I10
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.38Å | 1.37Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.34Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.10Å | |
| C2 | C3 | sing | 1.39Å | 1.32Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.10Å | |
| C3 | C7 | sing | 1.48Å | 1.48Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.36Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.41Å | Aromatic |
| C7 | C12 | doub | 1.39Å | 1.37Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.44Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| C9 | C10 | sing | 1.38Å | 1.43Å | Aromatic |
| C9 | C13 | sing | 1.51Å | 1.55Å | |
| C10 | C11 | doub | 1.38Å | 1.42Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | sing | 1.38Å | 1.43Å | Aromatic |
| C11 | H11 | sing | 1.08Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| C13 | C14 | sing | 1.51Å | 1.60Å | |
| C13 | C16 | sing | 1.53Å | 1.59Å | |
| C13 | H13 | sing | 1.09Å | 1.12Å | |
| C14 | N29 | sing | 1.35Å | 1.38Å | |
| C14 | O15 | doub | 1.21Å | 1.22Å | |
| C16 | C17 | sing | 1.53Å | 1.57Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C20 | C17 | sing | 1.53Å | 1.54Å | |
| C20 | H201 | sing | 1.09Å | 1.12Å | |
| C20 | H202 | sing | 1.09Å | 1.11Å | |
| C20 | H203 | sing | 1.09Å | 1.11Å | |
| C24 | C17 | sing | 1.53Å | 1.54Å | |
| C24 | H241 | sing | 1.09Å | 1.12Å | |
| C24 | H242 | sing | 1.09Å | 1.11Å | |
| C24 | H243 | sing | 1.09Å | 1.11Å | |
| N29 | C30 | sing | 1.46Å | 1.49Å | |
| N29 | HN2 | sing | 0.97Å | 0.98Å | |
| C30 | C31 | sing | 1.53Å | 1.54Å | |
| C30 | H301 | sing | 1.09Å | 1.11Å | |
| C30 | H302 | sing | 1.09Å | 1.11Å | |
| C31 | C35 | sing | 1.53Å | 1.54Å | |
| C31 | O34 | sing | 1.43Å | 1.38Å | |
| C31 | H31 | sing | 1.09Å | 1.12Å | |
| C35 | N36 | sing | 1.46Å | 1.45Å | |
| C35 | H351 | sing | 1.09Å | 1.11Å | |
| C35 | H352 | sing | 1.09Å | 1.11Å | |
| C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.10Å | |
| C5 | C6 | doub | 1.38Å | 1.35Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.12Å | |
| O34 | HO3 | sing | 0.97Å | 0.95Å | |
| N36 | S39 | sing | 1.66Å | 1.76Å | |
| N36 | HN3 | sing | 0.97Å | 0.92Å | |
| S39 | O40 | doub | 1.42Å | 1.46Å | |
| S39 | O41 | doub | 1.42Å | 1.41Å | |
| S39 | C42 | sing | 1.76Å | 1.64Å | |
| C42 | N43 | doub | 1.32Å | 1.31Å | Aromatic |
| C42 | C47 | sing | 1.38Å | 1.34Å | Aromatic |
| N43 | C44 | sing | 1.32Å | 1.35Å | Aromatic |
| C44 | C45 | doub | 1.38Å | 1.43Å | Aromatic |
| C44 | H44 | sing | 1.08Å | 1.10Å | |
| C45 | C46 | sing | 1.39Å | 1.43Å | Aromatic |
| C45 | H45 | sing | 1.08Å | 1.10Å | |
| C46 | C47 | doub | 1.39Å | 1.40Å | Aromatic |
| C46 | H46 | sing | 1.08Å | 1.10Å | |
| C47 | H47 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 120.8° | 120.1° |
| C2 | C1 | H1 | 120.6° | 119.9° |
| C1 | C2 | C3 | 123.5° | 119.9° |
| C1 | C2 | H2 | 120.0° | 120.1° |
| C6 | C1 | H1 | 118.6° | 120.0° |
| C1 | C6 | C5 | 117.3° | 120.2° |
| C1 | C6 | H6 | 120.9° | 119.9° |
| C3 | C2 | H2 | 116.5° | 120.0° |
| C2 | C3 | C7 | 122.2° | 120.1° |
| C2 | C3 | C4 | 116.0° | 119.8° |
| C7 | C3 | C4 | 121.8° | 120.1° |
| C3 | C7 | C8 | 124.8° | 120.1° |
| C3 | C7 | C12 | 118.1° | 120.1° |
| C3 | C4 | C5 | 121.4° | 119.9° |
| C3 | C4 | H4 | 118.7° | 120.1° |
| C8 | C7 | C12 | 116.8° | 119.8° |
| C7 | C8 | C9 | 123.5° | 119.9° |
| C7 | C8 | H8 | 117.2° | 120.1° |
| C7 | C12 | C11 | 123.0° | 119.9° |
| C7 | C12 | H12 | 116.4° | 120.1° |
| C9 | C8 | H8 | 119.3° | 120.0° |
| C8 | C9 | C10 | 117.9° | 120.1° |
| C8 | C9 | C13 | 117.6° | 120.0° |
| C10 | C9 | C13 | 123.9° | 119.9° |
| C9 | C10 | C11 | 118.5° | 120.3° |
| C9 | C10 | H10 | 121.2° | 119.8° |
| C9 | C13 | C14 | 109.1° | 109.6° |
| C9 | C13 | C16 | 112.8° | 109.5° |
| C9 | C13 | H13 | 107.5° | 109.4° |
| C11 | C10 | H10 | 120.3° | 119.9° |
| C10 | C11 | C12 | 120.3° | 120.1° |
| C10 | C11 | H11 | 119.6° | 119.9° |
| C12 | C11 | H11 | 120.1° | 120.0° |
| C11 | C12 | H12 | 120.6° | 120.1° |
| C14 | C13 | C16 | 109.2° | 109.5° |
| C14 | C13 | H13 | 111.1° | 109.4° |
| C13 | C14 | N29 | 116.6° | 120.1° |
| C13 | C14 | O15 | 119.3° | 119.9° |
| C16 | C13 | H13 | 107.3° | 109.5° |
| C13 | C16 | C17 | 123.3° | 109.4° |
| C13 | C16 | H161 | 107.3° | 109.4° |
| C13 | C16 | H162 | 107.3° | 109.5° |
| N29 | C14 | O15 | 124.1° | 120.0° |
| C14 | N29 | C30 | 125.9° | 120.1° |
| C14 | N29 | HN2 | 120.6° | 120.0° |
| C17 | C16 | H161 | 107.3° | 109.5° |
| C17 | C16 | H162 | 107.3° | 109.5° |
| C16 | C17 | C20 | 114.6° | 109.4° |
| C16 | C17 | C24 | 114.8° | 109.5° |
| C16 | C17 | H17 | 100.3° | 109.5° |
| H161 | C16 | H162 | 102.5° | 109.5° |
| C17 | C20 | H201 | 114.6° | 109.5° |
| C17 | C20 | H202 | 110.3° | 109.5° |
| C17 | C20 | H203 | 110.3° | 109.5° |
| C20 | C17 | C24 | 104.0° | 109.4° |
| C20 | C17 | H17 | 111.8° | 109.5° |
| H201 | C20 | H202 | 110.3° | 109.5° |
| H201 | C20 | H203 | 110.3° | 109.5° |
| H202 | C20 | H203 | 99.9° | 109.5° |
| C17 | C24 | H241 | 114.8° | 109.4° |
| C17 | C24 | H242 | 110.3° | 109.4° |
| C17 | C24 | H243 | 110.3° | 109.5° |
| C24 | C17 | H17 | 111.6° | 109.5° |
| H241 | C24 | H242 | 110.2° | 109.5° |
| H241 | C24 | H243 | 110.3° | 109.5° |
| H242 | C24 | H243 | 100.1° | 109.5° |
| C30 | N29 | HN2 | 113.5° | 120.0° |
| N29 | C30 | C31 | 109.4° | 109.5° |
| N29 | C30 | H301 | 112.3° | 109.5° |
| N29 | C30 | H302 | 112.2° | 109.5° |
| C31 | C30 | H301 | 112.2° | 109.4° |
| C31 | C30 | H302 | 112.2° | 109.5° |
| C30 | C31 | C35 | 113.7° | 109.5° |
| C30 | C31 | O34 | 112.0° | 109.5° |
| C30 | C31 | H31 | 104.1° | 109.4° |
| H301 | C30 | H302 | 98.2° | 109.5° |
| C35 | C31 | O34 | 107.6° | 109.5° |
| C35 | C31 | H31 | 108.8° | 109.4° |
| C31 | C35 | N36 | 116.3° | 109.5° |
| C31 | C35 | H351 | 109.7° | 109.5° |
| C31 | C35 | H352 | 109.7° | 109.4° |
| O34 | C31 | H31 | 110.6° | 109.5° |
| C31 | O34 | HO3 | 122.6° | 106.8° |
| N36 | C35 | H351 | 109.7° | 109.5° |
| N36 | C35 | H352 | 109.7° | 109.5° |
| C35 | N36 | S39 | 123.3° | 120.0° |
| C35 | N36 | HN3 | 110.7° | 120.0° |
| H351 | C35 | H352 | 100.5° | 109.5° |
| C5 | C4 | H4 | 119.9° | 120.1° |
| C4 | C5 | C6 | 121.0° | 120.1° |
| C4 | C5 | H5 | 120.4° | 119.9° |
| C6 | C5 | H5 | 118.5° | 120.0° |
| C5 | C6 | H6 | 121.8° | 119.9° |
| S39 | N36 | HN3 | 125.9° | 120.0° |
| N36 | S39 | O40 | 104.9° | 105.8° |
| N36 | S39 | O41 | 106.3° | 105.7° |
| N36 | S39 | C42 | 106.1° | 107.4° |
| O40 | S39 | O41 | 118.4° | 125.4° |
| O40 | S39 | C42 | 111.1° | 105.8° |
| O41 | S39 | C42 | 109.2° | 105.7° |
| S39 | C42 | N43 | 118.9° | 119.7° |
| S39 | C42 | C47 | 114.3° | 119.6° |
| N43 | C42 | C47 | 126.7° | 120.7° |
| C42 | N43 | C44 | 119.0° | 121.8° |
| C42 | C47 | C46 | 117.3° | 119.2° |
| C42 | C47 | H47 | 119.3° | 120.4° |
| N43 | C44 | C45 | 120.7° | 120.8° |
| N43 | C44 | H44 | 117.0° | 119.6° |
| C45 | C44 | H44 | 122.3° | 119.6° |
| C44 | C45 | C46 | 116.7° | 119.1° |
| C44 | C45 | H45 | 121.4° | 120.4° |
| C46 | C45 | H45 | 121.9° | 120.4° |
| C45 | C46 | C47 | 119.6° | 118.4° |
| C45 | C46 | H46 | 121.6° | 120.8° |
| C47 | C46 | H46 | 118.8° | 120.8° |
| C46 | C47 | H47 | 123.4° | 120.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | C7 | 178.2° | 180.0° |
| C1 | C2 | C3 | C4 | 0.2° | 0.2° |
| C2 | C1 | C6 | C5 | 0.1° | 0.0° |
| C2 | C1 | C6 | H6 | 179.9° | 180.0° |
| C6 | C1 | C2 | C3 | 0.0° | 0.0° |
| C6 | C1 | C2 | H2 | 179.9° | 179.9° |
| C1 | C6 | C5 | C4 | 0.0° | 0.2° |
| C1 | C6 | C5 | H6 | 180.0° | 180.0° |
| C1 | C6 | C5 | H5 | 179.9° | 180.0° |
| H1 | C1 | C2 | C3 | 180.0° | 180.0° |
| H1 | C1 | C2 | H2 | 0.0° | 0.0° |
| H1 | C1 | C6 | C5 | 179.9° | 180.0° |
| H1 | C1 | C6 | H6 | 0.1° | 0.0° |
| C2 | C3 | C7 | C4 | 178.3° | 179.8° |
| C2 | C3 | C7 | C8 | 37.7° | 139.8° |
| C2 | C3 | C7 | C12 | 148.1° | 40.0° |
| C2 | C3 | C4 | C5 | 0.4° | 0.5° |
| C2 | C3 | C4 | H4 | 179.7° | 180.0° |
| H2 | C2 | C3 | C7 | 1.8° | 0.0° |
| H2 | C2 | C3 | C4 | 179.8° | 179.8° |
| C3 | C7 | C8 | C12 | 174.3° | 179.8° |
| C3 | C7 | C8 | C9 | 173.5° | 179.7° |
| C3 | C7 | C8 | H8 | 6.4° | 0.2° |
| C3 | C7 | C12 | C11 | 174.1° | 179.9° |
| C3 | C7 | C12 | H12 | 5.9° | 0.0° |
| C7 | C3 | C4 | C5 | 178.1° | 179.8° |
| C7 | C3 | C4 | H4 | 1.9° | 0.3° |
| C4 | C3 | C7 | C8 | 140.7° | 40.0° |
| C4 | C3 | C7 | C12 | 33.6° | 140.2° |
| C3 | C4 | C5 | H4 | 180.0° | 179.5° |
| C3 | C4 | C5 | C6 | 0.3° | 0.5° |
| C3 | C4 | C5 | H5 | 179.7° | 179.8° |
| C7 | C8 | C9 | H8 | 180.0° | 179.4° |
| C7 | C8 | C9 | C10 | 0.3° | 0.5° |
| C7 | C8 | C9 | C13 | 170.6° | 179.7° |
| C8 | C7 | C12 | C11 | 0.6° | 0.3° |
| C8 | C7 | C12 | H12 | 179.4° | 179.8° |
| C12 | C7 | C8 | C9 | 0.7° | 0.5° |
| C12 | C7 | C8 | H8 | 179.3° | 180.0° |
| C7 | C12 | C11 | C10 | 0.0° | 0.0° |
| C7 | C12 | C11 | H12 | 180.0° | 179.9° |
| C7 | C12 | C11 | H11 | 179.9° | 180.0° |
| C8 | C9 | C10 | C13 | 170.3° | 179.8° |
| C8 | C9 | C10 | C11 | 0.3° | 0.2° |
| C8 | C9 | C10 | H10 | 179.7° | 179.7° |
| C8 | C9 | C13 | C14 | 82.6° | 120.2° |
| C8 | C9 | C13 | C16 | 38.9° | 119.7° |
| C8 | C9 | C13 | H13 | 156.9° | 0.2° |
| H8 | C8 | C9 | C10 | 179.7° | 179.9° |
| H8 | C8 | C9 | C13 | 9.4° | 0.3° |
| C9 | C10 | C11 | H10 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 0.5° | 0.0° |
| C9 | C10 | C11 | H11 | 179.5° | 180.0° |
| C10 | C9 | C13 | C14 | 87.8° | 60.0° |
| C10 | C9 | C13 | C16 | 150.8° | 60.1° |
| C10 | C9 | C13 | H13 | 32.8° | 180.0° |
| C13 | C9 | C10 | C11 | 170.6° | 180.0° |
| C13 | C9 | C10 | H10 | 9.4° | 0.1° |
| C9 | C13 | C14 | C16 | 123.6° | 120.0° |
| C9 | C13 | C14 | H13 | 118.3° | 120.0° |
| C9 | C13 | C16 | H13 | 118.1° | 119.9° |
| C9 | C13 | C14 | N29 | 101.4° | 173.4° |
| C9 | C13 | C14 | O15 | 78.5° | 6.6° |
| C9 | C13 | C16 | C17 | 177.0° | 65.7° |
| C9 | C13 | C16 | H161 | 51.8° | 174.3° |
| C9 | C13 | C16 | H162 | 57.7° | 54.3° |
| C10 | C11 | C12 | H11 | 180.0° | 180.0° |
| C10 | C11 | C12 | H12 | 180.0° | 179.9° |
| H10 | C10 | C11 | C12 | 179.5° | 180.0° |
| H10 | C10 | C11 | H11 | 0.5° | 0.0° |
| H11 | C11 | C12 | H12 | 0.1° | 0.1° |
| C14 | C13 | C16 | H13 | 120.5° | 119.9° |
| C13 | C14 | N29 | O15 | 179.9° | 180.0° |
| C14 | C13 | C16 | C17 | 61.6° | 174.2° |
| C14 | C13 | C16 | H161 | 173.2° | 54.2° |
| C14 | C13 | C16 | H162 | 63.6° | 65.8° |
| C13 | C14 | N29 | C30 | 179.8° | 174.9° |
| C13 | C14 | N29 | HN2 | 0.2° | 5.0° |
| C16 | C13 | C14 | N29 | 135.0° | 66.5° |
| C16 | C13 | C14 | O15 | 45.1° | 113.4° |
| C13 | C16 | C17 | H161 | 125.2° | 119.9° |
| C13 | C16 | C17 | H162 | 125.2° | 120.0° |
| C13 | C16 | H161 | H162 | 112.8° | 120.0° |
| C13 | C16 | C17 | C20 | 176.8° | 174.5° |
| C13 | C16 | C17 | C24 | 62.8° | 65.6° |
| C13 | C16 | C17 | H17 | 56.9° | 54.5° |
| H13 | C13 | C14 | N29 | 16.9° | 53.4° |
| H13 | C13 | C14 | O15 | 163.2° | 126.6° |
| H13 | C13 | C16 | C17 | 58.9° | 54.2° |
| H13 | C13 | C16 | H161 | 66.3° | 65.8° |
| H13 | C13 | C16 | H162 | 175.9° | 174.2° |
| C14 | N29 | C30 | HN2 | 179.6° | 179.9° |
| C14 | N29 | C30 | C31 | 115.3° | 175.1° |
| C14 | N29 | C30 | H301 | 9.9° | 55.1° |
| C14 | N29 | C30 | H302 | 119.4° | 64.9° |
| O15 | C14 | N29 | C30 | 0.3° | 5.2° |
| O15 | C14 | N29 | HN2 | 179.9° | 175.0° |
| C17 | C16 | H161 | H162 | 112.8° | 120.1° |
| C16 | C17 | C20 | C24 | 126.2° | 120.0° |
| C16 | C17 | C20 | H17 | 113.3° | 120.0° |
| C16 | C17 | C20 | H201 | 180.0° | 180.0° |
| C16 | C17 | C20 | H202 | 54.7° | 60.0° |
| C16 | C17 | C20 | H203 | 54.7° | 60.0° |
| C16 | C17 | C24 | H17 | 113.2° | 120.0° |
| C16 | C17 | C24 | H241 | 180.0° | 63.7° |
| C16 | C17 | C24 | H242 | 54.8° | 56.2° |
| C16 | C17 | C24 | H243 | 54.8° | 176.3° |
| H161 | C16 | C17 | C20 | 58.0° | 65.6° |
| H161 | C16 | C17 | C24 | 62.4° | 54.4° |
| H161 | C16 | C17 | H17 | 177.9° | 174.4° |
| H162 | C16 | C17 | C20 | 51.6° | 54.5° |
| H162 | C16 | C17 | C24 | 171.9° | 174.4° |
| H162 | C16 | C17 | H17 | 68.3° | 65.5° |
| C17 | C20 | H201 | H202 | 125.3° | 120.0° |
| C17 | C20 | H201 | H203 | 125.3° | 120.0° |
| C17 | C20 | H202 | H203 | 116.2° | 120.0° |
| C20 | C17 | C24 | H17 | 120.7° | 120.0° |
| C20 | C17 | C24 | H241 | 54.0° | 56.2° |
| C20 | C17 | C24 | H242 | 179.1° | 176.2° |
| C20 | C17 | C24 | H243 | 71.3° | 63.8° |
| H201 | C20 | H202 | H203 | 116.2° | 120.1° |
| H201 | C20 | C17 | C24 | 53.8° | 60.1° |
| H201 | C20 | C17 | H17 | 66.7° | 60.0° |
| H202 | C20 | C17 | C24 | 71.4° | 180.0° |
| H202 | C20 | C17 | H17 | 168.0° | 60.0° |
| H203 | C20 | C17 | C24 | 179.1° | 60.0° |
| H203 | C20 | C17 | H17 | 58.5° | 180.0° |
| C17 | C24 | H241 | H242 | 125.2° | 119.9° |
| C17 | C24 | H241 | H243 | 125.3° | 120.0° |
| C17 | C24 | H242 | H243 | 116.1° | 120.0° |
| H241 | C24 | H242 | H243 | 116.1° | 120.1° |
| H241 | C24 | C17 | H17 | 66.7° | 176.2° |
| H242 | C24 | C17 | H17 | 58.4° | 63.8° |
| H243 | C24 | C17 | H17 | 168.0° | 56.3° |
| N29 | C30 | C31 | H301 | 125.3° | 120.0° |
| N29 | C30 | C31 | H302 | 125.3° | 120.1° |
| N29 | C30 | H301 | H302 | 118.2° | 120.0° |
| N29 | C30 | C31 | C35 | 50.6° | 174.8° |
| N29 | C30 | C31 | O34 | 172.9° | 65.2° |
| N29 | C30 | C31 | H31 | 67.7° | 54.8° |
| HN2 | N29 | C30 | C31 | 64.3° | 5.1° |
| HN2 | N29 | C30 | H301 | 170.5° | 125.0° |
| HN2 | N29 | C30 | H302 | 60.9° | 115.0° |
| C31 | C30 | H301 | H302 | 118.1° | 119.9° |
| C30 | C31 | C35 | O34 | 124.7° | 120.0° |
| C30 | C31 | C35 | H31 | 115.5° | 120.0° |
| C30 | C31 | O34 | H31 | 115.6° | 120.0° |
| C30 | C31 | C35 | N36 | 165.4° | 180.0° |
| C30 | C31 | C35 | H351 | 40.1° | 60.0° |
| C30 | C31 | C35 | H352 | 69.4° | 60.0° |
| C30 | C31 | O34 | HO3 | 60.8° | 60.1° |
| H301 | C30 | C31 | C35 | 175.8° | 65.2° |
| H301 | C30 | C31 | O34 | 61.9° | 54.8° |
| H301 | C30 | C31 | H31 | 57.6° | 174.8° |
| H302 | C30 | C31 | C35 | 74.7° | 54.7° |
| H302 | C30 | C31 | O34 | 47.6° | 174.7° |
| H302 | C30 | C31 | H31 | 167.1° | 65.2° |
| C35 | C31 | O34 | H31 | 118.7° | 120.0° |
| C31 | C35 | N36 | H351 | 125.3° | 120.0° |
| C31 | C35 | N36 | H352 | 125.2° | 120.0° |
| C31 | C35 | H351 | H352 | 115.5° | 120.0° |
| C35 | C31 | O34 | HO3 | 64.9° | 60.0° |
| C31 | C35 | N36 | S39 | 116.5° | 180.0° |
| C31 | C35 | N36 | HN3 | 66.8° | 0.0° |
| O34 | C31 | C35 | N36 | 40.7° | 60.0° |
| O34 | C31 | C35 | H351 | 84.5° | 60.0° |
| O34 | C31 | C35 | H352 | 166.0° | 180.0° |
| H31 | C31 | C35 | N36 | 79.1° | 60.0° |
| H31 | C31 | C35 | H351 | 155.7° | 180.0° |
| H31 | C31 | C35 | H352 | 46.2° | 60.0° |
| H31 | C31 | O34 | HO3 | 176.5° | 180.0° |
| N36 | C35 | H351 | H352 | 115.5° | 120.0° |
| C35 | N36 | S39 | HN3 | 176.2° | 180.0° |
| C35 | N36 | S39 | O40 | 33.8° | 172.6° |
| C35 | N36 | S39 | O41 | 160.1° | 52.6° |
| C35 | N36 | S39 | C42 | 83.8° | 59.9° |
| H351 | C35 | N36 | S39 | 8.8° | 60.0° |
| H351 | C35 | N36 | HN3 | 167.9° | 120.0° |
| H352 | C35 | N36 | S39 | 118.3° | 60.0° |
| H352 | C35 | N36 | HN3 | 58.4° | 120.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.8° |
| C4 | C5 | C6 | H6 | 180.0° | 179.7° |
| H4 | C4 | C5 | C6 | 179.7° | 180.0° |
| H4 | C4 | C5 | H5 | 0.3° | 0.2° |
| H5 | C5 | C6 | H6 | 0.0° | 0.0° |
| N36 | S39 | O40 | O41 | 118.3° | 123.1° |
| N36 | S39 | O40 | C42 | 114.2° | 113.8° |
| N36 | S39 | O41 | C42 | 114.0° | 113.7° |
| N36 | S39 | C42 | N43 | 94.4° | 90.2° |
| N36 | S39 | C42 | C47 | 82.7° | 90.1° |
| HN3 | N36 | S39 | O40 | 149.9° | 7.4° |
| HN3 | N36 | S39 | O41 | 23.7° | 127.4° |
| HN3 | N36 | S39 | C42 | 92.4° | 120.0° |
| O40 | S39 | O41 | C42 | 128.3° | 123.2° |
| O40 | S39 | C42 | N43 | 152.1° | 157.1° |
| O40 | S39 | C42 | C47 | 30.8° | 22.6° |
| O41 | S39 | C42 | N43 | 19.8° | 22.3° |
| O41 | S39 | C42 | C47 | 163.2° | 157.4° |
| S39 | C42 | N43 | C47 | 176.6° | 179.7° |
| S39 | C42 | N43 | C44 | 176.3° | 179.7° |
| S39 | C42 | C47 | C46 | 176.5° | 180.0° |
| S39 | C42 | C47 | H47 | 3.5° | 0.1° |
| C42 | N43 | C44 | C45 | 0.4° | 0.6° |
| C42 | N43 | C44 | H44 | 179.6° | 179.8° |
| N43 | C42 | C47 | C46 | 0.3° | 0.3° |
| N43 | C42 | C47 | H47 | 179.7° | 179.8° |
| C47 | C42 | N43 | C44 | 0.4° | 0.6° |
| C42 | C47 | C46 | C45 | 0.3° | 0.1° |
| C42 | C47 | C46 | H47 | 180.0° | 179.9° |
| C42 | C47 | C46 | H46 | 179.7° | 180.0° |
| N43 | C44 | C45 | H44 | 180.0° | 179.7° |
| N43 | C44 | C45 | C46 | 0.4° | 0.3° |
| N43 | C44 | C45 | H45 | 179.6° | 179.7° |
| C44 | C45 | C46 | H45 | 180.0° | 180.0° |
| C44 | C45 | C46 | C47 | 0.4° | 0.1° |
| C44 | C45 | C46 | H46 | 179.7° | 180.0° |
| H44 | C44 | C45 | C46 | 179.6° | 180.0° |
| H44 | C44 | C45 | H45 | 0.4° | 0.0° |
| C45 | C46 | C47 | H46 | 180.0° | 180.0° |
| C45 | C46 | C47 | H47 | 179.7° | 180.0° |
| H45 | C45 | C46 | C47 | 179.6° | 180.0° |
| H45 | C45 | C46 | H46 | 0.4° | 0.0° |
| H46 | C46 | C47 | H47 | 0.3° | 0.1° |
