# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28128872
_cell_length_b   4.70622708
_cell_length_c   46.31656354
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   117.07321633
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni34
_cell_volume   830.962432424
_cell_formula_units_Z   34
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  0.471270  0.278322  0.288438  1
  Ni  Ni2  1  0.043483  0.726876  0.300580  1
  Ni  Ni3  1  0.922440  0.179740  0.313351  1
  Ni  Ni4  1  0.492702  0.643536  0.326464  1
  Ni  Ni5  1  0.384194  0.099642  0.339209  1
  Ni  Ni6  1  0.946906  0.554963  0.351574  1
  Ni  Ni7  1  0.842300  0.012691  0.364560  1
  Ni  Ni8  1  0.404198  0.468943  0.377402  1
  Ni  Ni9  1  0.297193  0.924286  0.390197  1
  Ni  Ni10  1  0.860261  0.381003  0.403042  1
  Ni  Ni11  1  0.753543  0.837492  0.415929  1
  Ni  Ni12  1  0.316855  0.293726  0.428755  1
  Ni  Ni13  1  0.209733  0.750079  0.441606  1
  Ni  Ni14  1  0.773239  0.206524  0.454464  1
  Ni  Ni15  1  0.666060  0.662863  0.467316  1
  Ni  Ni16  1  0.229597  0.119228  0.480164  1
  Ni  Ni17  1  0.122428  0.575613  0.493016  1
  Ni  Ni18  1  0.685964  0.031988  0.505869  1
  Ni  Ni19  1  0.578795  0.488373  0.518722  1
  Ni  Ni20  1  0.142331  0.944738  0.531569  1
  Ni  Ni21  1  0.035152  0.401077  0.544421  1
  Ni  Ni22  1  0.598659  0.857522  0.557279  1
  Ni  Ni23  1  0.491536  0.313875  0.570131  1
  Ni  Ni24  1  0.054848  0.770108  0.582956  1
  Ni  Ni25  1  0.948130  0.226598  0.595844  1
  Ni  Ni26  1  0.511199  0.683315  0.608689  1
  Ni  Ni27  1  0.404193  0.138658  0.621484  1
  Ni  Ni28  1  0.966092  0.594910  0.634326  1
  Ni  Ni29  1  0.861485  0.052638  0.647312  1
  Ni  Ni30  1  0.424198  0.507959  0.659676  1
  Ni  Ni31  1  0.315690  0.964065  0.672421  1
  Ni  Ni32  1  0.885951  0.427861  0.685535  1
  Ni  Ni33  1  0.764908  0.880725  0.698305  1
  Ni  Ni34  1  0.337121  0.329279  0.710447  1
