| Formula | S14C134N8O4F6H108 |
| Reduced formula | S7C67N4O2F3H54 |
| Stoichiometry | A2B3C4D7E54F67 |
| Number of species | 6 |
| Number of atoms | 274 |
| Unique ID | 9 |
| Packing density | 0.028 |
| Dipole moment [Debye] | 4.256 |
| HOMO-LUMO gap (B3LYP) [eV] | 2.799 |
| HOMO (B3LYP) [eV] | -5.206 |
| LUMO (B3LYP) [eV] | -2.408 |
| Unit | Dimer |
| GS Energy [eV] | -328883.962 |