# generated using pymatgen
data_PrNiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.37445976
_cell_length_b   5.42801121
_cell_length_c   7.63202038
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrNiO3
_chemical_formula_sum   'Pr4 Ni4 O12'
_cell_volume   222.64609010
_cell_formula_units_Z   4
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
  Pr  Pr0  1  0.02969916  0.99424684  0.75000000  1.0
  Pr  Pr1  1  0.52969916  0.50575316  0.75000000  1.0
  Pr  Pr2  1  0.47030084  0.49424684  0.25000000  1.0
  Pr  Pr3  1  0.97030084  0.00575316  0.25000000  1.0
  Ni  Ni4  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni5  1  0.50000000  -0.00000000  -0.00000000  1.0
  Ni  Ni6  1  0.50000000  -0.00000000  0.50000000  1.0
  Ni  Ni7  1  0.00000000  0.50000000  -0.00000000  1.0
  O  O8  1  0.72304528  0.27610616  0.46360094  1.0
  O  O9  1  0.22304528  0.22389384  0.03639906  1.0
  O  O10  1  0.77695472  0.77610616  0.53639906  1.0
  O  O11  1  0.27695472  0.72389384  0.96360094  1.0
  O  O12  1  0.27695472  0.72389384  0.53639906  1.0
  O  O13  1  0.77695472  0.77610616  0.96360094  1.0
  O  O14  1  0.22304528  0.22389384  0.46360094  1.0
  O  O15  1  0.72304528  0.27610616  0.03639906  1.0
  O  O16  1  0.50500577  0.93309648  0.25000000  1.0
  O  O17  1  0.00500577  0.56690352  0.25000000  1.0
  O  O18  1  0.99499423  0.43309648  0.75000000  1.0
  O  O19  1  0.49499423  0.06690352  0.75000000  1.0