# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.36320813
_cell_length_b   7.98193022
_cell_length_c   49.14692405
_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   'Cr18 Ni36'
_cell_volume   1319.34389732
_cell_formula_units_Z   18
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  0.510317  0.417470  0.276833  1
  Cr  Cr2  1  1.010317  0.917470  0.276833  1
  Cr  Cr3  1  0.510317  0.308902  0.326287  1
  Cr  Cr4  1  1.010317  0.808902  0.326287  1
  Cr  Cr5  1  0.510317  0.204818  0.376335  1
  Cr  Cr6  1  1.010317  0.704818  0.376335  1
  Cr  Cr7  1  0.510317  0.099581  0.426508  1
  Cr  Cr8  1  1.010317  0.599581  0.426508  1
  Cr  Cr9  1  0.510317  0.994383  0.476671  1
  Cr  Cr10  1  1.010317  0.494383  0.476671  1
  Cr  Cr11  1  0.510317  0.889201  0.526830  1
  Cr  Cr12  1  1.010317  0.389201  0.526830  1
  Cr  Cr13  1  0.510317  0.783896  0.576973  1
  Cr  Cr14  1  1.010317  0.283896  0.576973  1
  Cr  Cr15  1  0.510317  0.678903  0.627169  1
  Cr  Cr16  1  1.010317  0.178903  0.627169  1
  Cr  Cr17  1  0.510317  0.575495  0.676421  1
  Cr  Cr18  1  1.010317  0.075495  0.676421  1
  Ni  Ni19  1  1.010317  0.209332  0.293483  1
  Ni  Ni20  1  0.510317  0.010115  0.310441  1
  Ni  Ni21  1  0.510317  0.709332  0.293483  1
  Ni  Ni22  1  1.010317  0.510115  0.310441  1
  Ni  Ni23  1  1.010317  0.106482  0.342989  1
  Ni  Ni24  1  0.510317  0.907383  0.359816  1
  Ni  Ni25  1  0.510317  0.606482  0.342989  1
  Ni  Ni26  1  1.010317  0.407383  0.359816  1
  Ni  Ni27  1  1.010317  0.001682  0.393017  1
  Ni  Ni28  1  0.510317  0.802555  0.409913  1
  Ni  Ni29  1  0.510317  0.501682  0.393017  1
  Ni  Ni30  1  1.010317  0.302555  0.409913  1
  Ni  Ni31  1  1.010317  0.896493  0.443160  1
  Ni  Ni32  1  0.510317  0.697413  0.460052  1
  Ni  Ni33  1  0.510317  0.396493  0.443160  1
  Ni  Ni34  1  1.010317  0.197413  0.460052  1
  Ni  Ni35  1  1.010317  0.791324  0.493307  1
  Ni  Ni36  1  0.510317  0.592250  0.510196  1
  Ni  Ni37  1  0.510317  0.291324  0.493307  1
  Ni  Ni38  1  1.010317  0.092250  0.510196  1
  Ni  Ni39  1  1.010317  0.686127  0.543451  1
  Ni  Ni40  1  0.510317  0.487087  0.560346  1
  Ni  Ni41  1  0.510317  0.186127  0.543451  1
  Ni  Ni42  1  1.010317  0.987087  0.560346  1
  Ni  Ni43  1  1.010317  0.580948  0.593638  1
  Ni  Ni44  1  0.510317  0.381719  0.610414  1
  Ni  Ni45  1  0.510317  0.080948  0.593638  1
  Ni  Ni46  1  1.010317  0.881719  0.610414  1
  Ni  Ni47  1  1.010317  0.476143  0.643546  1
  Ni  Ni48  1  0.510317  0.278474  0.660334  1
  Ni  Ni49  1  0.510317  0.976143  0.643546  1
  Ni  Ni50  1  1.010317  0.778474  0.660334  1
  Ni  Ni51  1  1.010317  0.377002  0.693256  1
  Ni  Ni52  1  0.510317  0.176299  0.708563  1
  Ni  Ni53  1  0.510317  0.877002  0.693256  1
  Ni  Ni54  1  1.010317  0.676299  0.708563  1
