# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.47700277
_cell_length_b   7.68655114
_cell_length_c   48.66062576
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   99.22130013
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   914.50614851
_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  0.849462  0.697906  0.305450  1
  Ni  Ni2  1  0.229242  0.457729  0.329758  1
  Ni  Ni3  1  0.609807  0.218474  0.352716  1
  Ni  Ni4  1  0.458021  0.915658  0.333478  1
  Ni  Ni5  1  0.697371  0.395140  0.287002  1
  Ni  Ni6  1  0.074886  0.149429  0.308952  1
  Ni  Ni7  1  0.991446  0.981552  0.376954  1
  Ni  Ni8  1  0.372523  0.743567  0.400872  1
  Ni  Ni9  1  0.753557  0.505419  0.424586  1
  Ni  Ni10  1  0.602064  0.203280  0.404729  1
  Ni  Ni11  1  0.839581  0.678743  0.357417  1
  Ni  Ni12  1  0.220440  0.440218  0.380950  1
  Ni  Ni13  1  0.134848  0.267792  0.448447  1
  Ni  Ni14  1  0.516080  0.030070  0.472308  1
  Ni  Ni15  1  0.897257  0.792226  0.496125  1
  Ni  Ni16  1  0.745825  0.490228  0.476274  1
  Ni  Ni17  1  0.983481  0.965941  0.428641  1
  Ni  Ni18  1  0.364591  0.727959  0.452447  1
  Ni  Ni19  1  0.278519  0.554556  0.519974  1
  Ni  Ni20  1  0.659753  0.316825  0.543801  1
  Ni  Ni21  1  0.040863  0.078843  0.567607  1
  Ni  Ni22  1  0.889496  0.776992  0.547801  1
  Ni  Ni23  1  0.127087  0.252557  0.500122  1
  Ni  Ni24  1  0.508264  0.014714  0.523940  1
  Ni  Ni25  1  0.422280  0.841504  0.591519  1
  Ni  Ni26  1  0.803904  0.604565  0.615297  1
  Ni  Ni27  1  0.184763  0.366041  0.638831  1
  Ni  Ni28  1  0.032898  0.063231  0.619294  1
  Ni  Ni29  1  0.270787  0.539365  0.571661  1
  Ni  Ni30  1  0.651821  0.301217  0.595375  1
  Ni  Ni31  1  0.566323  0.129126  0.662770  1
  Ni  Ni32  1  0.949458  0.895355  0.687295  1
  Ni  Ni33  1  0.326973  0.649644  0.709246  1
  Ni  Ni34  1  0.174882  0.346878  0.690797  1
  Ni  Ni35  1  0.414537  0.826309  0.643531  1
  Ni  Ni36  1  0.795102  0.587054  0.666489  1
