# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47705434
_cell_length_b   7.68665876
_cell_length_c   48.66006294
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   80.77869985
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   914.527415522
_cell_formula_units_Z   36
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  0.152513  0.697880  0.305457  1
  Ni  Ni2  1  0.772730  0.457709  0.329765  1
  Ni  Ni3  1  0.392165  0.218456  0.352723  1
  Ni  Ni4  1  0.543953  0.915635  0.333484  1
  Ni  Ni5  1  0.304605  0.395114  0.287009  1
  Ni  Ni6  1  0.927088  0.149408  0.308959  1
  Ni  Ni7  1  0.010524  0.981536  0.376960  1
  Ni  Ni8  1  0.629446  0.743553  0.400879  1
  Ni  Ni9  1  0.248411  0.505407  0.424592  1
  Ni  Ni10  1  0.399906  0.203264  0.404735  1
  Ni  Ni11  1  0.162392  0.678724  0.357423  1
  Ni  Ni12  1  0.781531  0.440200  0.380957  1
  Ni  Ni13  1  0.867119  0.267782  0.448453  1
  Ni  Ni14  1  0.485886  0.030062  0.472314  1
  Ni  Ni15  1  0.104708  0.792220  0.496131  1
  Ni  Ni16  1  0.256143  0.490218  0.476280  1
  Ni  Ni17  1  0.018488  0.965927  0.428647  1
  Ni  Ni18  1  0.637377  0.727947  0.452453  1
  Ni  Ni19  1  0.723444  0.554552  0.519979  1
  Ni  Ni20  1  0.342210  0.316823  0.543806  1
  Ni  Ni21  1  0.961099  0.078843  0.567612  1
  Ni  Ni22  1  0.112468  0.776988  0.547807  1
  Ni  Ni23  1  0.874879  0.252549  0.500128  1
  Ni  Ni24  1  0.493701  0.014707  0.523945  1
  Ni  Ni25  1  0.579681  0.841506  0.591524  1
  Ni  Ni26  1  0.198056  0.604569  0.615302  1
  Ni  Ni27  1  0.817196  0.366046  0.638836  1
  Ni  Ni28  1  0.969063  0.063234  0.619299  1
  Ni  Ni29  1  0.731176  0.539363  0.571667  1
  Ni  Ni30  1  0.350141  0.301216  0.595381  1
  Ni  Ni31  1  0.435634  0.129134  0.662775  1
  Ni  Ni32  1  0.052499  0.895362  0.687300  1
  Ni  Ni33  1  0.674982  0.649656  0.709250  1
  Ni  Ni34  1  0.827074  0.346889  0.690802  1
  Ni  Ni35  1  0.587422  0.826314  0.643536  1
  Ni  Ni36  1  0.206857  0.587061  0.666494  1
