# generated using pymatgen
data_CrNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.49125643
_cell_length_b   4.53421715
_cell_length_c   46.21842610
_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   'Cr20 Ni40'
_cell_volume   1569.9005114
_cell_formula_units_Z   20
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  0.000238  0.984611  0.293403  1
  Cr  Cr2  1  0.500238  0.484611  0.293403  1
  Cr  Cr3  1  0.000238  0.686693  0.340603  1
  Cr  Cr4  1  0.500238  0.186693  0.340603  1
  Cr  Cr5  1  0.000238  0.373816  0.385970  1
  Cr  Cr6  1  0.500238  0.873816  0.385970  1
  Cr  Cr7  1  0.000238  0.064061  0.431424  1
  Cr  Cr8  1  0.500238  0.564061  0.431424  1
  Cr  Cr9  1  0.000238  0.754667  0.476890  1
  Cr  Cr10  1  0.500238  0.254667  0.476890  1
  Cr  Cr11  1  0.000238  0.445129  0.522338  1
  Cr  Cr12  1  0.500238  0.945129  0.522338  1
  Cr  Cr13  1  0.000238  0.135735  0.567804  1
  Cr  Cr14  1  0.500238  0.635735  0.567804  1
  Cr  Cr15  1  0.000238  0.825980  0.613258  1
  Cr  Cr16  1  0.500238  0.325980  0.613258  1
  Cr  Cr17  1  1.000238  0.513103  0.658625  1
  Cr  Cr18  1  0.500238  0.013103  0.658625  1
  Cr  Cr19  1  1.000238  0.215185  0.705825  1
  Cr  Cr20  1  0.500238  0.715185  0.705825  1
  Ni  Ni21  1  0.169488  0.484846  0.295820  1
  Ni  Ni22  1  0.330988  0.984846  0.295820  1
  Ni  Ni23  1  0.669488  0.984846  0.295820  1
  Ni  Ni24  1  0.830988  0.484846  0.295820  1
  Ni  Ni25  1  0.171052  0.181613  0.340585  1
  Ni  Ni26  1  0.329424  0.681613  0.340585  1
  Ni  Ni27  1  0.671052  0.681613  0.340585  1
  Ni  Ni28  1  0.829424  0.181613  0.340585  1
  Ni  Ni29  1  0.171936  0.873546  0.385989  1
  Ni  Ni30  1  0.328540  0.373546  0.385989  1
  Ni  Ni31  1  0.671936  0.373546  0.385989  1
  Ni  Ni32  1  0.828540  0.873546  0.385989  1
  Ni  Ni33  1  0.171761  0.564105  0.431439  1
  Ni  Ni34  1  0.328715  0.064105  0.431439  1
  Ni  Ni35  1  0.671761  0.064105  0.431439  1
  Ni  Ni36  1  0.828715  0.564105  0.431439  1
  Ni  Ni37  1  0.171765  0.254632  0.476887  1
  Ni  Ni38  1  0.328711  0.754632  0.476887  1
  Ni  Ni39  1  0.671765  0.754632  0.476887  1
  Ni  Ni40  1  0.828711  0.254632  0.476887  1
  Ni  Ni41  1  0.171765  0.945164  0.522341  1
  Ni  Ni42  1  0.328711  0.445164  0.522341  1
  Ni  Ni43  1  0.671765  0.445164  0.522341  1
  Ni  Ni44  1  0.828711  0.945164  0.522341  1
  Ni  Ni45  1  0.171761  0.635690  0.567789  1
  Ni  Ni46  1  0.328715  0.135690  0.567789  1
  Ni  Ni47  1  0.671761  0.135690  0.567789  1
  Ni  Ni48  1  0.828715  0.635690  0.567789  1
  Ni  Ni49  1  0.171936  0.326249  0.613239  1
  Ni  Ni50  1  0.328540  0.826249  0.613239  1
  Ni  Ni51  1  0.671936  0.826249  0.613239  1
  Ni  Ni52  1  0.828540  0.326249  0.613239  1
  Ni  Ni53  1  0.171052  0.018182  0.658643  1
  Ni  Ni54  1  0.329424  0.518182  0.658643  1
  Ni  Ni55  1  0.671052  0.518182  0.658643  1
  Ni  Ni56  1  0.829424  0.018182  0.658643  1
  Ni  Ni57  1  0.169488  0.714950  0.703408  1
  Ni  Ni58  1  0.330988  0.214950  0.703408  1
  Ni  Ni59  1  0.669488  0.214950  0.703408  1
  Ni  Ni60  1  0.830988  0.714950  0.703408  1
