# generated using pymatgen
data_FeNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.49730459
_cell_length_b   7.86713883
_cell_length_c   47.22592639
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeNi3
_chemical_formula_sum   'Fe14 Ni42'
_cell_volume   1299.36378369
_cell_formula_units_Z   14
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  1.002650  0.576212  0.307741  1
  Fe  Fe2  1  1.002650  0.179530  0.274288  1
  Fe  Fe3  1  1.002650  0.375244  0.374275  1
  Fe  Fe4  1  1.002650  0.975701  0.340918  1
  Fe  Fe5  1  1.002650  0.175004  0.441007  1
  Fe  Fe6  1  1.002650  0.775112  0.407633  1
  Fe  Fe7  1  1.002650  0.974681  0.507764  1
  Fe  Fe8  1  1.002650  0.574816  0.474381  1
  Fe  Fe9  1  1.002650  0.774308  0.574488  1
  Fe  Fe10  1  1.002650  0.374514  0.541133  1
  Fe  Fe11  1  1.002650  0.574136  0.641240  1
  Fe  Fe12  1  1.002650  0.174235  0.607930  1
  Fe  Fe13  1  1.002650  0.370567  0.708058  1
  Fe  Fe14  1  1.002650  0.973589  0.674198  1
  Ni  Ni15  1  0.502650  0.379477  0.291233  1
  Ni  Ni16  1  0.502650  0.776041  0.324360  1
  Ni  Ni17  1  1.002650  0.275491  0.324274  1
  Ni  Ni18  1  1.002650  0.877101  0.291115  1
  Ni  Ni19  1  0.502650  0.679217  0.275525  1
  Ni  Ni20  1  0.502650  0.076027  0.307524  1
  Ni  Ni21  1  0.502650  0.175111  0.357495  1
  Ni  Ni22  1  0.502650  0.575246  0.390948  1
  Ni  Ni23  1  1.002650  0.075252  0.390947  1
  Ni  Ni24  1  1.002650  0.675257  0.357505  1
  Ni  Ni25  1  0.502650  0.475416  0.340908  1
  Ni  Ni26  1  0.502650  0.875325  0.374307  1
  Ni  Ni27  1  0.502650  0.975100  0.424337  1
  Ni  Ni28  1  0.502650  0.374885  0.457690  1
  Ni  Ni29  1  1.002650  0.874911  0.457699  1
  Ni  Ni30  1  1.002650  0.475061  0.424323  1
  Ni  Ni31  1  0.502650  0.275107  0.407613  1
  Ni  Ni32  1  0.502650  0.674989  0.441012  1
  Ni  Ni33  1  0.502650  0.774753  0.491071  1
  Ni  Ni34  1  0.502650  0.174606  0.524453  1
  Ni  Ni35  1  1.002650  0.674578  0.524439  1
  Ni  Ni36  1  1.002650  0.274746  0.491071  1
  Ni  Ni37  1  0.502650  0.074837  0.474390  1
  Ni  Ni38  1  0.502650  0.474661  0.507754  1
  Ni  Ni39  1  0.502650  0.574410  0.557818  1
  Ni  Ni40  1  0.502650  0.974335  0.591187  1
  Ni  Ni41  1  1.002650  0.474234  0.591194  1
  Ni  Ni42  1  1.002650  0.074472  0.557833  1
  Ni  Ni43  1  0.502650  0.874524  0.541134  1
  Ni  Ni44  1  0.502650  0.274349  0.574518  1
  Ni  Ni45  1  0.502650  0.374132  0.624580  1
  Ni  Ni46  1  0.502650  0.773899  0.658048  1
  Ni  Ni47  1  1.002650  0.274246  0.658085  1
  Ni  Ni48  1  1.002650  0.873931  0.624488  1
  Ni  Ni49  1  0.502650  0.674162  0.607877  1
  Ni  Ni50  1  0.502650  0.074330  0.641297  1
  Ni  Ni51  1  0.502650  0.171912  0.691284  1
  Ni  Ni52  1  0.502650  0.572182  0.723514  1
  Ni  Ni53  1  1.002650  0.066218  0.723270  1
  Ni  Ni54  1  1.002650  0.673648  0.691356  1
  Ni  Ni55  1  0.502650  0.473925  0.674589  1
  Ni  Ni56  1  0.502650  0.870764  0.707715  1
