DD9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C9 | C8 | sing | 1.53Å | 1.51Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C9 | H9B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C1 | C2 | C3 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | H2A | 109.5° | 109.5° |
| H1 | C1 | H1A | 109.4° | 109.4° |
| H1 | C1 | H1B | 109.4° | 109.5° |
| H1A | C1 | H1B | 109.5° | 109.5° |
| C3 | C2 | H2 | 109.5° | 109.5° |
| C3 | C2 | H2A | 109.5° | 109.5° |
| C2 | C3 | C4 | 111.2° | 109.5° |
| C2 | C3 | H3 | 108.9° | 109.5° |
| C2 | C3 | H3A | 108.5° | 109.5° |
| H2 | C2 | H2A | 109.5° | 109.5° |
| C4 | C3 | H3 | 108.9° | 109.5° |
| C4 | C3 | H3A | 108.5° | 109.5° |
| C3 | C4 | C5 | 111.4° | 109.5° |
| C3 | C4 | H4 | 108.8° | 109.5° |
| C3 | C4 | H4A | 108.4° | 109.5° |
| H3 | C3 | H3A | 110.8° | 109.4° |
| C5 | C4 | H4 | 108.8° | 109.5° |
| C5 | C4 | H4A | 108.4° | 109.5° |
| C4 | C5 | C6 | 111.3° | 109.5° |
| C4 | C5 | H5 | 108.9° | 109.5° |
| C4 | C5 | H5A | 108.5° | 109.5° |
| H4 | C4 | H4A | 111.0° | 109.5° |
| C6 | C5 | H5 | 108.8° | 109.5° |
| C6 | C5 | H5A | 108.4° | 109.5° |
| C5 | C6 | C7 | 111.4° | 109.5° |
| C5 | C6 | H6 | 108.8° | 109.5° |
| C5 | C6 | H6A | 108.4° | 109.5° |
| H5 | C5 | H5A | 110.9° | 109.4° |
| C7 | C6 | H6 | 108.9° | 109.5° |
| C7 | C6 | H6A | 108.4° | 109.5° |
| C6 | C7 | C8 | 111.2° | 109.5° |
| C6 | C7 | H7 | 108.9° | 109.5° |
| C6 | C7 | H7A | 108.5° | 109.5° |
| H6 | C6 | H6A | 111.0° | 109.5° |
| C8 | C7 | H7 | 108.9° | 109.5° |
| C8 | C7 | H7A | 108.5° | 109.5° |
| C7 | C8 | C9 | 111.0° | 109.5° |
| C7 | C8 | H8 | 109.0° | 109.5° |
| C7 | C8 | H8A | 108.6° | 109.5° |
| H7 | C7 | H7A | 110.8° | 109.4° |
| C9 | C8 | H8 | 108.9° | 109.5° |
| C9 | C8 | H8A | 108.6° | 109.5° |
| C8 | C9 | H9 | 109.5° | 109.5° |
| C8 | C9 | H9A | 109.5° | 109.5° |
| C8 | C9 | H9B | 109.4° | 109.5° |
| H8 | C8 | H8A | 110.7° | 109.5° |
| H9 | C9 | H9A | 109.4° | 109.4° |
| H9 | C9 | H9B | 109.5° | 109.5° |
| H9A | C9 | H9B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | H1 | H1A | 120.0° | 120.0° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | C3 | H2 | 120.0° | 120.0° |
| C1 | C2 | C3 | H2A | 120.0° | 120.0° |
| C1 | C2 | H2 | H2A | 120.0° | 120.0° |
| C1 | C2 | C3 | C4 | 175.3° | 180.0° |
| C1 | C2 | C3 | H3 | 55.3° | 60.0° |
| C1 | C2 | C3 | H3A | 65.4° | 60.0° |
| H1 | C1 | H1A | H1B | 120.0° | 120.0° |
| H1 | C1 | C2 | C3 | 146.5° | 60.0° |
| H1 | C1 | C2 | H2 | 26.5° | 60.0° |
| H1 | C1 | C2 | H2A | 93.5° | 180.0° |
| H1A | C1 | C2 | C3 | 26.5° | 60.0° |
| H1A | C1 | C2 | H2 | 93.5° | 180.0° |
| H1A | C1 | C2 | H2A | 146.5° | 60.0° |
| H1B | C1 | C2 | C3 | 93.5° | 180.0° |
| H1B | C1 | C2 | H2 | 146.5° | 60.0° |
| H1B | C1 | C2 | H2A | 26.5° | 60.0° |
| C3 | C2 | H2 | H2A | 120.0° | 120.0° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 119.3° | 120.0° |
| C2 | C3 | H3 | H3A | 119.3° | 120.0° |
| C2 | C3 | C4 | C5 | 149.8° | 180.0° |
| C2 | C3 | C4 | H4 | 90.2° | 60.0° |
| C2 | C3 | C4 | H4A | 30.6° | 60.0° |
| H2 | C2 | C3 | C4 | 64.7° | 60.0° |
| H2 | C2 | C3 | H3 | 175.3° | 180.0° |
| H2 | C2 | C3 | H3A | 54.6° | 60.0° |
| H2A | C2 | C3 | C4 | 55.3° | 60.0° |
| H2A | C2 | C3 | H3 | 64.7° | 60.0° |
| H2A | C2 | C3 | H3A | 174.6° | 180.0° |
| C4 | C3 | H3 | H3A | 119.3° | 120.0° |
| C3 | C4 | C5 | H4 | 120.0° | 120.0° |
| C3 | C4 | C5 | H4A | 119.2° | 120.0° |
| C3 | C4 | H4 | H4A | 119.2° | 120.0° |
| C3 | C4 | C5 | C6 | 168.8° | 180.0° |
| C3 | C4 | C5 | H5 | 48.8° | 60.0° |
| C3 | C4 | C5 | H5A | 72.0° | 60.0° |
| H3 | C3 | C4 | C5 | 29.8° | 60.0° |
| H3 | C3 | C4 | H4 | 149.8° | 180.0° |
| H3 | C3 | C4 | H4A | 89.4° | 60.0° |
| H3A | C3 | C4 | C5 | 90.9° | 60.0° |
| H3A | C3 | C4 | H4 | 29.1° | 60.0° |
| H3A | C3 | C4 | H4A | 149.9° | 180.0° |
| C5 | C4 | H4 | H4A | 119.2° | 120.0° |
| C4 | C5 | C6 | H5 | 120.0° | 120.0° |
| C4 | C5 | C6 | H5A | 119.2° | 120.0° |
| C4 | C5 | H5 | H5A | 119.3° | 120.0° |
| C4 | C5 | C6 | C7 | 163.4° | 180.0° |
| C4 | C5 | C6 | H6 | 76.5° | 60.0° |
| C4 | C5 | C6 | H6A | 44.2° | 60.0° |
| H4 | C4 | C5 | C6 | 71.2° | 60.0° |
| H4 | C4 | C5 | H5 | 168.8° | 180.0° |
| H4 | C4 | C5 | H5A | 48.0° | 60.0° |
| H4A | C4 | C5 | C6 | 49.6° | 60.0° |
| H4A | C4 | C5 | H5 | 70.4° | 60.0° |
| H4A | C4 | C5 | H5A | 168.8° | 180.0° |
| C6 | C5 | H5 | H5A | 119.2° | 120.0° |
| C5 | C6 | C7 | H6 | 120.0° | 120.0° |
| C5 | C6 | C7 | H6A | 119.2° | 120.0° |
| C5 | C6 | H6 | H6A | 119.2° | 120.0° |
| C5 | C6 | C7 | C8 | 155.5° | 180.0° |
| C5 | C6 | C7 | H7 | 35.5° | 60.0° |
| C5 | C6 | C7 | H7A | 85.2° | 60.0° |
| H5 | C5 | C6 | C7 | 43.4° | 60.0° |
| H5 | C5 | C6 | H6 | 163.5° | 180.0° |
| H5 | C5 | C6 | H6A | 75.8° | 60.0° |
| H5A | C5 | C6 | C7 | 77.4° | 60.0° |
| H5A | C5 | C6 | H6 | 42.7° | 60.0° |
| H5A | C5 | C6 | H6A | 163.5° | 180.0° |
| C7 | C6 | H6 | H6A | 119.2° | 120.0° |
| C6 | C7 | C8 | H7 | 120.0° | 120.0° |
| C6 | C7 | C8 | H7A | 119.3° | 120.0° |
| C6 | C7 | H7 | H7A | 119.3° | 120.0° |
| C6 | C7 | C8 | C9 | 167.6° | 180.0° |
| C6 | C7 | C8 | H8 | 47.6° | 60.0° |
| C6 | C7 | C8 | H8A | 73.1° | 60.0° |
| H6 | C6 | C7 | C8 | 84.5° | 60.0° |
| H6 | C6 | C7 | H7 | 155.5° | 180.0° |
| H6 | C6 | C7 | H7A | 34.8° | 60.0° |
| H6A | C6 | C7 | C8 | 36.3° | 60.0° |
| H6A | C6 | C7 | H7 | 83.7° | 60.0° |
| H6A | C6 | C7 | H7A | 155.6° | 180.0° |
| C8 | C7 | H7 | H7A | 119.3° | 120.0° |
| C7 | C8 | C9 | H8 | 120.0° | 120.0° |
| C7 | C8 | C9 | H8A | 119.4° | 120.0° |
| C7 | C8 | H8 | H8A | 119.4° | 120.0° |
| C7 | C8 | C9 | H9 | 117.6° | 60.0° |
| C7 | C8 | C9 | H9A | 2.3° | 60.0° |
| C7 | C8 | C9 | H9B | 122.3° | 180.0° |
| H7 | C7 | C8 | C9 | 72.4° | 60.0° |
| H7 | C7 | C8 | H8 | 167.6° | 180.0° |
| H7 | C7 | C8 | H8A | 46.9° | 60.0° |
| H7A | C7 | C8 | C9 | 48.3° | 60.0° |
| H7A | C7 | C8 | H8 | 71.7° | 60.0° |
| H7A | C7 | C8 | H8A | 167.6° | 180.0° |
| C9 | C8 | H8 | H8A | 119.4° | 120.0° |
| C8 | C9 | H9 | H9A | 120.0° | 120.0° |
| C8 | C9 | H9 | H9B | 120.0° | 120.0° |
| C8 | C9 | H9A | H9B | 120.0° | 120.0° |
| H8 | C8 | C9 | H9 | 122.4° | 180.0° |
| H8 | C8 | C9 | H9A | 117.6° | 60.0° |
| H8 | C8 | C9 | H9B | 2.4° | 60.0° |
| H8A | C8 | C9 | H9 | 1.8° | 60.0° |
| H8A | C8 | C9 | H9A | 121.7° | 180.0° |
| H8A | C8 | C9 | H9B | 118.3° | 60.0° |
| H9 | C9 | H9A | H9B | 120.0° | 120.0° |
