Conformational analysis of 3,4,5,6-tetrabromocyclohexene

Methods: MMFF94 (Marvin, conformers plugin) — conformers (perl script) — MP2 (PRIRODA).
Energy (without ZPE) by riMP2/L1 (basis like cc-pVDZ, PRIRODA program)

Click on a level title to download xyz file
Click on energy level to view 3D structure (run jmol java-applet)

0.00 0.00 3.82 3.82 3.92 3.92 3.99 3.99 4.14 4.14 4.29 4.29 4.46 4.46 4.81 4.81 5.05 5.05 8.27 8.27 9.34 9.34 11.07 11.07 13.06 13.06 13.20 13.20 13.61 13.61 15.88 15.88 16.41 16.41 16.41 16.41 16.49 16.49 18.63 18.63 20.32 20.32 20.44 20.44