data_[Pm1H2Ir1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  H  2.2000  0.2500  0.0000
  Ir  2.2000  1.3500  0.7650
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [4.8603]
_cell_length_b [5.3042]
_cell_length_c [5.5865]
_cell_angle_alpha [68.0077]
_cell_angle_beta [68.8100]
_cell_angle_gamma [64.4517]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [PmH2IrO6]
_chemical_formula_sum '[Pm1 H2 Ir1 O6]'
_cell_volume [116.9906]
_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
[
  Pm  Pm0  1  0.4902  0.4963  0.5268  1
  Ir  Ir1  1  0.0086  0.9838  0.0195  1
  H  H2  1  0.4264  0.1602  0.2282  1
  H  H3  1  0.6720  0.8766  0.8182  1
  O  O4  1  0.0509  0.3330  0.7924  1
  O  O5  1  0.2150  0.9523  0.2596  1
  O  O6  1  0.3731  0.7640  0.8212  1
  O  O7  1  0.5929  0.2243  0.2260  1
  O  O8  1  0.7584  0.0332  0.7712  1
  O  O9  1  0.8902  0.6642  0.2341  1
]