# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.51167354
_cell_length_b   15.35159422
_cell_length_c   47.63515326
_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   1836.72543363
_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  1.009853  0.309397  0.281663  1
  Cr  Cr2  1  1.009853  0.783900  0.315449  1
  Cr  Cr3  1  0.509853  0.049275  0.298543  1
  Cr  Cr4  1  0.509853  0.520003  0.334530  1
  Cr  Cr5  1  1.009853  0.257928  0.351982  1
  Cr  Cr6  1  1.009853  0.731982  0.387171  1
  Cr  Cr7  1  0.509853  0.994406  0.369653  1
  Cr  Cr8  1  0.509853  0.469191  0.405569  1
  Cr  Cr9  1  1.009853  0.205884  0.423422  1
  Cr  Cr10  1  1.009853  0.680398  0.459089  1
  Cr  Cr11  1  0.509853  0.942834  0.440909  1
  Cr  Cr12  1  0.509853  0.417489  0.476947  1
  Cr  Cr13  1  1.009853  0.154366  0.494741  1
  Cr  Cr14  1  1.009853  0.628579  0.530481  1
  Cr  Cr15  1  0.509853  0.891405  0.512552  1
  Cr  Cr16  1  0.509853  0.365945  0.548499  1
  Cr  Cr17  1  1.009853  0.102891  0.566093  1
  Cr  Cr18  1  1.009853  0.576861  0.602137  1
  Cr  Cr19  1  0.509853  0.840192  0.584378  1
  Cr  Cr20  1  0.509853  0.313866  0.619954  1
  Cr  Cr21  1  1.009853  0.051371  0.637304  1
  Cr  Cr22  1  1.009853  0.525016  0.673727  1
  Cr  Cr23  1  0.509853  0.788183  0.654544  1
  Cr  Cr24  1  0.509853  0.261257  0.690618  1
  Ni  Ni25  1  0.509853  0.893811  0.286517  1
  Ni  Ni26  1  0.509853  0.363869  0.322450  1
  Ni  Ni27  1  1.009853  0.942121  0.327756  1
  Ni  Ni28  1  1.009853  0.467325  0.292348  1
  Ni  Ni29  1  1.009853  0.100061  0.340256  1
  Ni  Ni30  1  1.009853  0.623845  0.303949  1
  Ni  Ni31  1  0.509853  0.204431  0.310638  1
  Ni  Ni32  1  0.509853  0.677535  0.345403  1
  Ni  Ni33  1  0.509853  0.837016  0.357013  1
  Ni  Ni34  1  0.509853  0.311321  0.393781  1
  Ni  Ni35  1  1.009853  0.888726  0.399012  1
  Ni  Ni36  1  1.009853  0.414898  0.364084  1
  Ni  Ni37  1  1.009853  0.048380  0.411361  1
  Ni  Ni38  1  1.009853  0.574776  0.375841  1
  Ni  Ni39  1  0.509853  0.152228  0.381666  1
  Ni  Ni40  1  0.509853  0.626827  0.417314  1
  Ni  Ni41  1  0.509853  0.785582  0.429105  1
  Ni  Ni42  1  0.509853  0.259920  0.465109  1
  Ni  Ni43  1  1.009853  0.837585  0.470768  1
  Ni  Ni44  1  1.009853  0.363582  0.435262  1
  Ni  Ni45  1  1.009853  0.996733  0.482762  1
  Ni  Ni46  1  1.009853  0.523066  0.447209  1
  Ni  Ni47  1  0.509853  0.100355  0.453003  1
  Ni  Ni48  1  0.509853  0.574858  0.488790  1
  Ni  Ni49  1  0.509853  0.734233  0.500842  1
  Ni  Ni50  1  0.509853  0.208392  0.536474  1
  Ni  Ni51  1  1.009853  0.786196  0.542508  1
  Ni  Ni52  1  1.009853  0.312040  0.506697  1
  Ni  Ni53  1  1.009853  0.945217  0.554284  1
  Ni  Ni54  1  1.009853  0.471275  0.518702  1
  Ni  Ni55  1  0.509853  0.048829  0.524392  1
  Ni  Ni56  1  0.509853  0.523107  0.560348  1
  Ni  Ni57  1  0.509853  0.682177  0.572132  1
  Ni  Ni58  1  0.509853  0.156832  0.607777  1
  Ni  Ni59  1  1.009853  0.734098  0.613483  1
  Ni  Ni60  1  1.009853  0.260489  0.578085  1
  Ni  Ni61  1  1.009853  0.895071  0.626218  1
  Ni  Ni62  1  1.009853  0.419710  0.590425  1
  Ni  Ni63  1  0.509853  0.997452  0.595743  1
  Ni  Ni64  1  0.509853  0.471855  0.632217  1
  Ni  Ni65  1  0.509853  0.631171  0.643829  1
  Ni  Ni66  1  0.509853  0.103270  0.679434  1
  Ni  Ni67  1  1.009853  0.684517  0.685295  1
  Ni  Ni68  1  1.009853  0.207718  0.649509  1
  Ni  Ni69  1  1.009853  0.839080  0.696536  1
  Ni  Ni70  1  1.009853  0.367265  0.661516  1
  Ni  Ni71  1  0.509853  0.946289  0.668365  1
  Ni  Ni72  1  0.509853  0.416103  0.702835  1
