# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.50029419
_cell_length_b   10.36535288
_cell_length_c   46.68250185
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.66350550
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe36 Ni36'
_cell_volume   1669.69151459
_cell_formula_units_Z   36
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  0.101860  0.786121  0.279059  1
  Fe  Fe2  1  0.263100  0.109413  0.291014  1
  Fe  Fe3  1  0.424774  0.432972  0.303056  1
  Fe  Fe4  1  0.586036  0.755321  0.316205  1
  Fe  Fe5  1  0.748215  0.079771  0.328789  1
  Fe  Fe6  1  0.909620  0.402723  0.340972  1
  Fe  Fe7  1  0.071214  0.725908  0.353346  1
  Fe  Fe8  1  0.233330  0.050157  0.365779  1
  Fe  Fe9  1  0.394873  0.373344  0.378082  1
  Fe  Fe10  1  0.556557  0.696754  0.390330  1
  Fe  Fe11  1  0.718380  0.020432  0.402702  1
  Fe  Fe12  1  0.880139  0.344010  0.415103  1
  Fe  Fe13  1  0.041851  0.667488  0.427385  1
  Fe  Fe14  1  0.203567  0.990965  0.439739  1
  Fe  Fe15  1  0.365357  0.314590  0.452113  1
  Fe  Fe16  1  0.527092  0.638117  0.464432  1
  Fe  Fe17  1  0.688820  0.961619  0.476788  1
  Fe  Fe18  1  0.850567  0.285160  0.489128  1
  Fe  Fe19  1  0.012285  0.608652  0.501453  1
  Fe  Fe20  1  0.174071  0.932272  0.513826  1
  Fe  Fe21  1  0.335824  0.255820  0.526172  1
  Fe  Fe22  1  0.497480  0.579192  0.538475  1
  Fe  Fe23  1  0.659252  0.902789  0.550826  1
  Fe  Fe24  1  0.821126  0.226569  0.563245  1
  Fe  Fe25  1  0.982731  0.549836  0.575524  1
  Fe  Fe26  1  0.144368  0.873180  0.587791  1
  Fe  Fe27  1  0.306396  0.197264  0.600310  1
  Fe  Fe28  1  0.468028  0.520566  0.612594  1
  Fe  Fe29  1  0.629601  0.843783  0.624779  1
  Fe  Fe30  1  0.791468  0.167603  0.637206  1
  Fe  Fe31  1  0.953445  0.491516  0.649743  1
  Fe  Fe32  1  0.114872  0.814438  0.661894  1
  Fe  Fe33  1  0.276094  0.137105  0.673953  1
  Fe  Fe34  1  0.438962  0.462585  0.687431  1
  Fe  Fe35  1  0.600002  0.784748  0.699668  1
  Fe  Fe36  1  0.760962  0.107131  0.711786  1
  Ni  Ni37  1  0.682478  0.947857  0.285566  1
  Ni  Ni38  1  0.843615  0.270602  0.297659  1
  Ni  Ni39  1  0.005210  0.593820  0.309775  1
  Ni  Ni40  1  0.167309  0.917869  0.322683  1
  Ni  Ni41  1  0.328963  0.241355  0.334845  1
  Ni  Ni42  1  0.490256  0.564019  0.347117  1
  Ni  Ni43  1  0.652246  0.887970  0.359452  1
  Ni  Ni44  1  0.814165  0.211879  0.371897  1
  Ni  Ni45  1  0.975673  0.534974  0.384190  1
  Ni  Ni46  1  0.137475  0.858601  0.396511  1
  Ni  Ni47  1  0.299279  0.182258  0.408943  1
  Ni  Ni48  1  0.461001  0.505762  0.421246  1
  Ni  Ni49  1  0.622711  0.829228  0.433555  1
  Ni  Ni50  1  0.784450  0.152752  0.445932  1
  Ni  Ni51  1  0.946231  0.476367  0.458271  1
  Ni  Ni52  1  0.107953  0.799864  0.470605  1
  Ni  Ni53  1  0.269692  0.123386  0.482961  1
  Ni  Ni54  1  0.431430  0.446914  0.495292  1
  Ni  Ni55  1  0.593167  0.770442  0.507630  1
  Ni  Ni56  1  0.754962  0.094074  0.520012  1
  Ni  Ni57  1  0.916655  0.417511  0.532327  1
  Ni  Ni58  1  0.078340  0.740941  0.544630  1
  Ni  Ni59  1  0.240218  0.064736  0.557049  1
  Ni  Ni60  1  0.401926  0.388197  0.569389  1
  Ni  Ni61  1  0.563526  0.711459  0.581650  1
  Ni  Ni62  1  0.725378  0.035220  0.594010  1
  Ni  Ni63  1  0.887265  0.359017  0.606491  1
  Ni  Ni64  1  0.048800  0.682137  0.618728  1
  Ni  Ni65  1  0.210362  0.005364  0.630938  1
  Ni  Ni66  1  0.372609  0.329867  0.643613  1
  Ni  Ni67  1  0.534292  0.653217  0.655746  1
  Ni  Ni68  1  0.695540  0.975864  0.667949  1
  Ni  Ni69  1  0.857499  0.299929  0.680517  1
  Ni  Ni70  1  0.019440  0.623563  0.693138  1
  Ni  Ni71  1  0.180897  0.946694  0.705187  1
  Ni  Ni72  1  0.341625  0.268928  0.716613  1
