# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47666677
_cell_length_b   8.39269842
_cell_length_c   47.78489821
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   81.51489539
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni40
_cell_volume   982.381050904
_cell_formula_units_Z   40
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  0.931615  0.639387  0.316962  1
  Ni  Ni2  1  0.166522  0.169580  0.295571  1
  Ni  Ni3  1  0.303513  0.895588  0.313397  1
  Ni  Ni4  1  0.538372  0.425874  0.292163  1
  Ni  Ni5  1  0.464824  0.572968  0.360077  1
  Ni  Ni6  1  0.697789  0.107040  0.338862  1
  Ni  Ni7  1  0.837107  0.828402  0.356586  1
  Ni  Ni8  1  0.070677  0.361264  0.335115  1
  Ni  Ni9  1  0.998228  0.506162  0.403762  1
  Ni  Ni10  1  0.231773  0.039072  0.382031  1
  Ni  Ni11  1  0.370556  0.761504  0.400054  1
  Ni  Ni12  1  0.603696  0.295224  0.378494  1
  Ni  Ni13  1  0.531722  0.439173  0.447353  1
  Ni  Ni14  1  0.765107  0.972405  0.425594  1
  Ni  Ni15  1  0.903902  0.694812  0.443629  1
  Ni  Ni16  1  0.137234  0.228150  0.421929  1
  Ni  Ni17  1  0.065142  0.372333  0.490920  1
  Ni  Ni18  1  0.298476  0.905666  0.469157  1
  Ni  Ni19  1  0.437294  0.628028  0.487198  1
  Ni  Ni20  1  0.670619  0.161379  0.465449  1
  Ni  Ni21  1  0.598541  0.305535  0.534470  1
  Ni  Ni22  1  0.831866  0.838886  0.512722  1
  Ni  Ni23  1  0.970684  0.561248  0.530763  1
  Ni  Ni24  1  0.204018  0.094581  0.509000  1
  Ni  Ni25  1  0.131927  0.238764  0.577991  1
  Ni  Ni26  1  0.365258  0.772102  0.556291  1
  Ni  Ni27  1  0.504054  0.494509  0.574326  1
  Ni  Ni28  1  0.737438  0.027741  0.552566  1
  Ni  Ni29  1  0.665464  0.171690  0.621426  1
  Ni  Ni30  1  0.898604  0.705410  0.599866  1
  Ni  Ni31  1  0.037387  0.427842  0.617889  1
  Ni  Ni32  1  0.270932  0.960752  0.596157  1
  Ni  Ni33  1  0.198483  0.105650  0.664804  1
  Ni  Ni34  1  0.432053  0.638512  0.643334  1
  Ni  Ni35  1  0.571371  0.359874  0.661058  1
  Ni  Ni36  1  0.804336  0.893946  0.639843  1
  Ni  Ni37  1  0.730788  0.041040  0.707756  1
  Ni  Ni38  1  0.965647  0.571326  0.686523  1
  Ni  Ni39  1  0.102639  0.297334  0.704348  1
  Ni  Ni40  1  0.337545  0.827527  0.682958  1
