# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.51567589
_cell_length_b   7.47582235
_cell_length_c   49.33182201
_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   927.771050577
_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  1.001984  1.001271  0.283364  1
  Cr  Cr2  1  0.501984  0.501271  0.325333  1
  Cr  Cr3  1  1.001984  0.001271  0.363277  1
  Cr  Cr4  1  0.501984  0.501271  0.401119  1
  Cr  Cr5  1  1.001984  0.001271  0.439806  1
  Cr  Cr6  1  0.501984  0.501271  0.478297  1
  Cr  Cr7  1  1.001984  1.001271  0.516575  1
  Cr  Cr8  1  0.501984  0.501271  0.555066  1
  Cr  Cr9  1  1.001984  1.001271  0.593753  1
  Cr  Cr10  1  0.501984  0.501271  0.631595  1
  Cr  Cr11  1  1.001984  0.001271  0.669539  1
  Cr  Cr12  1  0.501984  0.501271  0.711508  1
  Ni  Ni13  1  0.501984  0.170819  0.324251  1
  Ni  Ni14  1  1.001984  0.332624  0.286597  1
  Ni  Ni15  1  1.001984  0.669918  0.286597  1
  Ni  Ni16  1  0.501984  0.831723  0.324251  1
  Ni  Ni17  1  0.501984  0.172777  0.401478  1
  Ni  Ni18  1  0.001984  0.328838  0.362890  1
  Ni  Ni19  1  1.001984  0.673704  0.362890  1
  Ni  Ni20  1  0.501984  0.829765  0.401478  1
  Ni  Ni21  1  0.501984  0.172674  0.478196  1
  Ni  Ni22  1  1.001984  0.330328  0.439781  1
  Ni  Ni23  1  1.001984  0.672214  0.439781  1
  Ni  Ni24  1  0.501984  0.829867  0.478196  1
  Ni  Ni25  1  0.501984  0.172214  0.555091  1
  Ni  Ni26  1  1.001984  0.329867  0.516676  1
  Ni  Ni27  1  1.001984  0.672674  0.516676  1
  Ni  Ni28  1  0.501984  0.830328  0.555091  1
  Ni  Ni29  1  0.501984  0.173704  0.631982  1
  Ni  Ni30  1  1.001984  0.329765  0.593394  1
  Ni  Ni31  1  1.001984  0.672777  0.593394  1
  Ni  Ni32  1  0.501984  0.828838  0.631982  1
  Ni  Ni33  1  0.501984  0.169918  0.708275  1
  Ni  Ni34  1  1.001984  0.331723  0.670621  1
  Ni  Ni35  1  1.001984  0.670819  0.670621  1
  Ni  Ni36  1  0.501984  0.832624  0.708275  1
