9OD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O9 | C9 | doub | 1.21Å | 1.23Å | |
| C9 | C10 | sing | 1.51Å | 1.50Å | |
| C9 | C8 | sing | 1.51Å | 1.52Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | C2 | doub | 1.33Å | 1.34Å | |
| C2 | C1 | sing | 1.47Å | 1.48Å | |
| C1 | OE1 | sing | 1.35Å | 1.25Å | |
| C1 | OE2 | doub | 1.21Å | 1.25Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| OE1 | HOE1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O9 | C9 | C10 | 121.4° | 119.9° |
| O9 | C9 | C8 | 119.8° | 120.0° |
| C10 | C9 | C8 | 118.8° | 120.0° |
| C9 | C10 | H10 | 109.5° | 109.5° |
| C9 | C10 | H10A | 109.5° | 109.5° |
| C9 | C10 | H10B | 109.5° | 109.5° |
| C9 | C8 | C7 | 110.3° | 109.5° |
| C9 | C8 | H8 | 109.2° | 109.5° |
| C9 | C8 | H8A | 109.0° | 109.5° |
| C8 | C7 | C6 | 112.6° | 109.5° |
| C7 | C8 | H8 | 109.2° | 109.4° |
| C7 | C8 | H8A | 109.0° | 109.5° |
| C8 | C7 | H7 | 108.4° | 109.4° |
| C8 | C7 | H7A | 107.7° | 109.5° |
| C7 | C6 | C5 | 111.5° | 109.4° |
| C6 | C7 | H7 | 108.4° | 109.5° |
| C6 | C7 | H7A | 107.7° | 109.5° |
| C7 | C6 | H6 | 108.8° | 109.4° |
| C7 | C6 | H6A | 108.3° | 109.5° |
| C6 | C5 | C4 | 112.7° | 109.4° |
| C5 | C6 | H6 | 108.8° | 109.5° |
| C5 | C6 | H6A | 108.4° | 109.5° |
| C6 | C5 | H5 | 108.4° | 109.5° |
| C6 | C5 | H5A | 107.7° | 109.5° |
| C5 | C4 | C3 | 108.6° | 109.5° |
| C4 | C5 | H5 | 108.4° | 109.5° |
| C4 | C5 | H5A | 107.7° | 109.5° |
| C5 | C4 | H4 | 109.7° | 109.5° |
| C5 | C4 | H4A | 110.0° | 109.5° |
| C4 | C3 | C2 | 126.6° | 120.0° |
| C3 | C4 | H4 | 109.8° | 109.5° |
| C3 | C4 | H4A | 109.9° | 109.5° |
| C4 | C3 | H3 | 116.7° | 120.0° |
| C3 | C2 | C1 | 126.5° | 120.0° |
| C2 | C3 | H3 | 116.7° | 119.9° |
| C3 | C2 | H2 | 116.8° | 120.0° |
| C2 | C1 | OE1 | 117.2° | 120.0° |
| C2 | C1 | OE2 | 121.6° | 120.0° |
| C1 | C2 | H2 | 116.8° | 120.0° |
| OE1 | C1 | OE2 | 121.3° | 120.0° |
| C1 | OE1 | HOE1 | 109.5° | 117.0° |
| H10 | C10 | H10A | 109.5° | 109.4° |
| H10 | C10 | H10B | 109.5° | 109.4° |
| H10A | C10 | H10B | 109.5° | 109.4° |
| H8 | C8 | H8A | 110.1° | 109.5° |
| H7 | C7 | H7A | 111.9° | 109.5° |
| H6 | C6 | H6A | 111.0° | 109.5° |
| H5 | C5 | H5A | 112.0° | 109.5° |
| H4 | C4 | H4A | 108.8° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O9 | C9 | C10 | C8 | 179.9° | 179.7° |
| O9 | C9 | C8 | C7 | 42.4° | 0.0° |
| O9 | C9 | C10 | H10 | 155.3° | 0.0° |
| O9 | C9 | C10 | H10A | 35.2° | 120.0° |
| O9 | C9 | C10 | H10B | 84.7° | 120.0° |
| O9 | C9 | C8 | H8 | 77.7° | 120.0° |
| O9 | C9 | C8 | H8A | 162.0° | 120.0° |
| C10 | C9 | C8 | C7 | 137.6° | 179.8° |
| C9 | C10 | H10 | H10A | 120.0° | 120.0° |
| C9 | C10 | H10 | H10B | 120.0° | 120.1° |
| C9 | C10 | H10A | H10B | 120.0° | 120.0° |
| C10 | C9 | C8 | H8 | 102.4° | 60.3° |
| C10 | C9 | C8 | H8A | 17.9° | 59.7° |
| C9 | C8 | C7 | H8 | 120.0° | 120.0° |
| C9 | C8 | C7 | H8A | 119.7° | 120.0° |
| C9 | C8 | C7 | C6 | 171.8° | 180.0° |
| C8 | C9 | C10 | H10 | 24.8° | 179.7° |
| C8 | C9 | C10 | H10A | 144.9° | 59.7° |
| C8 | C9 | C10 | H10B | 95.2° | 60.3° |
| C9 | C8 | H8 | H8A | 119.7° | 120.0° |
| C9 | C8 | C7 | H7 | 51.8° | 60.0° |
| C9 | C8 | C7 | H7A | 69.5° | 60.0° |
| C8 | C7 | C6 | H7 | 120.0° | 119.9° |
| C8 | C7 | C6 | H7A | 118.7° | 120.0° |
| C8 | C7 | C6 | C5 | 175.6° | 180.0° |
| C7 | C8 | H8 | H8A | 119.6° | 120.0° |
| C8 | C7 | H7 | H7A | 118.7° | 120.0° |
| C8 | C7 | C6 | H6 | 55.6° | 60.0° |
| C8 | C7 | C6 | H6A | 65.2° | 60.0° |
| C7 | C6 | C5 | H6 | 120.0° | 119.9° |
| C7 | C6 | C5 | H6A | 119.1° | 120.0° |
| C7 | C6 | C5 | C4 | 136.8° | NaN° |
| C6 | C7 | C8 | H8 | 68.2° | 60.0° |
| C6 | C7 | C8 | H8A | 52.1° | 60.0° |
| C6 | C7 | H7 | H7A | 118.7° | 120.1° |
| C7 | C6 | H6 | H6A | 119.2° | 120.0° |
| C7 | C6 | C5 | H5 | 103.2° | 60.0° |
| C7 | C6 | C5 | H5A | 18.2° | 60.0° |
| C6 | C5 | C4 | H5 | 120.0° | 120.0° |
| C6 | C5 | C4 | H5A | 118.6° | 120.0° |
| C6 | C5 | C4 | C3 | 164.3° | 180.0° |
| C5 | C6 | C7 | H7 | 64.3° | 60.1° |
| C5 | C6 | C7 | H7A | 57.0° | 60.0° |
| C5 | C6 | H6 | H6A | 119.2° | 120.1° |
| C6 | C5 | H5 | H5A | 118.7° | 120.1° |
| C6 | C5 | C4 | H4 | 75.7° | 60.0° |
| C6 | C5 | C4 | H4A | 44.0° | 60.0° |
| C5 | C4 | C3 | H4 | 120.0° | 120.0° |
| C5 | C4 | C3 | H4A | 120.3° | 120.0° |
| C5 | C4 | C3 | C2 | 175.6° | 129.2° |
| C4 | C5 | C6 | H6 | 16.8° | 60.1° |
| C4 | C5 | C6 | H6A | 104.0° | 60.0° |
| C4 | C5 | H5 | H5A | 118.7° | 120.0° |
| C5 | C4 | H4 | H4A | 120.4° | 120.0° |
| C5 | C4 | C3 | H3 | 4.4° | 50.8° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.0° | 15.9° |
| C3 | C4 | C5 | H5 | 44.3° | 60.0° |
| C3 | C4 | C5 | H5A | 77.1° | 60.0° |
| C3 | C4 | H4 | H4A | 120.3° | 120.0° |
| C4 | C3 | C2 | H2 | 180.0° | 164.0° |
| C3 | C2 | C1 | H2 | 180.0° | 179.9° |
| C3 | C2 | C1 | OE1 | 179.7° | 172.6° |
| C3 | C2 | C1 | OE2 | 0.0° | 7.4° |
| C2 | C3 | C4 | H4 | 55.6° | 9.2° |
| C2 | C3 | C4 | H4A | 64.1° | 110.8° |
| C2 | C1 | OE1 | OE2 | 179.7° | 180.0° |
| C1 | C2 | C3 | H3 | 179.9° | 164.1° |
| C2 | C1 | OE1 | HOE1 | 179.7° | 180.0° |
| OE1 | C1 | C2 | H2 | 0.3° | 7.3° |
| OE2 | C1 | C2 | H2 | 179.9° | 172.7° |
| OE2 | C1 | OE1 | HOE1 | 0.0° | 0.0° |
| H10 | C10 | H10A | H10B | 120.0° | 119.9° |
| H8 | C8 | C7 | H7 | 171.8° | 180.0° |
| H8 | C8 | C7 | H7A | 50.5° | 60.0° |
| H8A | C8 | C7 | H7 | 67.9° | 60.0° |
| H8A | C8 | C7 | H7A | 170.8° | 180.0° |
| H7 | C7 | C6 | H6 | 175.7° | 179.9° |
| H7 | C7 | C6 | H6A | 54.8° | 60.0° |
| H7A | C7 | C6 | H6 | 63.0° | 60.0° |
| H7A | C7 | C6 | H6A | 176.1° | 180.0° |
| H6 | C6 | C5 | H5 | 136.8° | 180.0° |
| H6 | C6 | C5 | H5A | 101.8° | 59.9° |
| H6A | C6 | C5 | H5 | 16.0° | 60.0° |
| H6A | C6 | C5 | H5A | 137.4° | 180.0° |
| H5 | C5 | C4 | H4 | 164.3° | 180.0° |
| H5 | C5 | C4 | H4A | 76.0° | 60.0° |
| H5A | C5 | C4 | H4 | 42.9° | 60.0° |
| H5A | C5 | C4 | H4A | 162.6° | NaN° |
| H4 | C4 | C3 | H3 | 124.4° | 170.8° |
| H4A | C4 | C3 | H3 | 115.9° | 69.2° |
| H3 | C3 | C2 | H2 | 0.0° | 16.0° |
