# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.48795263
_cell_length_b   7.70410309
_cell_length_c   48.68022215
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.21558123
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   921.031972045
_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  0.849535  0.702178  0.306975  1
  Ni  Ni2  1  0.229109  0.461552  0.330963  1
  Ni  Ni3  1  0.610274  0.223231  0.354071  1
  Ni  Ni4  1  0.458890  0.921688  0.335070  1
  Ni  Ni5  1  0.700556  0.406379  0.288460  1
  Ni  Ni6  1  0.078007  0.160134  0.310832  1
  Ni  Ni7  1  0.992107  0.986480  0.378256  1
  Ni  Ni8  1  0.373212  0.748291  0.401939  1
  Ni  Ni9  1  0.754761  0.511003  0.425875  1
  Ni  Ni10  1  0.602794  0.208387  0.406053  1
  Ni  Ni11  1  0.839658  0.682969  0.358255  1
  Ni  Ni12  1  0.221037  0.445247  0.382190  1
  Ni  Ni13  1  0.136224  0.273556  0.449749  1
  Ni  Ni14  1  0.517691  0.036128  0.473617  1
  Ni  Ni15  1  0.899152  0.798681  0.497478  1
  Ni  Ni16  1  0.747161  0.496029  0.477646  1
  Ni  Ni17  1  0.984175  0.970789  0.429913  1
  Ni  Ni18  1  0.365673  0.733415  0.453765  1
  Ni  Ni19  1  0.280627  0.561268  0.521356  1
  Ni  Ni20  1  0.662115  0.323881  0.545237  1
  Ni  Ni21  1  0.043612  0.086507  0.569089  1
  Ni  Ni22  1  0.891564  0.783740  0.549253  1
  Ni  Ni23  1  0.128636  0.258615  0.501524  1
  Ni  Ni24  1  0.510096  0.021168  0.525385  1
  Ni  Ni25  1  0.424993  0.848909  0.592949  1
  Ni  Ni26  1  0.806750  0.612049  0.616812  1
  Ni  Ni27  1  0.188129  0.374327  0.640747  1
  Ni  Ni28  1  0.035680  0.070816  0.620746  1
  Ni  Ni29  1  0.273027  0.546294  0.573127  1
  Ni  Ni30  1  0.654575  0.309005  0.597063  1
  Ni  Ni31  1  0.568897  0.135608  0.663932  1
  Ni  Ni32  1  0.949781  0.897162  0.688170  1
  Ni  Ni33  1  0.327231  0.650917  0.710543  1
  Ni  Ni34  1  0.178253  0.355118  0.692027  1
  Ni  Ni35  1  0.417513  0.834065  0.644931  1
  Ni  Ni36  1  0.798679  0.595744  0.668039  1
