# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.50641271
_cell_length_b   3.50641271
_cell_length_c   49.47983856
_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   Ni24
_cell_volume   608.351157053
_cell_formula_units_Z   24
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  0.001937  0.001937  0.301586  1
  Ni  Ni2  1  0.501937  0.501937  0.301586  1
  Ni  Ni3  1  0.001937  0.501937  0.337339  1
  Ni  Ni4  1  0.501937  0.001937  0.337339  1
  Ni  Ni5  1  0.001937  0.001937  0.372897  1
  Ni  Ni6  1  0.501937  0.501937  0.372897  1
  Ni  Ni7  1  0.001937  0.501937  0.408629  1
  Ni  Ni8  1  0.501937  0.001937  0.408629  1
  Ni  Ni9  1  0.001937  0.001937  0.444370  1
  Ni  Ni10  1  0.501937  0.501937  0.444370  1
  Ni  Ni11  1  0.001937  0.501937  0.480110  1
  Ni  Ni12  1  0.501937  0.001937  0.480110  1
  Ni  Ni13  1  0.001937  0.001937  0.515851  1
  Ni  Ni14  1  0.501937  0.501937  0.515851  1
  Ni  Ni15  1  0.001937  0.501937  0.551591  1
  Ni  Ni16  1  0.501937  0.001937  0.551591  1
  Ni  Ni17  1  0.001937  0.001937  0.587332  1
  Ni  Ni18  1  0.501937  0.501937  0.587332  1
  Ni  Ni19  1  0.001937  0.501937  0.623064  1
  Ni  Ni20  1  0.501937  0.001937  0.623064  1
  Ni  Ni21  1  0.001937  0.001937  0.658622  1
  Ni  Ni22  1  0.501937  0.501937  0.658622  1
  Ni  Ni23  1  0.001937  0.501937  0.694376  1
  Ni  Ni24  1  0.501937  0.001937  0.694376  1
