# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.73250973
_cell_length_b   10.66186097
_cell_length_c   48.09302686
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrNi2
_chemical_formula_sum   'Cr24 Ni48'
_cell_volume   1913.88604184
_cell_formula_units_Z   24
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
  Cr  Cr1  1  1.005732  0.095980  0.319411  1
  Cr  Cr2  1  1.005732  0.926964  0.356518  1
  Cr  Cr3  1  1.005732  0.252839  0.280669  1
  Cr  Cr4  1  0.505732  0.752839  0.280669  1
  Cr  Cr5  1  0.505732  0.595980  0.319411  1
  Cr  Cr6  1  0.505732  0.426964  0.356518  1
  Cr  Cr7  1  1.005732  0.589907  0.430685  1
  Cr  Cr8  1  1.005732  0.421313  0.467753  1
  Cr  Cr9  1  1.005732  0.758499  0.393631  1
  Cr  Cr10  1  0.505732  0.258499  0.393631  1
  Cr  Cr11  1  0.505732  0.089907  0.430685  1
  Cr  Cr12  1  0.505732  0.921313  0.467753  1
  Cr  Cr13  1  1.005732  0.084134  0.541899  1
  Cr  Cr14  1  1.005732  0.915501  0.578968  1
  Cr  Cr15  1  1.005732  0.252728  0.504825  1
  Cr  Cr16  1  0.505732  0.752728  0.504825  1
  Cr  Cr17  1  0.505732  0.584134  0.541899  1
  Cr  Cr18  1  0.505732  0.415501  0.578968  1
  Cr  Cr19  1  1.005732  0.577471  0.653185  1
  Cr  Cr20  1  1.005732  0.406851  0.691362  1
  Cr  Cr21  1  1.005732  0.747257  0.615978  1
  Cr  Cr22  1  0.505732  0.247257  0.615978  1
  Cr  Cr23  1  0.505732  0.077471  0.653185  1
  Cr  Cr24  1  0.505732  0.906851  0.691362  1
  Ni  Ni25  1  0.505732  0.925719  0.319605  1
  Ni  Ni26  1  0.505732  0.758145  0.356081  1
  Ni  Ni27  1  0.505732  0.589333  0.393005  1
  Ni  Ni28  1  1.005732  0.932150  0.283920  1
  Ni  Ni29  1  1.005732  0.763650  0.320153  1
  Ni  Ni30  1  1.005732  0.596190  0.357163  1
  Ni  Ni31  1  1.005732  0.258145  0.356081  1
  Ni  Ni32  1  1.005732  0.089333  0.393005  1
  Ni  Ni33  1  1.005732  0.425719  0.319605  1
  Ni  Ni34  1  0.505732  0.096190  0.357163  1
  Ni  Ni35  1  0.505732  0.432150  0.283920  1
  Ni  Ni36  1  0.505732  0.263650  0.320153  1
  Ni  Ni37  1  0.505732  0.420854  0.430102  1
  Ni  Ni38  1  0.505732  0.252242  0.467177  1
  Ni  Ni39  1  0.505732  0.083639  0.504246  1
  Ni  Ni40  1  1.005732  0.427618  0.394185  1
  Ni  Ni41  1  1.005732  0.258976  0.431259  1
  Ni  Ni42  1  1.005732  0.090400  0.468334  1
  Ni  Ni43  1  1.005732  0.752242  0.467177  1
  Ni  Ni44  1  1.005732  0.583639  0.504246  1
  Ni  Ni45  1  1.005732  0.920854  0.430102  1
  Ni  Ni46  1  0.505732  0.590400  0.468334  1
  Ni  Ni47  1  0.505732  0.927618  0.394185  1
  Ni  Ni48  1  0.505732  0.758976  0.431259  1
  Ni  Ni49  1  0.505732  0.915059  0.541319  1
  Ni  Ni50  1  0.505732  0.746483  0.578394  1
  Ni  Ni51  1  0.505732  0.577538  0.615440  1
  Ni  Ni52  1  1.005732  0.921812  0.505404  1
  Ni  Ni53  1  1.005732  0.753204  0.542467  1
  Ni  Ni54  1  1.005732  0.584617  0.579559  1
  Ni  Ni55  1  1.005732  0.246483  0.578394  1
  Ni  Ni56  1  1.005732  0.077538  0.615440  1
  Ni  Ni57  1  1.005732  0.415059  0.541319  1
  Ni  Ni58  1  0.505732  0.084617  0.579559  1
  Ni  Ni59  1  0.505732  0.421812  0.505404  1
  Ni  Ni60  1  0.505732  0.253204  0.542467  1
  Ni  Ni61  1  0.505732  0.410000  0.652777  1
  Ni  Ni62  1  0.505732  0.243511  0.688912  1
  Ni  Ni63  1  0.505732  0.082090  0.724681  1
  Ni  Ni64  1  1.005732  0.416397  0.616690  1
  Ni  Ni65  1  1.005732  0.247676  0.652695  1
  Ni  Ni66  1  1.005732  0.082924  0.690273  1
  Ni  Ni67  1  1.005732  0.743511  0.688912  1
  Ni  Ni68  1  1.005732  0.582090  0.724681  1
  Ni  Ni69  1  1.005732  0.910000  0.652777  1
  Ni  Ni70  1  0.505732  0.582924  0.690273  1
  Ni  Ni71  1  0.505732  0.916397  0.616690  1
  Ni  Ni72  1  0.505732  0.747676  0.652695  1
