# generated using pymatgen
data_PrHgIr2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.49175906
_cell_length_b   7.30185376
_cell_length_c   7.30185296
_cell_angle_alpha   59.16734040
_cell_angle_beta   59.13587239
_cell_angle_gamma   59.13586596
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrHgIr2O7
_chemical_formula_sum   'Pr2 Hg2 Ir4 O14'
_cell_volume   276.95063366
_cell_formula_units_Z   2
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  0.12500000  0.12500000  0.12500000  1.0
  Pr  Pr1  1  0.62500000  0.12500000  0.12500000  1.0
  Hg  Hg2  1  0.12500000  0.12500000  0.62500000  1.0
  Hg  Hg3  1  0.12500000  0.62500000  0.12500000  1.0
  Ir  Ir4  1  0.62500000  0.62500000  0.62500000  1.0
  Ir  Ir5  1  0.12500000  0.62500000  0.62500000  1.0
  Ir  Ir6  1  0.62500000  0.12500000  0.62500000  1.0
  Ir  Ir7  1  0.62500000  0.62500000  0.12500000  1.0
  O  O8  1  0.94483050  0.55516950  0.55516950  1.0
  O  O9  1  0.30299946  0.29941266  0.70471786  1.0
  O  O10  1  0.94700054  0.54528214  0.95058734  1.0
  O  O11  1  0.70976022  0.29023978  0.29023978  1.0
  O  O12  1  0.55712998  0.54528214  0.95058734  1.0
  O  O13  1  0.55712998  0.95058734  0.54528214  1.0
  O  O14  1  0.54023978  0.95976022  0.95976022  1.0
  O  O15  1  0.23677859  0.26322141  0.26322141  1.0
  O  O16  1  0.30516950  0.69483050  0.69483050  1.0
  O  O17  1  0.69287002  0.29941266  0.70471786  1.0
  O  O18  1  0.01322141  0.98677859  0.98677859  1.0
  O  O19  1  0.94700054  0.95058734  0.54528214  1.0
  O  O20  1  0.30299946  0.70471786  0.29941266  1.0
  O  O21  1  0.69287002  0.70471786  0.29941266  1.0