IH1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C28 | doub | 1.38Å | 1.32Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | BR | sing | 1.89Å | 1.77Å | |
| C28 | C29 | sing | 1.38Å | 1.35Å | Aromatic |
| C28 | HC28 | sing | 1.08Å | 1.10Å | |
| C29 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | HC29 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.38Å | 1.32Å | Aromatic |
| C24 | S | sing | 1.76Å | 1.73Å | |
| C25 | C26 | doub | 1.38Å | 1.35Å | Aromatic |
| C25 | HC25 | sing | 1.08Å | 1.10Å | |
| C26 | HC26 | sing | 1.08Å | 1.10Å | |
| S | O1 | doub | 1.42Å | 1.46Å | |
| S | O2 | doub | 1.42Å | 1.48Å | |
| S | C23 | sing | 1.81Å | 1.74Å | |
| C23 | C22 | sing | 1.53Å | 1.60Å | |
| C23 | H231 | sing | 1.09Å | 1.11Å | |
| C23 | H232 | sing | 1.09Å | 1.11Å | |
| C22 | N20 | sing | 1.47Å | 1.38Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.12Å | |
| C13 | C14 | sing | 1.51Å | 1.41Å | |
| C13 | N18 | sing | 1.47Å | 1.45Å | |
| C13 | C12 | sing | 1.51Å | 1.69Å | |
| C13 | HC13 | sing | 1.09Å | 1.12Å | |
| C14 | C15 | doub | 1.31Å | 1.33Å | |
| C14 | HC14 | sing | 1.08Å | 1.10Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C15 | HC15 | sing | 1.08Å | 1.10Å | |
| C16 | N17 | sing | 1.47Å | 1.35Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C19 | N17 | sing | 1.33Å | 1.39Å | Aromatic |
| C19 | O19 | doub | 1.22Å | 1.22Å | |
| C19 | N20 | sing | 1.35Å | 1.28Å | Aromatic |
| C21 | N18 | sing | 1.33Å | 1.28Å | Aromatic |
| C21 | O21 | doub | 1.21Å | 1.14Å | |
| C21 | N20 | sing | 1.35Å | 1.39Å | Aromatic |
| N17 | N18 | sing | 1.42Å | 1.35Å | Aromatic |
| C12 | O12 | doub | 1.21Å | 1.29Å | |
| C12 | N9 | sing | 1.35Å | 1.41Å | |
| C1 | C2 | sing | 1.53Å | 1.42Å | |
| C1 | N9 | sing | 1.46Å | 1.13Å | |
| C1 | HC11 | sing | 1.09Å | 1.11Å | |
| C1 | HC12 | sing | 1.09Å | 1.12Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C7 | sing | 1.53Å | 1.55Å | |
| C2 | HC2 | sing | 1.09Å | 1.12Å | |
| C3 | C4 | sing | 1.53Å | 1.42Å | |
| C3 | HC31 | sing | 1.09Å | 1.11Å | |
| C3 | HC32 | sing | 1.09Å | 1.12Å | |
| C4 | C5 | sing | 1.53Å | 1.61Å | |
| C4 | HC41 | sing | 1.09Å | 1.12Å | |
| C4 | HC42 | sing | 1.09Å | 1.11Å | |
| C5 | C6 | sing | 1.53Å | 1.56Å | |
| C5 | C8 | sing | 1.51Å | 1.40Å | |
| C5 | HC5 | sing | 1.09Å | 1.11Å | |
| C6 | C7 | sing | 1.53Å | 1.36Å | |
| C6 | HC61 | sing | 1.09Å | 1.11Å | |
| C6 | HC62 | sing | 1.09Å | 1.12Å | |
| N9 | HN9 | sing | 0.97Å | 1.02Å | |
| C7 | HC71 | sing | 1.09Å | 1.12Å | |
| C7 | HC72 | sing | 1.09Å | 1.11Å | |
| C8 | N11 | sing | 1.37Å | 1.28Å | |
| C8 | N10 | doub | 1.29Å | 1.31Å | |
| N11 | H111 | sing | 0.97Å | 1.02Å | |
| N11 | H112 | sing | 0.97Å | 1.02Å | |
| N10 | HN10 | sing | 0.97Å | 1.02Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | C27 | C26 | 125.7° | 120.0° |
| C28 | C27 | BR | 116.0° | 120.0° |
| C27 | C28 | C29 | 113.4° | 120.0° |
| C27 | C28 | HC28 | 122.2° | 120.0° |
| C26 | C27 | BR | 117.9° | 120.0° |
| C27 | C26 | C25 | 118.7° | 120.0° |
| C27 | C26 | HC26 | 122.5° | 120.0° |
| C29 | C28 | HC28 | 124.4° | 120.0° |
| C28 | C29 | C24 | 122.2° | 120.0° |
| C28 | C29 | HC29 | 117.5° | 120.0° |
| C24 | C29 | HC29 | 120.2° | 120.0° |
| C29 | C24 | C25 | 122.7° | 120.0° |
| C29 | C24 | S | 124.4° | 120.0° |
| C25 | C24 | S | 112.8° | 120.0° |
| C24 | C25 | C26 | 117.0° | 120.0° |
| C24 | C25 | HC25 | 120.4° | 120.0° |
| C24 | S | O1 | 103.1° | 102.8° |
| C24 | S | O2 | 104.7° | 102.8° |
| C24 | S | C23 | 111.2° | 103.2° |
| C26 | C25 | HC25 | 122.6° | 120.0° |
| C25 | C26 | HC26 | 118.8° | 120.0° |
| O1 | S | O2 | 113.6° | 122.1° |
| O1 | S | C23 | 110.9° | 111.6° |
| O2 | S | C23 | 112.7° | 111.6° |
| S | C23 | C22 | 116.6° | 109.5° |
| S | C23 | H231 | 109.6° | 109.5° |
| S | C23 | H232 | 109.7° | 109.5° |
| C22 | C23 | H231 | 109.6° | 109.5° |
| C22 | C23 | H232 | 109.6° | 109.5° |
| C23 | C22 | N20 | 117.5° | 109.5° |
| C23 | C22 | H221 | 109.3° | 109.5° |
| C23 | C22 | H222 | 109.3° | 109.5° |
| H231 | C23 | H232 | 100.6° | 109.5° |
| N20 | C22 | H221 | 109.3° | 109.5° |
| N20 | C22 | H222 | 109.3° | 109.5° |
| C22 | N20 | C19 | 126.1° | 125.3° |
| C22 | N20 | C21 | 123.7° | 125.3° |
| H221 | C22 | H222 | 100.8° | 109.5° |
| C14 | C13 | N18 | 105.3° | 107.6° |
| C14 | C13 | C12 | 112.3° | 109.9° |
| C14 | C13 | HC13 | 114.8° | 109.9° |
| C13 | C14 | C15 | 132.8° | 122.3° |
| C13 | C14 | HC14 | 117.6° | 118.9° |
| N18 | C13 | C12 | 119.7° | 109.9° |
| N18 | C13 | HC13 | 106.5° | 109.8° |
| C13 | N18 | C21 | 126.4° | 131.9° |
| C13 | N18 | N17 | 120.9° | 120.8° |
| C12 | C13 | HC13 | 98.3° | 109.8° |
| C13 | C12 | O12 | 121.8° | 120.0° |
| C13 | C12 | N9 | 130.0° | 120.0° |
| C15 | C14 | HC14 | 109.6° | 118.8° |
| C14 | C15 | C16 | 115.3° | 122.3° |
| C14 | C15 | HC15 | 116.5° | 118.8° |
| C16 | C15 | HC15 | 128.2° | 118.8° |
| C15 | C16 | N17 | 112.8° | 107.5° |
| C15 | C16 | H161 | 111.0° | 109.8° |
| C15 | C16 | H162 | 111.0° | 109.9° |
| N17 | C16 | H161 | 111.0° | 109.9° |
| N17 | C16 | H162 | 111.0° | 109.9° |
| C16 | N17 | C19 | 120.4° | 131.9° |
| C16 | N17 | N18 | 125.5° | 120.9° |
| H161 | C16 | H162 | 99.4° | 109.9° |
| N17 | C19 | O19 | 119.5° | 125.9° |
| N17 | C19 | N20 | 102.8° | 108.1° |
| C19 | N17 | N18 | 109.5° | 107.2° |
| O19 | C19 | N20 | 137.2° | 126.0° |
| C19 | N20 | C21 | 110.1° | 109.4° |
| N18 | C21 | O21 | 127.0° | 126.0° |
| N18 | C21 | N20 | 108.6° | 108.1° |
| C21 | N18 | N17 | 104.6° | 107.2° |
| O21 | C21 | N20 | 124.4° | 125.9° |
| O12 | C12 | N9 | 105.6° | 120.0° |
| C12 | N9 | C1 | 138.9° | 120.0° |
| C12 | N9 | HN9 | 127.2° | 120.0° |
| C2 | C1 | N9 | 122.7° | 109.5° |
| C2 | C1 | HC11 | 107.5° | 109.4° |
| C2 | C1 | HC12 | 107.5° | 109.5° |
| C1 | C2 | C3 | 123.1° | 109.5° |
| C1 | C2 | C7 | 105.7° | 109.5° |
| C1 | C2 | HC2 | 105.1° | 109.5° |
| N9 | C1 | HC11 | 107.5° | 109.4° |
| N9 | C1 | HC12 | 107.5° | 109.5° |
| C1 | N9 | HN9 | 93.9° | 120.0° |
| HC11 | C1 | HC12 | 102.3° | 109.5° |
| C3 | C2 | C7 | 115.8° | 109.5° |
| C3 | C2 | HC2 | 91.4° | 109.5° |
| C2 | C3 | C4 | 112.5° | 109.5° |
| C2 | C3 | HC31 | 111.1° | 109.5° |
| C2 | C3 | HC32 | 111.1° | 109.5° |
| C7 | C2 | HC2 | 114.7° | 109.4° |
| C2 | C7 | C6 | 113.3° | 109.5° |
| C2 | C7 | HC71 | 110.8° | 109.5° |
| C2 | C7 | HC72 | 110.8° | 109.5° |
| C4 | C3 | HC31 | 111.1° | 109.5° |
| C4 | C3 | HC32 | 111.1° | 109.4° |
| C3 | C4 | C5 | 110.4° | 109.4° |
| C3 | C4 | HC41 | 111.8° | 109.5° |
| C3 | C4 | HC42 | 111.8° | 109.5° |
| HC31 | C3 | HC32 | 99.2° | 109.5° |
| C5 | C4 | HC41 | 111.9° | 109.5° |
| C5 | C4 | HC42 | 111.9° | 109.4° |
| C4 | C5 | C6 | 98.8° | 109.5° |
| C4 | C5 | C8 | 103.9° | 109.4° |
| C4 | C5 | HC5 | 117.3° | 109.5° |
| HC41 | C4 | HC42 | 98.5° | 109.6° |
| C6 | C5 | C8 | 103.5° | 109.5° |
| C6 | C5 | HC5 | 117.7° | 109.5° |
| C5 | C6 | C7 | 124.4° | 109.5° |
| C5 | C6 | HC61 | 106.9° | 109.5° |
| C5 | C6 | HC62 | 106.9° | 109.4° |
| C8 | C5 | HC5 | 113.5° | 109.5° |
| C5 | C8 | N11 | 122.7° | 120.0° |
| C5 | C8 | N10 | 115.8° | 120.0° |
| C7 | C6 | HC61 | 106.9° | 109.5° |
| C7 | C6 | HC62 | 106.9° | 109.5° |
| C6 | C7 | HC71 | 110.8° | 109.5° |
| C6 | C7 | HC72 | 110.8° | 109.5° |
| HC61 | C6 | HC62 | 102.7° | 109.4° |
| HC71 | C7 | HC72 | 99.6° | 109.4° |
| N11 | C8 | N10 | 121.0° | 120.0° |
| C8 | N11 | H111 | 122.7° | 120.0° |
| C8 | N11 | H112 | 107.5° | 120.1° |
| C8 | N10 | HN10 | 92.3° | 120.0° |
| H111 | N11 | H112 | 107.6° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | C27 | C26 | BR | 173.1° | 180.0° |
| C27 | C28 | C29 | HC28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C24 | 2.2° | 0.1° |
| C27 | C28 | C29 | HC29 | 177.8° | 180.0° |
| C28 | C27 | C26 | C25 | 5.1° | 0.3° |
| C28 | C27 | C26 | HC26 | 174.8° | 179.9° |
| C26 | C27 | C28 | C29 | 5.6° | 0.1° |
| C26 | C27 | C28 | HC28 | 174.3° | 180.0° |
| C27 | C26 | C25 | C24 | 0.7° | 0.6° |
| C27 | C26 | C25 | HC26 | 180.0° | 179.7° |
| C27 | C26 | C25 | HC25 | 179.3° | 180.0° |
| BR | C27 | C28 | C29 | 178.9° | 180.0° |
| BR | C27 | C28 | HC28 | 1.1° | 0.0° |
| BR | C27 | C26 | C25 | 178.3° | 179.7° |
| BR | C27 | C26 | HC26 | 1.7° | 0.0° |
| C28 | C29 | C24 | HC29 | 180.0° | 179.9° |
| C28 | C29 | C24 | C25 | 1.8° | 0.3° |
| C28 | C29 | C24 | S | 177.0° | 180.0° |
| HC28 | C28 | C29 | C24 | 177.7° | 180.0° |
| HC28 | C28 | C29 | HC29 | 2.2° | 0.1° |
| C29 | C24 | C25 | S | 175.7° | 179.7° |
| C29 | C24 | C25 | C26 | 2.5° | 0.6° |
| C29 | C24 | C25 | HC25 | 177.5° | 180.0° |
| C29 | C24 | S | O1 | 16.3° | 26.2° |
| C29 | C24 | S | O2 | 102.8° | 153.8° |
| C29 | C24 | S | C23 | 135.2° | 90.0° |
| HC29 | C29 | C24 | C25 | 178.2° | 179.8° |
| HC29 | C29 | C24 | S | 3.0° | 0.1° |
| C24 | C25 | C26 | HC25 | 180.0° | 179.4° |
| C24 | C25 | C26 | HC26 | 179.3° | 179.6° |
| C25 | C24 | S | O1 | 159.3° | 153.5° |
| C25 | C24 | S | O2 | 81.6° | 25.9° |
| C25 | C24 | S | C23 | 40.4° | 90.3° |
| S | C24 | C25 | C26 | 178.2° | 179.7° |
| S | C24 | C25 | HC25 | 1.8° | 0.3° |
| C24 | S | O1 | O2 | 112.8° | 114.3° |
| C24 | S | O1 | C23 | 119.1° | 110.0° |
| C24 | S | O2 | C23 | 121.0° | 110.0° |
| C24 | S | C23 | C22 | 73.7° | 180.0° |
| C24 | S | C23 | H231 | 51.6° | 60.0° |
| C24 | S | C23 | H232 | 161.1° | 60.0° |
| HC25 | C25 | C26 | HC26 | 0.7° | 0.2° |
| O1 | S | O2 | C23 | 127.2° | 135.7° |
| O1 | S | C23 | C22 | 40.4° | 70.3° |
| O1 | S | C23 | H231 | 165.7° | 169.8° |
| O1 | S | C23 | H232 | 84.8° | 49.8° |
| O2 | S | C23 | C22 | 169.1° | 70.2° |
| O2 | S | C23 | H231 | 65.7° | 49.7° |
| O2 | S | C23 | H232 | 43.8° | 169.7° |
| S | C23 | C22 | H231 | 125.3° | 120.0° |
| S | C23 | C22 | H232 | 125.3° | 120.0° |
| S | C23 | H231 | H232 | 115.5° | 120.0° |
| S | C23 | C22 | N20 | 61.7° | 180.0° |
| S | C23 | C22 | H221 | 173.0° | 60.0° |
| S | C23 | C22 | H222 | 63.6° | 60.0° |
| C22 | C23 | H231 | H232 | 115.4° | 120.0° |
| C23 | C22 | N20 | H221 | 125.3° | 120.0° |
| C23 | C22 | N20 | H222 | 125.3° | 120.0° |
| C23 | C22 | H221 | H222 | 115.1° | 120.0° |
| C23 | C22 | N20 | C19 | 57.0° | 89.9° |
| C23 | C22 | N20 | C21 | 127.0° | 90.0° |
| H231 | C23 | C22 | N20 | 63.6° | 60.0° |
| H231 | C23 | C22 | H221 | 61.7° | 180.0° |
| H231 | C23 | C22 | H222 | 171.1° | 60.0° |
| H232 | C23 | C22 | N20 | 173.0° | 60.0° |
| H232 | C23 | C22 | H221 | 47.8° | 60.0° |
| H232 | C23 | C22 | H222 | 61.7° | 180.0° |
| N20 | C22 | H221 | H222 | 115.0° | 120.0° |
| C22 | N20 | C19 | N17 | 165.6° | 180.0° |
| C22 | N20 | C19 | O19 | 5.9° | 0.0° |
| C22 | N20 | C19 | C21 | 176.5° | 180.0° |
| C22 | N20 | C21 | N18 | 178.2° | 180.0° |
| C22 | N20 | C21 | O21 | 0.1° | 0.0° |
| H221 | C22 | N20 | C19 | 68.3° | 30.0° |
| H221 | C22 | N20 | C21 | 107.7° | 150.0° |
| H222 | C22 | N20 | C19 | 177.7° | 150.0° |
| H222 | C22 | N20 | C21 | 1.7° | 30.0° |
| C14 | C13 | N18 | C12 | 127.6° | 119.6° |
| C14 | C13 | N18 | HC13 | 122.3° | 119.5° |
| C14 | C13 | C12 | HC13 | 121.2° | 120.9° |
| C13 | C14 | C15 | HC14 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 3.5° | 0.0° |
| C13 | C14 | C15 | HC15 | 176.5° | 180.0° |
| C14 | C13 | N18 | C21 | 173.5° | 147.3° |
| C14 | C13 | N18 | N17 | 29.6° | 32.6° |
| C14 | C13 | C12 | O12 | 8.1° | 119.0° |
| C14 | C13 | C12 | N9 | 167.3° | 60.9° |
| N18 | C13 | C12 | HC13 | 114.4° | 120.9° |
| N18 | C13 | C14 | C15 | 17.2° | 33.2° |
| N18 | C13 | C14 | HC14 | 162.8° | 146.8° |
| C13 | N18 | N17 | C16 | 32.6° | 0.1° |
| C13 | N18 | N17 | C19 | 171.8° | 180.0° |
| C13 | N18 | C21 | N17 | 148.5° | 179.9° |
| C13 | N18 | C21 | O21 | 15.9° | 0.1° |
| C13 | N18 | C21 | N20 | 162.4° | 179.9° |
| N18 | C13 | C12 | O12 | 132.4° | 0.9° |
| N18 | C13 | C12 | N9 | 68.4° | 179.0° |
| C12 | C13 | C14 | C15 | 114.7° | 86.4° |
| C12 | C13 | C14 | HC14 | 65.2° | 93.7° |
| C12 | C13 | N18 | C21 | 45.9° | 93.1° |
| C12 | C13 | N18 | N17 | 98.0° | 87.0° |
| C13 | C12 | O12 | N9 | 163.6° | 179.9° |
| C13 | C12 | N9 | C1 | 175.5° | 179.9° |
| C13 | C12 | N9 | HN9 | 4.4° | 0.0° |
| HC13 | C13 | C14 | C15 | 134.0° | 152.7° |
| HC13 | C13 | C14 | HC14 | 46.0° | 27.2° |
| HC13 | C13 | N18 | C21 | 64.2° | 27.7° |
| HC13 | C13 | N18 | N17 | 151.9° | 152.1° |
| HC13 | C13 | C12 | O12 | 113.1° | 120.0° |
| HC13 | C13 | C12 | N9 | 46.0° | 60.1° |
| C14 | C15 | C16 | HC15 | 180.0° | 180.0° |
| C14 | C15 | C16 | N17 | 0.1° | 33.1° |
| C14 | C15 | C16 | H161 | 125.2° | 86.4° |
| C14 | C15 | C16 | H162 | 125.3° | 152.7° |
| HC14 | C14 | C15 | C16 | 176.6° | 179.9° |
| HC14 | C14 | C15 | HC15 | 3.5° | 0.1° |
| C15 | C16 | N17 | H161 | 125.2° | 119.5° |
| C15 | C16 | N17 | H162 | 125.2° | 119.6° |
| C15 | C16 | H161 | H162 | 116.8° | 121.0° |
| C15 | C16 | N17 | C19 | 167.8° | 147.4° |
| C15 | C16 | N17 | N18 | 14.6° | 32.6° |
| HC15 | C15 | C16 | N17 | 180.0° | 146.9° |
| HC15 | C15 | C16 | H161 | 54.8° | 93.6° |
| HC15 | C15 | C16 | H162 | 54.7° | 27.3° |
| N17 | C16 | H161 | H162 | 116.9° | 121.0° |
| C16 | N17 | C19 | N18 | 157.1° | 180.0° |
| C16 | N17 | C19 | O19 | 9.7° | 0.0° |
| C16 | N17 | C19 | N20 | 177.0° | 179.9° |
| C16 | N17 | N18 | C21 | 176.8° | 179.9° |
| H161 | C16 | N17 | C19 | 67.0° | 93.1° |
| H161 | C16 | N17 | N18 | 139.8° | 86.9° |
| H162 | C16 | N17 | C19 | 42.5° | 27.9° |
| H162 | C16 | N17 | N18 | 110.7° | 152.2° |
| N17 | C19 | O19 | N20 | 170.5° | 180.0° |
| C19 | N17 | N18 | C21 | 21.2° | 0.1° |
| N17 | C19 | N20 | C21 | 10.9° | 0.0° |
| O19 | C19 | N20 | C21 | 177.6° | 180.0° |
| O19 | C19 | N17 | N18 | 166.7° | 180.0° |
| C19 | N20 | C21 | N18 | 1.7° | 0.0° |
| C19 | N20 | C21 | O21 | 176.7° | 179.9° |
| N20 | C19 | N17 | N18 | 19.9° | 0.1° |
| N18 | C21 | O21 | N20 | 178.0° | 179.9° |
| O21 | C21 | N18 | N17 | 164.4° | 180.0° |
| N20 | C21 | N18 | N17 | 13.9° | 0.0° |
| O12 | C12 | N9 | C1 | 13.8° | 0.0° |
| O12 | C12 | N9 | HN9 | 166.1° | 179.9° |
| C12 | N9 | C1 | C2 | 177.7° | 180.0° |
| C12 | N9 | C1 | HN9 | 180.0° | 179.9° |
| C12 | N9 | C1 | HC11 | 57.1° | 60.1° |
| C12 | N9 | C1 | HC12 | 52.4° | 60.0° |
| C2 | C1 | N9 | HC11 | 125.3° | 119.9° |
| C2 | C1 | N9 | HC12 | 125.3° | 120.0° |
| C2 | C1 | HC11 | HC12 | 113.0° | 120.0° |
| C1 | C2 | C3 | C7 | 132.4° | 120.1° |
| C1 | C2 | C3 | HC2 | 109.1° | 120.0° |
| C1 | C2 | C7 | HC2 | 115.3° | 120.0° |
| C1 | C2 | C3 | C4 | 172.5° | 180.0° |
| C1 | C2 | C3 | HC31 | 47.2° | 60.0° |
| C1 | C2 | C3 | HC32 | 62.3° | 60.0° |
| C1 | C2 | C7 | C6 | 164.8° | 180.0° |
| C2 | C1 | N9 | HN9 | 2.3° | 0.2° |
| C1 | C2 | C7 | HC71 | 70.0° | 60.0° |
| C1 | C2 | C7 | HC72 | 39.5° | 59.9° |
| N9 | C1 | HC11 | HC12 | 113.1° | 120.1° |
| N9 | C1 | C2 | C3 | 94.8° | 180.0° |
| N9 | C1 | C2 | C7 | 41.5° | 59.9° |
| N9 | C1 | C2 | HC2 | 163.2° | 60.1° |
| HC11 | C1 | C2 | C3 | 139.9° | 60.0° |
| HC11 | C1 | C2 | C7 | 83.8° | 60.0° |
| HC11 | C1 | C2 | HC2 | 37.9° | 180.0° |
| HC11 | C1 | N9 | HN9 | 122.9° | 120.1° |
| HC12 | C1 | C2 | C3 | 30.5° | 60.0° |
| HC12 | C1 | C2 | C7 | 166.8° | 180.0° |
| HC12 | C1 | C2 | HC2 | 71.5° | 60.0° |
| HC12 | C1 | N9 | HN9 | 127.6° | 119.9° |
| C3 | C2 | C7 | HC2 | 104.7° | 120.0° |
| C2 | C3 | C4 | HC31 | 125.3° | 120.0° |
| C2 | C3 | C4 | HC32 | 125.3° | 120.0° |
| C2 | C3 | HC31 | HC32 | 117.0° | 120.1° |
| C2 | C3 | C4 | C5 | 63.3° | 60.0° |
| C2 | C3 | C4 | HC41 | 171.5° | 180.0° |
| C2 | C3 | C4 | HC42 | 62.0° | 60.0° |
| C3 | C2 | C7 | C6 | 24.8° | 60.0° |
| C3 | C2 | C7 | HC71 | 150.0° | 60.1° |
| C3 | C2 | C7 | HC72 | 100.5° | 180.0° |
| C7 | C2 | C3 | C4 | 40.1° | 60.0° |
| C7 | C2 | C3 | HC31 | 85.2° | 60.0° |
| C7 | C2 | C3 | HC32 | 165.3° | 180.0° |
| C2 | C7 | C6 | C5 | 37.6° | 60.0° |
| C2 | C7 | C6 | HC71 | 125.2° | 120.0° |
| C2 | C7 | C6 | HC72 | 125.2° | 120.0° |
| C2 | C7 | C6 | HC61 | 162.9° | 60.0° |
| C2 | C7 | C6 | HC62 | 87.6° | 180.0° |
| C2 | C7 | HC71 | HC72 | 116.7° | 120.0° |
| HC2 | C2 | C3 | C4 | 78.4° | 60.0° |
| HC2 | C2 | C3 | HC31 | 156.3° | 180.0° |
| HC2 | C2 | C3 | HC32 | 46.8° | 60.0° |
| HC2 | C2 | C7 | C6 | 79.9° | 60.0° |
| HC2 | C2 | C7 | HC71 | 45.3° | 180.0° |
| HC2 | C2 | C7 | HC72 | 154.8° | 60.1° |
| C4 | C3 | HC31 | HC32 | 116.9° | 119.9° |
| C3 | C4 | C5 | HC41 | 125.3° | 120.0° |
| C3 | C4 | C5 | HC42 | 125.3° | 119.9° |
| C3 | C4 | HC41 | HC42 | 117.7° | 120.0° |
| C3 | C4 | C5 | C6 | 64.5° | 60.0° |
| C3 | C4 | C5 | C8 | 170.9° | 180.0° |
| C3 | C4 | C5 | HC5 | 63.0° | 60.0° |
| HC31 | C3 | C4 | C5 | 62.0° | 60.1° |
| HC31 | C3 | C4 | HC41 | 63.2° | 59.9° |
| HC31 | C3 | C4 | HC42 | 172.7° | 180.0° |
| HC32 | C3 | C4 | C5 | 171.5° | 180.0° |
| HC32 | C3 | C4 | HC41 | 46.2° | 60.0° |
| HC32 | C3 | C4 | HC42 | 63.2° | 60.1° |
| C5 | C4 | HC41 | HC42 | 117.8° | 120.0° |
| C4 | C5 | C6 | C8 | 106.7° | 120.0° |
| C4 | C5 | C6 | HC5 | 127.3° | 120.0° |
| C4 | C5 | C8 | HC5 | 128.5° | 120.0° |
| C4 | C5 | C6 | C7 | 55.0° | 60.0° |
| C4 | C5 | C6 | HC61 | 179.7° | 60.0° |
| C4 | C5 | C6 | HC62 | 70.2° | 180.0° |
| C4 | C5 | C8 | N11 | 103.7° | 150.0° |
| C4 | C5 | C8 | N10 | 84.1° | 30.1° |
| HC41 | C4 | C5 | C6 | 170.2° | 180.0° |
| HC41 | C4 | C5 | C8 | 63.9° | 60.0° |
| HC41 | C4 | C5 | HC5 | 62.3° | 60.0° |
| HC42 | C4 | C5 | C6 | 60.7° | 59.9° |
| HC42 | C4 | C5 | C8 | 45.6° | 60.0° |
| HC42 | C4 | C5 | HC5 | 171.7° | 180.0° |
| C6 | C5 | C8 | HC5 | 128.7° | 120.0° |
| C5 | C6 | C7 | HC61 | 125.3° | 120.0° |
| C5 | C6 | C7 | HC62 | 125.2° | 120.0° |
| C5 | C6 | HC61 | HC62 | 112.3° | 119.9° |
| C5 | C6 | C7 | HC71 | 162.8° | 60.0° |
| C5 | C6 | C7 | HC72 | 87.6° | 179.9° |
| C6 | C5 | C8 | N11 | 0.9° | 90.0° |
| C6 | C5 | C8 | N10 | 173.1° | 89.9° |
| C8 | C5 | C6 | C7 | 161.7° | 180.0° |
| C8 | C5 | C6 | HC61 | 73.0° | 59.9° |
| C8 | C5 | C6 | HC62 | 36.4° | 60.0° |
| C5 | C8 | N11 | N10 | 171.8° | 179.9° |
| C5 | C8 | N11 | H111 | 179.9° | 180.0° |
| C5 | C8 | N11 | H112 | 54.7° | 0.3° |
| C5 | C8 | N10 | HN10 | 32.0° | 0.1° |
| HC5 | C5 | C6 | C7 | 72.2° | 60.0° |
| HC5 | C5 | C6 | HC61 | 53.1° | 179.9° |
| HC5 | C5 | C6 | HC62 | 162.5° | 60.0° |
| HC5 | C5 | C8 | N11 | 127.8° | 30.0° |
| HC5 | C5 | C8 | N10 | 44.4° | 150.1° |
| C7 | C6 | HC61 | HC62 | 112.4° | 120.0° |
| C6 | C7 | HC71 | HC72 | 116.7° | 120.0° |
| HC61 | C6 | C7 | HC71 | 71.9° | 180.0° |
| HC61 | C6 | C7 | HC72 | 37.7° | 60.0° |
| HC62 | C6 | C7 | HC71 | 37.6° | 59.9° |
| HC62 | C6 | C7 | HC72 | 147.1° | 60.0° |
| C8 | N11 | H111 | H112 | 125.3° | 179.7° |
| N11 | C8 | N10 | HN10 | 155.6° | 180.0° |
| N10 | C8 | N11 | H111 | 8.3° | 0.1° |
| N10 | C8 | N11 | H112 | 117.1° | 179.8° |
