# generated using pymatgen
data_NiPbIO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.10202208
_cell_length_b   5.10202260
_cell_length_c   5.37383492
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000250
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiPbIO6
_chemical_formula_sum   'Ni1 Pb1 I1 O6'
_cell_volume   121.14337078
_cell_formula_units_Z   1
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  Ni0  1  0.33333300  0.66666700  0.50000000  1.0
  Pb  Pb1  1  0.00000000  0.00000000  0.00000000  1.0
  I  I2  1  0.66666700  0.33333300  0.50000000  1.0
  O  O3  1  0.38262943  0.00978559  0.69846482  1.0
  O  O4  1  0.99021441  0.37284383  0.69846482  1.0
  O  O5  1  0.62715617  0.61737057  0.69846482  1.0
  O  O6  1  0.99021441  0.61737057  0.30153518  1.0
  O  O7  1  0.62715617  0.00978559  0.30153518  1.0
  O  O8  1  0.38262943  0.37284383  0.30153518  1.0