
  Ni  Ni90  1  0.170637  0.615553  0.382934  1
  Ni  Ni91  1  0.428866  0.026440  0.407588  1
  Ni  Ni92  1  0.799664  0.070795  0.395181  1
  Ni  Ni93  1  0.057865  0.981817  0.419916  1
  Ni  Ni94  1  0.428866  0.526440  0.407588  1
  Ni  Ni95  1  0.799664  0.570795  0.395181  1
  Ni  Ni96  1  0.057865  0.481817  0.419916  1
  Ni  Ni97  1  0.316057  0.892883  0.444610  1
  Ni  Ni98  1  0.686972  0.937408  0.432281  1
  Ni  Ni99  1  0.945122  0.848419  0.456991  1
  Ni  Ni100  1  0.316057  0.392883  0.444610  1
  Ni  Ni101  1  0.686972  0.437408  0.432281  1
  Ni  Ni102  1  0.945122  0.348419  0.456991  1
  Ni  Ni103  1  0.203308  0.759490  0.481708  1
  Ni  Ni104  1  0.574211  0.803927  0.469331  1
  Ni  Ni105  1  0.832376  0.714964  0.494056  1
  Ni  Ni106  1  0.203308  0.259490  0.481708  1
  Ni  Ni107  1  0.574211  0.303927  0.469331  1
  Ni  Ni108  1  0.832376  0.214964  0.494056  1
  Ni  Ni109  1  0.090556  0.626007  0.518772  1
  Ni  Ni110  1  0.461488  0.670533  0.506424  1
  Ni  Ni111  1  0.719653  0.581571  0.531149  1
  Ni  Ni112  1  0.090556  0.126007  0.518772  1
  Ni  Ni113  1  0.461488  0.170533  0.506424  1
  Ni  Ni114  1  0.719653  0.081571  0.531149  1
  Ni  Ni115  1  0.977807  0.492615  0.555870  1
  Ni  Ni116  1  0.348742  0.537079  0.543489  1
  Ni  Ni117  1  0.606892  0.448089  0.568199  1
  Ni  Ni118  1  0.977807  0.992615  0.555870  1
  Ni  Ni119  1  0.348742  0.037079  0.543489  1
  Ni  Ni120  1  0.606892  0.948089  0.568199  1
  Ni  Ni121  1  0.864998  0.359057  0.592892  1
  Ni  Ni122  1  0.235999  0.403680  0.580564  1
  Ni  Ni123  1  0.494199  0.314702  0.605299  1
  Ni  Ni124  1  0.864998  0.859057  0.592892  1
  Ni  Ni125  1  0.235999  0.903680  0.580564  1
  Ni  Ni126  1  0.494199  0.814702  0.605299  1
  Ni  Ni127  1  0.752380  0.225991  0.630122  1
  Ni  Ni128  1  0.123226  0.269944  0.617547  1
  Ni  Ni129  1  0.381508  0.181087  0.642396  1
  Ni  Ni130  1  0.752380  0.725991  0.630122  1
  Ni  Ni131  1  0.123226  0.769944  0.617547  1
  Ni  Ni132  1  0.381508  0.681087  0.642396  1
  Ni  Ni133  1  0.639799  0.091856  0.667016  1
  Ni  Ni134  1  0.010553  0.136935  0.654945  1
  Ni  Ni135  1  0.268406  0.047646  0.679572  1
  Ni  Ni136  1  0.639799  0.591856  0.667016  1
  Ni  Ni137  1  0.010553  0.636935  0.654945  1
  Ni  Ni138  1  0.268406  0.547646  0.679572  1
  Ni  Ni139  1  0.526777  0.955636  0.703808  1
  Ni  Ni140  1  0.900469  0.000142  0.691417  1
  Ni  Ni141  1  0.159791  0.910164  0.715264  1
  Ni  Ni142  1  0.526777  0.455636  0.703808  1
  Ni  Ni143  1  0.900469  0.500142  0.691417  1
  Ni  Ni144  1  0.159791  0.410164  0.715264  1
