# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85225148
_cell_length_b   7.66777224
_cell_length_c   46.04684156
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni72
_cell_volume   1625.30026784
_cell_formula_units_Z   72
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
  Ni  Ni1  1  0.492215  0.603197  0.295035  1
  Ni  Ni2  1  0.714182  0.047179  0.317898  1
  Ni  Ni3  1  0.603623  0.326020  0.306568  1
  Ni  Ni4  1  0.377125  0.873060  0.284287  1
  Ni  Ni5  1  0.103623  0.326020  0.306568  1
  Ni  Ni6  1  0.877125  0.873060  0.284287  1
  Ni  Ni7  1  0.992215  0.603197  0.295035  1
  Ni  Ni8  1  0.214182  0.047179  0.317898  1
  Ni  Ni9  1  0.935179  0.489164  0.342414  1
  Ni  Ni10  1  0.158202  0.935201  0.367618  1
  Ni  Ni11  1  0.046738  0.212279  0.354761  1
  Ni  Ni12  1  0.824657  0.768126  0.330526  1
  Ni  Ni13  1  0.546738  0.212279  0.354761  1
  Ni  Ni14  1  0.324657  0.768126  0.330526  1
  Ni  Ni15  1  0.435179  0.489164  0.342414  1
  Ni  Ni16  1  0.658202  0.935201  0.367618  1
  Ni  Ni17  1  0.379478  0.377745  0.392817  1
  Ni  Ni18  1  0.602035  0.822855  0.418064  1
  Ni  Ni19  1  0.490861  0.100508  0.405423  1
  Ni  Ni20  1  0.268528  0.655851  0.380361  1
  Ni  Ni21  1  0.990861  0.100508  0.405423  1
  Ni  Ni22  1  0.768528  0.655851  0.380361  1
  Ni  Ni23  1  0.879478  0.377745  0.392817  1
  Ni  Ni24  1  0.102035  0.822855  0.418064  1
  Ni  Ni25  1  0.824185  0.267147  0.443203  1
  Ni  Ni26  1  0.046475  0.711722  0.468386  1
  Ni  Ni27  1  0.935357  0.989488  0.455791  1
  Ni  Ni28  1  0.713042  0.544865  0.430652  1
  Ni  Ni29  1  0.435357  0.989488  0.455791  1
  Ni  Ni30  1  0.213042  0.544865  0.430652  1
  Ni  Ni31  1  0.324185  0.267147  0.443203  1
  Ni  Ni32  1  0.546475  0.711722  0.468386  1
  Ni  Ni33  1  0.268695  0.156154  0.493554  1
  Ni  Ni34  1  0.490957  0.600673  0.518724  1
  Ni  Ni35  1  0.379833  0.878428  0.506142  1
  Ni  Ni36  1  0.157570  0.433908  0.480973  1
  Ni  Ni37  1  0.879833  0.878428  0.506142  1
  Ni  Ni38  1  0.657570  0.433908  0.480973  1
  Ni  Ni39  1  0.768695  0.156154  0.493554  1
  Ni  Ni40  1  0.990957  0.600673  0.518724  1
  Ni  Ni41  1  0.713171  0.045094  0.543906  1
  Ni  Ni42  1  0.935485  0.489717  0.569045  1
  Ni  Ni43  1  0.824343  0.767435  0.556493  1
  Ni  Ni44  1  0.602052  0.322859  0.531310  1
  Ni  Ni45  1  0.324343  0.767435  0.556493  1
  Ni  Ni46  1  0.102052  0.322859  0.531310  1
  Ni  Ni47  1  0.213171  0.045094  0.543906  1
  Ni  Ni48  1  0.435485  0.489717  0.569045  1
  Ni  Ni49  1  0.157667  0.934074  0.594274  1
  Ni  Ni50  1  0.379999  0.378731  0.619335  1
  Ni  Ni51  1  0.269049  0.656837  0.606879  1
  Ni  Ni52  1  0.046492  0.211726  0.581632  1
  Ni  Ni53  1  0.769049  0.656837  0.606879  1
  Ni  Ni54  1  0.546492  0.211726  0.581632  1
  Ni  Ni55  1  0.657667  0.934074  0.594274  1
  Ni  Ni56  1  0.879999  0.378731  0.619335  1
  Ni  Ni57  1  0.601789  0.822303  0.644936  1
  Ni  Ni58  1  0.823871  0.266456  0.669171  1
  Ni  Ni59  1  0.713348  0.545418  0.657283  1
  Ni  Ni60  1  0.490326  0.099381  0.632078  1
  Ni  Ni61  1  0.213348  0.545418  0.657283  1
  Ni  Ni62  1  0.990326  0.099381  0.632078  1
  Ni  Ni63  1  0.101789  0.822303  0.644936  1
  Ni  Ni64  1  0.323871  0.266456  0.669171  1
  Ni  Ni65  1  0.044904  0.708562  0.693128  1
  Ni  Ni66  1  0.271403  0.161521  0.715409  1
  Ni  Ni67  1  0.156312  0.431385  0.704662  1
  Ni  Ni68  1  0.934345  0.987403  0.681798  1
  Ni  Ni69  1  0.656312  0.431385  0.704662  1
  Ni  Ni70  1  0.434345  0.987403  0.681798  1
  Ni  Ni71  1  0.544904  0.708562  0.693128  1
  Ni  Ni72  1  0.771403  0.161521  0.715409  1
