data_AlHC8O5F4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66
_cell_length_b   8.86
_cell_length_c   11.18
_cell_angle_alpha   89.86
_cell_angle_beta   73.23
_cell_angle_gamma   75.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlHC8O5F4
_chemical_formula_sum   'Al2 H2 C16 O10 F8'
_cell_volume   610.97
_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
  Al  Al0  1  0.81  0.69  0.28  1.0
  Al  Al1  1  0.14  0.71  0.3  1.0
  H  H2  1  0.8  0.22  0.39  1.0
  H  H3  1  0.45  0.16  0.24  1.0
  C  C4  1  0.45  0.99  0.88  1.0
  C  C5  1  0.52  0.31  0.33  1.0
  C  C6  1  0.86  0.58  0.7  1.0
  C  C7  1  0.78  0.1  0.26  1.0
  C  C8  1  0.79  0.59  0.27  1.0
  C  C9  1  0.51  0.82  0.36  1.0
  C  C10  1  0.47  0.24  0.39  1.0
  C  C11  1  0.14  0.33  0.77  1.0
  C  C12  1  0.85  0.31  0.58  1.0
  C  C13  1  0.7  0.39  0.53  1.0
  C  C14  1  0.44  0.41  0.96  1.0
  C  C15  1  0.83  0.6  0.21  1.0
  C  C16  1  0.14  0.6  0.85  1.0
  C  C17  1  0.47  0.61  0.01  1.0
  C  C18  1  0.16  0.72  0.45  1.0
  C  C19  1  0.79  0.67  0.23  1.0
  O  O20  1  0.3  0.99  0.43  1.0
  O  O21  1  0.64  0.88  0.44  1.0
  O  O22  1  0.72  0.72  0.15  1.0
  O  O23  1  0.91  0.54  0.32  1.0
  O  O24  1  0.98  0.42  0.14  1.0
  O  O25  1  0.65  0.54  0.21  1.0
  O  O26  1  0.57  0.76  0.43  1.0
  O  O27  1  0.38  0.86  0.2  1.0
  O  O28  1  0.8  0.13  0.71  1.0
  O  O29  1  0.47  0.27  0.86  1.0
  F  F30  1  0.02  0.12  0.19  1.0
  F  F31  1  0.47  0.88  0.44  1.0
  F  F32  1  0.53  0.63  0.15  1.0
  F  F33  1  0.2  0.25  0.11  1.0
  F  F34  1  0.21  0.91  0.11  1.0
  F  F35  1  0.47  0.68  0.67  1.0
  F  F36  1  0.99  0.37  0.72  1.0
  F  F37  1  0.49  0.46  0.86  1.0

data_AlHC8O5F4
_symmetry_space_group_name_H-M   P1
_cell_length_a   6.66
_cell_length_b   8.86
_cell_length_c   11.18
_cell_angle_alpha   89.86
_cell_angle_beta   73.23
_cell_angle_gamma   75.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlHC8O5F4
_chemical_formula_sum   'Al2 H2 C16 O10 F8'
_cell_volume   610.97
_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
  Al  Al0  1  0.14  0.71  0.3  1.0
  Al  Al1  1  0.81  0.69  0.28  1.0
  H  H2  1  0.45  0.16  0.24  1.0
  H  H3  1  0.8  0.22  0.39  1.0
  C  C4  1  0.14  0.6  0.85  1.0
  C  C5  1  0.14  0.33  0.77  1.0
  C  C6  1  0.16  0.72  0.45  1.0
  C  C7  1  0.44  0.41  0.96  1.0
  C  C8  1  0.45  0.99  0.88  1.0
  C  C9  1  0.47  0.24  0.39  1.0
  C  C10  1  0.47  0.61  0.01  1.0
  C  C11  1  0.51  0.82  0.36  1.0
  C  C12  1  0.52  0.31  0.33  1.0
  C  C13  1  0.7  0.39  0.53  1.0
  C  C14  1  0.78  0.1  0.26  1.0
  C  C15  1  0.79  0.67  0.23  1.0
  C  C16  1  0.79  0.59  0.27  1.0
  C  C17  1  0.83  0.6  0.21  1.0
  C  C18  1  0.85  0.31  0.58  1.0
  C  C19  1  0.86  0.58  0.7  1.0
  O  O20  1  0.3  0.99  0.43  1.0
  O  O21  1  0.38  0.86  0.2  1.0
  O  O22  1  0.47  0.27  0.86  1.0
  O  O23  1  0.57  0.76  0.43  1.0
  O  O24  1  0.64  0.88  0.44  1.0
  O  O25  1  0.65  0.54  0.21  1.0
  O  O26  1  0.72  0.72  0.15  1.0
  O  O27  1  0.8  0.13  0.71  1.0
  O  O28  1  0.91  0.54  0.32  1.0
  O  O29  1  0.98  0.42  0.14  1.0
  F  F30  1  0.02  0.12  0.19  1.0
  F  F31  1  0.2  0.25  0.11  1.0
  F  F32  1  0.21  0.91  0.11  1.0
  F  F33  1  0.47  0.88  0.44  1.0
  F  F34  1  0.47  0.68  0.67  1.0
  F  F35  1  0.49  0.46  0.86  1.0
  F  F36  1  0.53  0.63  0.15  1.0
  F  F37  1  0.99  0.37  0.72  1.0

Al Al H H C C C C C C C C C C C C C C C C O O O O O O O O O O F F F F F F F F