# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.49740605
_cell_length_b   8.25974309
_cell_length_c   47.10532400
_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   'Fe21 Ni21'
_cell_volume   971.685436923
_cell_formula_units_Z   21
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  0.501273  0.366696  0.332330  1
  Fe  Fe2  1  0.501273  0.911777  0.287123  1
  Fe  Fe3  1  0.501273  0.639782  0.310263  1
  Fe  Fe4  1  0.501273  0.541910  0.398785  1
  Fe  Fe5  1  0.501273  0.092165  0.353997  1
  Fe  Fe6  1  0.501273  0.817525  0.376267  1
  Fe  Fe7  1  0.501273  0.717112  0.465273  1
  Fe  Fe8  1  0.501273  0.266792  0.421013  1
  Fe  Fe9  1  0.501273  0.992011  0.443080  1
  Fe  Fe10  1  0.501273  0.892039  0.531973  1
  Fe  Fe11  1  0.501273  0.441976  0.487584  1
  Fe  Fe12  1  0.501273  0.166900  0.509836  1
  Fe  Fe13  1  0.501273  0.066733  0.598781  1
  Fe  Fe14  1  0.501273  0.617011  0.554178  1
  Fe  Fe15  1  0.501273  0.341936  0.576466  1
  Fe  Fe16  1  0.501273  0.242751  0.665336  1
  Fe  Fe17  1  0.501273  0.792313  0.620804  1
  Fe  Fe18  1  0.501273  0.516868  0.642975  1
  Fe  Fe19  1  0.501273  0.422732  0.732421  1
  Fe  Fe20  1  0.501273  0.968409  0.687836  1
  Fe  Fe21  1  0.501273  0.695210  0.709983  1
  Ni  Ni22  1  0.001273  0.414559  0.287751  1
  Ni  Ni23  1  0.001273  0.141960  0.309385  1
  Ni  Ni24  1  0.001273  0.680484  0.266006  1
  Ni  Ni25  1  0.001273  0.592077  0.354492  1
  Ni  Ni26  1  0.001273  0.316749  0.376638  1
  Ni  Ni27  1  0.001273  0.867109  0.331668  1
  Ni  Ni28  1  0.001273  0.767118  0.420787  1
  Ni  Ni29  1  0.001273  0.492014  0.443162  1
  Ni  Ni30  1  0.001273  0.042033  0.398591  1
  Ni  Ni31  1  0.001273  0.941984  0.487538  1
  Ni  Ni32  1  0.001273  0.667012  0.509739  1
  Ni  Ni33  1  0.001273  0.216936  0.465409  1
  Ni  Ni34  1  0.001273  0.116959  0.554288  1
  Ni  Ni35  1  0.001273  0.842003  0.576391  1
  Ni  Ni36  1  0.001273  0.391954  0.532021  1
  Ni  Ni37  1  0.001273  0.291782  0.620884  1
  Ni  Ni38  1  0.001273  0.017047  0.643373  1
  Ni  Ni39  1  0.001273  0.567047  0.598606  1
  Ni  Ni40  1  0.001273  0.468252  0.687510  1
  Ni  Ni41  1  0.001273  0.197798  0.709678  1
  Ni  Ni42  1  0.001273  0.741669  0.665134  1
