data_FeH12Pt(ClO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.92
_cell_length_b   6.92
_cell_length_c   6.92
_cell_angle_alpha   96.46
_cell_angle_beta   96.46
_cell_angle_gamma   96.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeH12Pt(ClO)6
_chemical_formula_sum   'Fe1 H12 Pt1 Cl6 O6'
_cell_volume   324.63
_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
  Fe  Fe6  1  0.0  0.0  0.0  1.0
  H  H7  1  0.38  0.63  0.41  1.0
  H  H8  1  0.29  0.63  0.88  1.0
  H  H9  1  0.17  0.84  0.88  1.0
  H  H10  1  0.72  0.72  0.41  1.0
  H  H11  1  0.46  0.47  0.67  1.0
  H  H12  1  0.9  0.65  0.41  1.0
  H  H13  1  0.1  0.35  0.14  1.0
  H  H14  1  0.54  0.53  0.88  1.0
  H  H15  1  0.28  0.28  0.14  1.0
  H  H16  1  0.83  0.16  0.67  1.0
  H  H17  1  0.71  0.37  0.67  1.0
  H  H18  1  0.62  0.37  0.14  1.0
  Pt  Pt25  1  0.0  0.0  0.28  1.0
  Cl  Cl0  1  0.32  0.2  0.94  1.0
  Cl  Cl1  1  0.1  0.69  0.61  1.0
  Cl  Cl2  1  0.22  0.51  0.61  1.0
  Cl  Cl3  1  0.78  0.49  0.94  1.0
  Cl  Cl4  1  0.9  0.31  0.94  1.0
  Cl  Cl5  1  0.68  0.8  0.61  1.0
  O  O19  1  0.27  0.55  0.84  1.0
  O  O20  1  0.61  0.03  0.84  1.0
  O  O21  1  0.88  0.58  0.71  1.0
  O  O22  1  0.12  0.42  0.84  1.0
  O  O23  1  0.39  0.97  0.71  1.0
  O  O24  1  0.73  0.45  0.71  1.0

data_FeH12Pt(ClO)6
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.92
_cell_length_b   6.92
_cell_length_c   6.92
_cell_angle_alpha   96.46
_cell_angle_beta   96.46
_cell_angle_gamma   96.46
_symmetry_Int_Tables_number   1
_chemical_formula_structural   FeH12Pt(ClO)6
_chemical_formula_sum   'Fe1 H12 Pt1 Cl6 O6'
_cell_volume   324.63
_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
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  H  H1  1  0.1  0.35  0.14  1.0
  H  H2  1  0.17  0.84  0.88  1.0
  H  H3  1  0.28  0.28  0.14  1.0
  H  H4  1  0.29  0.63  0.88  1.0
  H  H5  1  0.38  0.63  0.41  1.0
  H  H6  1  0.46  0.47  0.67  1.0
  H  H7  1  0.54  0.53  0.88  1.0
  H  H8  1  0.62  0.37  0.14  1.0
  H  H9  1  0.71  0.37  0.67  1.0
  H  H10  1  0.72  0.72  0.41  1.0
  H  H11  1  0.83  0.16  0.67  1.0
  H  H12  1  0.9  0.65  0.41  1.0
  Pt  Pt13  1  0.0  0.0  0.28  1.0
  Cl  Cl14  1  0.1  0.69  0.61  1.0
  Cl  Cl15  1  0.22  0.51  0.61  1.0
  Cl  Cl16  1  0.32  0.2  0.94  1.0
  Cl  Cl17  1  0.68  0.8  0.61  1.0
  Cl  Cl18  1  0.78  0.49  0.94  1.0
  Cl  Cl19  1  0.9  0.31  0.94  1.0
  O  O20  1  0.12  0.42  0.84  1.0
  O  O21  1  0.27  0.55  0.84  1.0
  O  O22  1  0.39  0.97  0.71  1.0
  O  O23  1  0.61  0.03  0.84  1.0
  O  O24  1  0.73  0.45  0.71  1.0
  O  O25  1  0.88  0.58  0.71  1.0

Fe H H H H H H H H H H H H Pt Cl Cl Cl Cl Cl Cl O O O O O O