# generated using pymatgen
data_FeNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51910385
_cell_length_b   4.18118473
_cell_length_c   46.29475888
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   74.66756833
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi
_chemical_formula_sum   'Fe22 Ni22'
_cell_volume   1030.2924282
_cell_formula_units_Z   22
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  0.997165  0.864591  0.284483  1
  Fe  Fe2  1  0.437722  0.709972  0.303692  1
  Fe  Fe3  1  0.864501  0.556388  0.324489  1
  Fe  Fe4  1  0.294583  0.406934  0.344670  1
  Fe  Fe5  1  0.725203  0.255317  0.364646  1
  Fe  Fe6  1  0.155089  0.105317  0.384567  1
  Fe  Fe7  1  0.584950  0.955065  0.404505  1
  Fe  Fe8  1  0.015010  0.804905  0.424519  1
  Fe  Fe9  1  0.445098  0.654727  0.444538  1
  Fe  Fe10  1  0.875182  0.504424  0.464534  1
  Fe  Fe11  1  0.305242  0.354138  0.484521  1
  Fe  Fe12  1  0.735278  0.203876  0.504513  1
  Fe  Fe13  1  0.165313  0.053646  0.524505  1
  Fe  Fe14  1  0.595375  0.903394  0.544502  1
  Fe  Fe15  1  0.025398  0.753056  0.564483  1
  Fe  Fe16  1  0.455543  0.602886  0.584486  1
  Fe  Fe17  1  0.885551  0.452516  0.604517  1
  Fe  Fe18  1  0.315606  0.302648  0.624461  1
  Fe  Fe19  1  0.745703  0.152112  0.644518  1
  Fe  Fe20  1  0.174371  0.001486  0.664282  1
  Fe  Fe21  1  0.607037  0.846484  0.684646  1
  Fe  Fe22  1  0.039208  0.697332  0.705058  1
  Ni  Ni23  1  0.217348  0.286087  0.294543  1
  Ni  Ni24  1  0.648190  0.135515  0.314628  1
  Ni  Ni25  1  0.081410  0.980337  0.334590  1
  Ni  Ni26  1  0.509624  0.830804  0.354421  1
  Ni  Ni27  1  0.939699  0.680525  0.374515  1
  Ni  Ni28  1  0.370039  0.530379  0.394567  1
  Ni  Ni29  1  0.800073  0.380041  0.414567  1
  Ni  Ni30  1  0.230129  0.229782  0.434539  1
  Ni  Ni31  1  0.660137  0.079523  0.454518  1
  Ni  Ni32  1  0.090173  0.929282  0.474517  1
  Ni  Ni33  1  0.520243  0.779030  0.494518  1
  Ni  Ni34  1  0.950295  0.628755  0.514509  1
  Ni  Ni35  1  0.380370  0.478508  0.534504  1
  Ni  Ni36  1  0.810420  0.328225  0.554507  1
  Ni  Ni37  1  0.240434  0.178019  0.574490  1
  Ni  Ni38  1  0.670533  0.027743  0.594495  1
  Ni  Ni39  1  0.100412  0.877406  0.614432  1
  Ni  Ni40  1  0.530752  0.727623  0.634472  1
  Ni  Ni41  1  0.961005  0.576247  0.654546  1
  Ni  Ni42  1  0.390477  0.426571  0.674473  1
  Ni  Ni43  1  0.818661  0.273844  0.694932  1
  Ni  Ni44  1  0.255045  0.123442  0.713582  1
