# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.52247023
_cell_length_b   8.34449708
_cell_length_c   47.39141589
_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   'Cr12 Ni24'
_cell_volume   997.529851488
_cell_formula_units_Z   12
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  1.000632  0.164045  0.293572  1
  Cr  Cr2  1  0.500632  0.664045  0.293572  1
  Cr  Cr3  1  1.000632  0.954435  0.367564  1
  Cr  Cr4  1  0.500632  0.454435  0.367564  1
  Cr  Cr5  1  1.000632  0.753689  0.438687  1
  Cr  Cr6  1  0.500632  0.253689  0.438687  1
  Cr  Cr7  1  1.000632  0.551905  0.510066  1
  Cr  Cr8  1  0.500632  0.051905  0.510066  1
  Cr  Cr9  1  1.000632  0.349098  0.581702  1
  Cr  Cr10  1  0.500632  0.849098  0.581702  1
  Cr  Cr11  1  1.000632  0.152041  0.651922  1
  Cr  Cr12  1  0.500632  0.652041  0.651922  1
  Ni  Ni13  1  0.500632  0.193294  0.343811  1
  Ni  Ni14  1  1.000632  0.422177  0.319625  1
  Ni  Ni15  1  1.000632  0.693294  0.343811  1
  Ni  Ni16  1  0.500632  0.922177  0.319625  1
  Ni  Ni17  1  0.500632  0.991078  0.415315  1
  Ni  Ni18  1  1.000632  0.217287  0.390752  1
  Ni  Ni19  1  1.000632  0.491078  0.415315  1
  Ni  Ni20  1  0.500632  0.717287  0.390752  1
  Ni  Ni21  1  0.500632  0.789448  0.486648  1
  Ni  Ni22  1  1.000632  0.016065  0.462186  1
  Ni  Ni23  1  1.000632  0.289448  0.486648  1
  Ni  Ni24  1  0.500632  0.516065  0.462186  1
  Ni  Ni25  1  0.500632  0.587067  0.557966  1
  Ni  Ni26  1  1.000632  0.814104  0.533625  1
  Ni  Ni27  1  1.000632  0.087067  0.557966  1
  Ni  Ni28  1  0.500632  0.314104  0.533625  1
  Ni  Ni29  1  0.500632  0.387657  0.629681  1
  Ni  Ni30  1  1.000632  0.612405  0.604717  1
  Ni  Ni31  1  1.000632  0.887657  0.629681  1
  Ni  Ni32  1  0.500632  0.112405  0.604717  1
  Ni  Ni33  1  0.500632  0.182893  0.699788  1
  Ni  Ni34  1  1.000632  0.412279  0.676729  1
  Ni  Ni35  1  1.000632  0.682893  0.699788  1
  Ni  Ni36  1  0.500632  0.912279  0.676729  1
