# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66099678
_cell_length_b   4.24183326
_cell_length_c   46.84257438
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   64.26447460
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe13 Ni13'
_cell_volume   655.278489243
_cell_formula_units_Z   13
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  0.346152  0.073289  0.285087  1
  Fe  Fe2  1  0.959565  0.844237  0.318331  1
  Fe  Fe3  1  0.572699  0.616567  0.352665  1
  Fe  Fe4  1  0.187964  0.384723  0.387468  1
  Fe  Fe5  1  0.803170  0.152937  0.421871  1
  Fe  Fe6  1  0.418230  0.921451  0.456357  1
  Fe  Fe7  1  0.033399  0.689756  0.490899  1
  Fe  Fe8  1  0.648542  0.458110  0.525402  1
  Fe  Fe9  1  0.263681  0.226467  0.559884  1
  Fe  Fe10  1  0.878902  0.994671  0.594440  1
  Fe  Fe11  1  0.493841  0.763437  0.628988  1
  Fe  Fe12  1  0.108331  0.533053  0.663136  1
  Fe  Fe13  1  0.726479  0.295459  0.697726  1
  Ni  Ni14  1  0.651538  0.460934  0.301024  1
  Ni  Ni15  1  0.265283  0.232086  0.336019  1
  Ni  Ni16  1  0.880453  0.000417  0.370064  1
  Ni  Ni17  1  0.495604  0.768750  0.404560  1
  Ni  Ni18  1  0.110655  0.537283  0.439154  1
  Ni  Ni19  1  0.725821  0.305592  0.473635  1
  Ni  Ni20  1  0.340983  0.073907  0.508132  1
  Ni  Ni21  1  0.956107  0.842298  0.542661  1
  Ni  Ni22  1  0.571253  0.610645  0.577179  1
  Ni  Ni23  1  0.186467  0.378860  0.611605  1
  Ni  Ni24  1  0.801340  0.147751  0.646200  1
  Ni  Ni25  1  0.417678  0.913647  0.680914  1
  Ni  Ni26  1  0.035479  0.676153  0.714626  1
