# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.46805747
_cell_length_b   5.98222701
_cell_length_c   47.45815602
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe16 Ni16'
_cell_volume   700.694997584
_cell_formula_units_Z   16
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  1.001064  0.122743  0.300384  1
  Fe  Fe2  1  1.001064  0.459632  0.271260  1
  Fe  Fe3  1  1.001064  0.440814  0.359646  1
  Fe  Fe4  1  1.001064  0.781386  0.330104  1
  Fe  Fe5  1  1.001064  0.760146  0.418300  1
  Fe  Fe6  1  1.001064  0.100597  0.388834  1
  Fe  Fe7  1  1.001064  0.079360  0.477118  1
  Fe  Fe8  1  1.001064  0.419687  0.447801  1
  Fe  Fe9  1  1.001064  0.398484  0.536051  1
  Fe  Fe10  1  1.001064  0.738974  0.506517  1
  Fe  Fe11  1  1.001064  0.717854  0.594654  1
  Fe  Fe12  1  0.001064  0.058148  0.565359  1
  Fe  Fe13  1  0.001064  0.036638  0.653659  1
  Fe  Fe14  1  0.001064  0.377193  0.624411  1
  Fe  Fe15  1  0.001064  0.354049  0.713128  1
  Fe  Fe16  1  0.001064  0.695387  0.682480  1
  Ni  Ni17  1  0.501064  0.791951  0.285789  1
  Ni  Ni18  1  0.501064  0.451987  0.315609  1
  Ni  Ni19  1  0.501064  0.111313  0.344650  1
  Ni  Ni20  1  0.501064  0.770843  0.374194  1
  Ni  Ni21  1  0.501064  0.430208  0.403702  1
  Ni  Ni22  1  0.501064  0.089964  0.432990  1
  Ni  Ni23  1  0.501064  0.749580  0.462415  1
  Ni  Ni24  1  0.501064  0.409063  0.491910  1
  Ni  Ni25  1  0.501064  0.068802  0.521242  1
  Ni  Ni26  1  0.501064  0.728394  0.550607  1
  Ni  Ni27  1  0.501064  0.387749  0.580201  1
  Ni  Ni28  1  0.501064  0.047684  0.609499  1
  Ni  Ni29  1  0.501064  0.707318  0.638655  1
  Ni  Ni30  1  0.501064  0.365823  0.668601  1
  Ni  Ni31  1  0.501064  0.024571  0.697979  1
  Ni  Ni32  1  0.501064  0.688685  0.726319  1
