| 180° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | -0.412 | |
| Non-1,4 VDW | 0.6169 | |
| 1,4 VDW | 3.4573 | |
| Dipole/Dipole | 1.6226 | |
| Total Energy | 7.4063 kcal/mol | |
| 150° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 1.6042 | |
| Non-1,4 VDW | 1.7123 | |
| 1,4 VDW | 4.799 | |
| Dipole/Dipole | 1.6524 | |
| Total Energy | 11.8892 kcal/mol | |
| 120° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 3.7959 | |
| Non-1,4 VDW | 2.7941 | |
| 1,4 VDW | 6.2425 | |
| Dipole/Dipole | 1.7554 | |
| Total Energy | 16.7094 kcal/mol | |
| 90° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 2.1485 | |
| Non-1,4 VDW | 2.32 | |
| 1,4 VDW | 4.9013 | |
| Dipole/Dipole | 1.9736 | |
| Total Energy | 13.4648 kcal/mol | |
| 60° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 0.1959 | |
| Non-1,4 VDW | 0.3292 | |
| 1,4 VDW | 4.5839 | |
| Dipole/Dipole | 2.3524 | |
| Total Energy | 9.5828 kcal/mol | |
| 30° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 1.7773 | |
| Non-1,4 VDW | 0.4005 | |
| 1,4 VDW | 9.4609 | |
| Dipole/Dipole | 2.8189 | |
| Total Energy | 16.5790 kcal/mol | |
| 0° | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 3.488 | |
| Non-1,4 VDW | 1.3218 | |
| 1,4 VDW | 14.0923 | |
| Dipole/Dipole | 3.0541 | |
| Total Energy | 24.0776 kcal/mol | |
| -30 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 1.7772 | |
| Non-1,4 VDW | 0.3952 | |
| 1,4 VDW | 9.4609 | |
| Dipole/Dipole | 2.8189 | |
| Total Energy | 16.5735 kcal/mol | |
| -60 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 0.196 | |
| Non-1,4 VDW | 0.3266 | |
| 1,4 VDW | 4.584 | |
| Dipole/Dipole | 2.3524 | |
| Total Energy | 9.5804 kcal/mol | |
| -90 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 2.1487 | |
| Non-1,4 VDW | 2.3273 | |
| 1,4 VDW | 4.9017 | |
| Dipole/Dipole | 1.9736 | |
| Total Energy | 13.4727 kcal/mol | |
| -120 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 3.7959 | |
| Non-1,4 VDW | 2.7974 | |
| 1,4 VDW | 6.2427 | |
| Dipole/Dipole | 1.7554 | |
| Total Energy | 16.7128 kcal/mol | |
| -150 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | 1.6039 | |
| Non-1,4 VDW | 1.7062 | |
| 1,4 VDW | 4.7988 | |
| Dipole/Dipole | 1.6524 | |
| Total Energy | 11.8828 kcal/mol | |
| -180 | ||
| Stretch | 0.7746 | |
| Bend | 1.1675 | |
| Stretch-Bend | 0.1794 | |
| Torsion | -0.412 | |
| Non-1,4 VDW | 0.6169 | |
| 1,4 VDW | 3.4573 | |
| Dipole/Dipole | 1.6226 | |
| Total Energy | 7.4063 kcal/mol | |