# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.40705592
_cell_length_b   5.83492824
_cell_length_c   47.39800541
_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   Ni28
_cell_volume   665.704917178
_cell_formula_units_Z   28
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  0.504798  0.683309  0.315464  1
  Ni  Ni2  1  0.004798  0.956327  0.289143  1
  Ni  Ni3  1  0.004798  0.010644  0.335847  1
  Ni  Ni4  1  0.504798  0.270948  0.306660  1
  Ni  Ni5  1  0.504798  0.167106  0.376924  1
  Ni  Ni6  1  0.004798  0.424118  0.345554  1
  Ni  Ni7  1  0.004798  0.496862  0.398102  1
  Ni  Ni8  1  0.504798  0.750297  0.366154  1
  Ni  Ni9  1  0.504798  0.657054  0.440290  1
  Ni  Ni10  1  0.004798  0.911220  0.408526  1
  Ni  Ni11  1  0.004798  0.986859  0.461325  1
  Ni  Ni12  1  0.504798  0.241644  0.429743  1
  Ni  Ni13  1  0.504798  0.147224  0.503418  1
  Ni  Ni14  1  0.004798  0.402056  0.471832  1
  Ni  Ni15  1  0.004798  0.477218  0.524516  1
  Ni  Ni16  1  0.504798  0.732050  0.492931  1
  Ni  Ni17  1  0.504798  0.637630  0.566606  1
  Ni  Ni18  1  0.004798  0.892415  0.535024  1
  Ni  Ni19  1  0.004798  0.968054  0.587823  1
  Ni  Ni20  1  0.504798  0.222220  0.556059  1
  Ni  Ni21  1  0.504798  0.128977  0.630194  1
  Ni  Ni22  1  0.004798  0.382412  0.598247  1
  Ni  Ni23  1  0.004798  0.455156  0.650795  1
  Ni  Ni24  1  0.504798  0.712168  0.619424  1
  Ni  Ni25  1  0.504798  0.608326  0.689689  1
  Ni  Ni26  1  0.004798  0.868630  0.660502  1
  Ni  Ni27  1  0.004798  0.922947  0.707205  1
  Ni  Ni28  1  0.504798  0.195965  0.680885  1
