# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.48728165
_cell_length_b   4.96819693
_cell_length_c   49.93809335
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni
_chemical_formula_sum   Ni36
_cell_volume   865.202535263
_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  1.004691  0.125990  0.286674  1
  Ni  Ni2  1  0.504691  0.375990  0.310659  1
  Ni  Ni3  1  0.504691  0.875990  0.310659  1
  Ni  Ni4  1  1.004691  0.625990  0.286674  1
  Ni  Ni5  1  1.004691  0.625990  0.335758  1
  Ni  Ni6  1  0.504691  0.875990  0.360630  1
  Ni  Ni7  1  0.504691  0.375990  0.360630  1
  Ni  Ni8  1  1.004691  0.125990  0.335758  1
  Ni  Ni9  1  1.004691  0.125990  0.385735  1
  Ni  Ni10  1  0.504691  0.375990  0.410756  1
  Ni  Ni11  1  0.504691  0.875990  0.410756  1
  Ni  Ni12  1  1.004691  0.625990  0.385735  1
  Ni  Ni13  1  1.004691  0.625990  0.435811  1
  Ni  Ni14  1  0.504691  0.875990  0.460852  1
  Ni  Ni15  1  0.504691  0.375990  0.460852  1
  Ni  Ni16  1  1.004691  0.125990  0.435811  1
  Ni  Ni17  1  1.004691  0.125990  0.485899  1
  Ni  Ni18  1  0.504691  0.375990  0.510942  1
  Ni  Ni19  1  0.504691  0.875990  0.510942  1
  Ni  Ni20  1  1.004691  0.625990  0.485899  1
  Ni  Ni21  1  1.004691  0.625990  0.535989  1
  Ni  Ni22  1  0.504691  0.875990  0.561030  1
  Ni  Ni23  1  0.504691  0.375990  0.561030  1
  Ni  Ni24  1  1.004691  0.125990  0.535989  1
  Ni  Ni25  1  1.004691  0.125990  0.586085  1
  Ni  Ni26  1  0.504691  0.375990  0.611106  1
  Ni  Ni27  1  0.504691  0.875990  0.611106  1
  Ni  Ni28  1  1.004691  0.625990  0.586085  1
  Ni  Ni29  1  1.004691  0.625990  0.636211  1
  Ni  Ni30  1  0.504691  0.875990  0.661083  1
  Ni  Ni31  1  0.504691  0.375990  0.661083  1
  Ni  Ni32  1  1.004691  0.125990  0.636211  1
  Ni  Ni33  1  1.004691  0.125990  0.686182  1
  Ni  Ni34  1  0.504691  0.375990  0.710166  1
  Ni  Ni35  1  0.504691  0.875990  0.710166  1
  Ni  Ni36  1  1.004691  0.625990  0.686182  1
