# generated using pymatgen
data_Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.07973343
_cell_length_b   4.28872574
_cell_length_c   47.43599370
_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   Ni34
_cell_volume   829.98083426
_cell_formula_units_Z   34
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  0.251031  0.181097  0.288074  1
  Ni  Ni2  1  0.751031  0.824371  0.288074  1
  Ni  Ni3  1  0.251031  0.678018  0.314556  1
  Ni  Ni4  1  0.751031  0.327450  0.314556  1
  Ni  Ni5  1  0.251031  0.172166  0.340561  1
  Ni  Ni6  1  0.751031  0.833302  0.340561  1
  Ni  Ni7  1  0.251031  0.670702  0.367005  1
  Ni  Ni8  1  0.751031  0.334766  0.367005  1
  Ni  Ni9  1  0.251031  0.170398  0.393295  1
  Ni  Ni10  1  0.751031  0.835069  0.393295  1
  Ni  Ni11  1  0.251031  0.670316  0.419633  1
  Ni  Ni12  1  0.751031  0.335152  0.419633  1
  Ni  Ni13  1  0.251031  0.170288  0.445951  1
  Ni  Ni14  1  0.751031  0.835180  0.445951  1
  Ni  Ni15  1  0.251031  0.670282  0.472276  1
  Ni  Ni16  1  0.751031  0.335186  0.472276  1
  Ni  Ni17  1  0.251031  0.170280  0.498599  1
  Ni  Ni18  1  0.751031  0.835188  0.498599  1
  Ni  Ni19  1  0.251031  0.670282  0.524922  1
  Ni  Ni20  1  0.751031  0.335186  0.524922  1
  Ni  Ni21  1  0.251031  0.170288  0.551247  1
  Ni  Ni22  1  0.751031  0.835180  0.551247  1
  Ni  Ni23  1  0.251031  0.670316  0.577565  1
  Ni  Ni24  1  0.751031  0.335152  0.577565  1
  Ni  Ni25  1  0.251031  0.170398  0.603903  1
  Ni  Ni26  1  0.751031  0.835069  0.603903  1
  Ni  Ni27  1  0.251031  0.670702  0.630193  1
  Ni  Ni28  1  0.751031  0.334766  0.630193  1
  Ni  Ni29  1  0.251031  0.172166  0.656637  1
  Ni  Ni30  1  0.751031  0.833302  0.656637  1
  Ni  Ni31  1  0.251031  0.678018  0.682642  1
  Ni  Ni32  1  0.751031  0.327450  0.682642  1
  Ni  Ni33  1  0.251031  0.181097  0.709124  1
  Ni  Ni34  1  0.751031  0.824371  0.709124  1
