O9H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.51Å | |
| C20 | O4 | sing | 1.43Å | 1.42Å | |
| C25 | C24 | sing | 1.38Å | 1.37Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | O4 | sing | 1.43Å | 1.43Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C3 | sing | 1.51Å | 1.50Å | |
| C3 | S1 | sing | 1.77Å | 1.72Å | |
| C3 | C4 | doub | 1.35Å | 1.37Å | |
| S1 | C2 | sing | 1.82Å | 1.73Å | |
| O8 | C45 | doub | 1.21Å | 1.20Å | |
| C4 | C5 | sing | 1.40Å | 1.48Å | |
| C4 | N1 | sing | 1.39Å | 1.39Å | |
| C45 | C46 | sing | 1.51Å | 1.49Å | |
| C45 | O7 | sing | 1.34Å | 1.34Å | |
| C5 | O1 | doub | 1.22Å | 1.23Å | |
| C2 | N1 | sing | 1.47Å | 1.30Å | |
| C2 | C1 | sing | 1.53Å | 1.49Å | |
| C1 | O7 | sing | 1.45Å | 1.46Å | |
| C1 | C27 | sing | 1.53Å | 1.53Å | |
| C41 | N3 | sing | 1.47Å | 1.47Å | |
| N3 | C28 | sing | 1.47Å | 1.49Å | |
| C27 | C28 | sing | 1.53Å | 1.53Å | |
| C28 | C42 | sing | 1.53Å | 1.54Å | |
| C42 | C43 | sing | 1.53Å | 1.52Å | |
| C42 | C44 | sing | 1.53Å | 1.52Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H14 | sing | 1.08Å | 1.08Å | |
| C26 | H15 | sing | 1.08Å | 1.08Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| N3 | H19 | sing | 1.01Å | 1.00Å | |
| N3 | H20 | sing | 1.01Å | 1.00Å | |
| C41 | H21 | sing | 1.09Å | 1.10Å | |
| C41 | H22 | sing | 1.09Å | 1.10Å | |
| C41 | H23 | sing | 1.09Å | 1.10Å | |
| C42 | H24 | sing | 1.09Å | 1.10Å | |
| C43 | H25 | sing | 1.09Å | 1.10Å | |
| C43 | H26 | sing | 1.09Å | 1.10Å | |
| C43 | H27 | sing | 1.09Å | 1.10Å | |
| C44 | H28 | sing | 1.09Å | 1.10Å | |
| C44 | H29 | sing | 1.09Å | 1.10Å | |
| C44 | H30 | sing | 1.09Å | 1.10Å | |
| C46 | H31 | sing | 1.09Å | 1.10Å | |
| C46 | H32 | sing | 1.09Å | 1.10Å | |
| C46 | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C21 | 120.6° | 120.0° |
| C26 | C25 | C24 | 120.2° | 120.0° |
| C26 | C25 | H14 | 119.9° | 120.0° |
| C25 | C26 | H15 | 119.7° | 120.0° |
| C26 | C21 | C20 | 120.8° | 120.0° |
| C26 | C21 | C22 | 118.7° | 120.0° |
| C21 | C26 | H15 | 119.7° | 120.0° |
| C21 | C20 | O4 | 111.0° | 109.5° |
| C20 | C21 | C22 | 120.5° | 120.0° |
| C21 | C20 | H9 | 109.1° | 109.5° |
| C21 | C20 | H10 | 109.1° | 109.4° |
| C20 | O4 | C19 | 113.2° | 114.0° |
| O4 | C20 | H9 | 109.1° | 109.5° |
| O4 | C20 | H10 | 109.1° | 109.5° |
| C25 | C24 | C23 | 119.8° | 120.0° |
| C25 | C24 | H13 | 120.1° | 120.0° |
| C24 | C25 | H14 | 119.9° | 120.0° |
| C21 | C22 | C23 | 120.7° | 120.0° |
| C21 | C22 | H11 | 119.7° | 120.0° |
| O4 | C19 | C18 | 109.7° | 109.5° |
| O4 | C19 | H7 | 109.4° | 109.5° |
| O4 | C19 | H8 | 109.4° | 109.5° |
| C19 | C18 | C3 | 113.0° | 109.5° |
| C19 | C18 | H5 | 108.6° | 109.5° |
| C19 | C18 | H6 | 108.6° | 109.4° |
| C18 | C19 | H7 | 109.4° | 109.5° |
| C18 | C19 | H8 | 109.4° | 109.4° |
| C24 | C23 | C22 | 120.1° | 120.0° |
| C24 | C23 | H12 | 119.9° | 120.0° |
| C23 | C24 | H13 | 120.1° | 120.0° |
| C23 | C22 | H11 | 119.7° | 120.0° |
| C22 | C23 | H12 | 120.0° | 119.9° |
| C18 | C3 | S1 | 118.1° | 126.2° |
| C18 | C3 | C4 | 130.0° | 126.2° |
| C3 | C18 | H5 | 108.6° | 109.5° |
| C3 | C18 | H6 | 108.6° | 109.5° |
| S1 | C3 | C4 | 111.9° | 107.6° |
| C3 | S1 | C2 | 87.8° | 95.0° |
| C3 | C4 | C5 | 129.6° | 120.4° |
| C3 | C4 | N1 | 112.1° | 119.2° |
| S1 | C2 | N1 | 115.3° | 104.1° |
| S1 | C2 | C1 | 121.9° | 110.5° |
| S1 | C2 | H4 | 90.2° | 110.6° |
| O8 | C45 | C46 | 125.6° | 120.0° |
| O8 | C45 | O7 | 123.7° | 120.0° |
| C5 | C4 | N1 | 118.3° | 120.4° |
| C4 | C5 | O1 | 119.6° | 120.0° |
| C4 | C5 | H2 | 120.2° | 120.0° |
| C4 | N1 | C2 | 110.9° | 114.1° |
| C4 | N1 | H1 | 109.1° | 123.0° |
| C46 | C45 | O7 | 110.7° | 120.0° |
| C45 | C46 | H31 | 109.5° | 109.4° |
| C45 | C46 | H32 | 109.4° | 109.5° |
| C45 | C46 | H33 | 109.5° | 109.5° |
| C45 | O7 | C1 | 119.2° | 117.0° |
| O1 | C5 | H2 | 120.2° | 120.0° |
| N1 | C2 | C1 | 122.7° | 110.5° |
| C2 | N1 | H1 | 109.1° | 122.9° |
| N1 | C2 | H4 | 90.3° | 110.5° |
| C2 | C1 | O7 | 109.6° | 109.4° |
| C2 | C1 | C27 | 110.2° | 109.5° |
| C2 | C1 | H3 | 109.6° | 109.5° |
| C1 | C2 | H4 | 90.2° | 110.4° |
| O7 | C1 | C27 | 108.3° | 109.5° |
| O7 | C1 | H3 | 110.1° | 109.4° |
| C1 | C27 | C28 | 113.6° | 109.5° |
| C27 | C1 | H3 | 109.1° | 109.5° |
| C1 | C27 | H16 | 108.4° | 109.5° |
| C1 | C27 | H17 | 108.4° | 109.5° |
| C41 | N3 | C28 | 117.1° | 109.5° |
| C41 | N3 | H19 | 107.5° | 109.5° |
| C41 | N3 | H20 | 107.5° | 109.5° |
| N3 | C41 | H21 | 109.5° | 109.4° |
| N3 | C41 | H22 | 109.5° | 109.5° |
| N3 | C41 | H23 | 109.4° | 109.5° |
| N3 | C28 | C27 | 110.5° | 109.5° |
| N3 | C28 | C42 | 111.1° | 109.5° |
| N3 | C28 | H18 | 107.1° | 109.4° |
| C28 | N3 | H19 | 107.5° | 109.5° |
| C28 | N3 | H20 | 107.5° | 109.4° |
| C27 | C28 | C42 | 114.6° | 109.5° |
| C28 | C27 | H16 | 108.5° | 109.4° |
| C28 | C27 | H17 | 108.4° | 109.4° |
| C27 | C28 | H18 | 106.6° | 109.4° |
| C28 | C42 | C43 | 111.3° | 109.4° |
| C28 | C42 | C44 | 112.4° | 109.5° |
| C42 | C28 | H18 | 106.6° | 109.5° |
| C28 | C42 | H24 | 107.4° | 109.5° |
| C43 | C42 | C44 | 110.3° | 109.5° |
| C43 | C42 | H24 | 107.6° | 109.5° |
| C42 | C43 | H25 | 109.5° | 109.5° |
| C42 | C43 | H26 | 109.5° | 109.5° |
| C42 | C43 | H27 | 109.5° | 109.5° |
| C44 | C42 | H24 | 107.6° | 109.5° |
| C42 | C44 | H28 | 109.5° | 109.5° |
| C42 | C44 | H29 | 109.5° | 109.5° |
| C42 | C44 | H30 | 109.5° | 109.5° |
| H5 | C18 | H6 | 109.5° | 109.4° |
| H7 | C19 | H8 | 109.5° | 109.4° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.4° | 109.5° |
| H19 | N3 | H20 | 109.5° | 109.4° |
| H21 | C41 | H22 | 109.5° | 109.5° |
| H21 | C41 | H23 | 109.4° | 109.5° |
| H22 | C41 | H23 | 109.5° | 109.5° |
| H25 | C43 | H26 | 109.5° | 109.5° |
| H25 | C43 | H27 | 109.4° | 109.5° |
| H26 | C43 | H27 | 109.5° | 109.4° |
| H28 | C44 | H29 | 109.5° | 109.4° |
| H28 | C44 | H30 | 109.5° | 109.4° |
| H29 | C44 | H30 | 109.5° | 109.5° |
| H31 | C46 | H32 | 109.5° | 109.5° |
| H31 | C46 | H33 | 109.5° | 109.4° |
| H32 | C46 | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C21 | H15 | 180.0° | 179.5° |
| C25 | C26 | C21 | C20 | 180.0° | 179.7° |
| C26 | C25 | C24 | H14 | 180.0° | 179.8° |
| C25 | C26 | C21 | C22 | 0.1° | 0.5° |
| C26 | C25 | C24 | C23 | 0.0° | 0.2° |
| C26 | C25 | C24 | H13 | 180.0° | 179.8° |
| C26 | C21 | C20 | C22 | 179.9° | 179.8° |
| C26 | C21 | C20 | O4 | 113.2° | 90.3° |
| C21 | C26 | C25 | C24 | 0.0° | 0.5° |
| C26 | C21 | C22 | C23 | 0.1° | 0.3° |
| C26 | C21 | C20 | H9 | 7.0° | 149.7° |
| C26 | C21 | C20 | H10 | 126.6° | 29.7° |
| C26 | C21 | C22 | H11 | 179.9° | 179.7° |
| C21 | C26 | C25 | H14 | 180.0° | 179.7° |
| C21 | C20 | O4 | H9 | 120.2° | 120.0° |
| C21 | C20 | O4 | H10 | 120.2° | 120.0° |
| C21 | C20 | O4 | C19 | 79.1° | 180.0° |
| C20 | C21 | C22 | C23 | 180.0° | 180.0° |
| C21 | C20 | H9 | H10 | 119.3° | 120.0° |
| C20 | C21 | C22 | H11 | 0.0° | 0.0° |
| C20 | C21 | C26 | H15 | 0.0° | 0.3° |
| O4 | C20 | C21 | C22 | 66.8° | 90.0° |
| C20 | O4 | C19 | C18 | 166.4° | 180.0° |
| C20 | O4 | C19 | H7 | 46.4° | 60.0° |
| C20 | O4 | C19 | H8 | 73.5° | 60.0° |
| O4 | C20 | H9 | H10 | 119.3° | 120.0° |
| C25 | C24 | C23 | H13 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 0.0° | 0.0° |
| C25 | C24 | C23 | H12 | 179.9° | 179.9° |
| C24 | C25 | C26 | H15 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C21 | C22 | C23 | H11 | 180.0° | 180.0° |
| C22 | C21 | C20 | H9 | 173.0° | 30.0° |
| C22 | C21 | C20 | H10 | 53.5° | 150.0° |
| C21 | C22 | C23 | H12 | 179.9° | 180.0° |
| C22 | C21 | C26 | H15 | 179.9° | 180.0° |
| O4 | C19 | C18 | H7 | 120.0° | 120.1° |
| O4 | C19 | C18 | H8 | 120.0° | 120.0° |
| O4 | C19 | C18 | C3 | 78.2° | 180.0° |
| O4 | C19 | C18 | H5 | 161.3° | 59.9° |
| O4 | C19 | C18 | H6 | 42.3° | 60.0° |
| O4 | C19 | H7 | H8 | 119.9° | 120.0° |
| C19 | O4 | C20 | H9 | 41.2° | 60.0° |
| C19 | O4 | C20 | H10 | 160.7° | 60.0° |
| C19 | C18 | C3 | H5 | 120.5° | 120.0° |
| C19 | C18 | C3 | H6 | 120.5° | 120.0° |
| C19 | C18 | C3 | S1 | 87.4° | 85.0° |
| C19 | C18 | C3 | C4 | 92.9° | 95.2° |
| C19 | C18 | H5 | H6 | 118.4° | 119.9° |
| C18 | C19 | H7 | H8 | 119.9° | 119.9° |
| C24 | C23 | C22 | H12 | 180.0° | 180.0° |
| C24 | C23 | C22 | H11 | 180.0° | 180.0° |
| C23 | C24 | C25 | H14 | 180.0° | 180.0° |
| C22 | C23 | C24 | H13 | 179.9° | 180.0° |
| C18 | C3 | S1 | C4 | 179.7° | 179.8° |
| C18 | C3 | S1 | C2 | 179.5° | 180.0° |
| C18 | C3 | C4 | C5 | 6.7° | 0.2° |
| C18 | C3 | C4 | N1 | 171.5° | 179.8° |
| C3 | C18 | H5 | H6 | 118.4° | 120.0° |
| C3 | C18 | C19 | H7 | 41.8° | 59.9° |
| C3 | C18 | C19 | H8 | 161.7° | 60.0° |
| S1 | C3 | C4 | C5 | 173.6° | 180.0° |
| S1 | C3 | C4 | N1 | 8.2° | 0.4° |
| C3 | S1 | C2 | N1 | 8.6° | 0.0° |
| C3 | S1 | C2 | C1 | 172.1° | 118.7° |
| C3 | S1 | C2 | H4 | 81.8° | 118.7° |
| S1 | C3 | C18 | H5 | 33.1° | 35.0° |
| S1 | C3 | C18 | H6 | 152.1° | 155.0° |
| C4 | C3 | S1 | C2 | 0.2° | 0.2° |
| C3 | C4 | C5 | N1 | 178.1° | 179.5° |
| C3 | C4 | C5 | O1 | 150.7° | 180.0° |
| C3 | C4 | N1 | C2 | 14.5° | 0.4° |
| C3 | C4 | N1 | H1 | 105.7° | 179.7° |
| C3 | C4 | C5 | H2 | 29.3° | 0.0° |
| C4 | C3 | C18 | H5 | 146.6° | 144.7° |
| C4 | C3 | C18 | H6 | 27.6° | 24.7° |
| S1 | C2 | N1 | C4 | 14.7° | 0.2° |
| S1 | C2 | N1 | C1 | 179.3° | 118.7° |
| S1 | C2 | N1 | H4 | 90.3° | 118.8° |
| S1 | C2 | C1 | H4 | 90.3° | 122.7° |
| S1 | C2 | C1 | O7 | 116.6° | 54.7° |
| S1 | C2 | C1 | C27 | 124.3° | 65.3° |
| S1 | C2 | N1 | H1 | 105.5° | 179.9° |
| S1 | C2 | C1 | H3 | 4.3° | 174.6° |
| O8 | C45 | C46 | O7 | 179.7° | 180.0° |
| O8 | C45 | O7 | C1 | 8.5° | 0.0° |
| O8 | C45 | C46 | H31 | 0.0° | 90.0° |
| O8 | C45 | C46 | H32 | 120.0° | 30.0° |
| O8 | C45 | C46 | H33 | 120.0° | 150.0° |
| C4 | C5 | O1 | H2 | 180.0° | 179.9° |
| C5 | C4 | N1 | C2 | 167.1° | 180.0° |
| C5 | C4 | N1 | H1 | 72.7° | 0.2° |
| N1 | C4 | C5 | O1 | 27.3° | 0.5° |
| C4 | N1 | C2 | H1 | 120.2° | 179.8° |
| C4 | N1 | C2 | C1 | 166.0° | 118.9° |
| N1 | C4 | C5 | H2 | 152.7° | 179.6° |
| C4 | N1 | C2 | H4 | 75.6° | 118.6° |
| C46 | C45 | O7 | C1 | 171.7° | 180.0° |
| C45 | C46 | H31 | H32 | 120.0° | 120.0° |
| C45 | C46 | H31 | H33 | 120.0° | 120.0° |
| C45 | C46 | H32 | H33 | 120.0° | 120.1° |
| C45 | O7 | C1 | C2 | 78.3° | 150.0° |
| C45 | O7 | C1 | C27 | 161.5° | 90.0° |
| C45 | O7 | C1 | H3 | 42.3° | 30.0° |
| O7 | C45 | C46 | H31 | 179.7° | 90.0° |
| O7 | C45 | C46 | H32 | 60.3° | 150.0° |
| O7 | C45 | C46 | H33 | 59.7° | 29.9° |
| N1 | C2 | C1 | H4 | 90.4° | 122.6° |
| N1 | C2 | C1 | O7 | 64.1° | 60.0° |
| N1 | C2 | C1 | C27 | 54.9° | 180.0° |
| N1 | C2 | C1 | H3 | 175.0° | 60.0° |
| C2 | C1 | O7 | C27 | 120.2° | 120.0° |
| C2 | C1 | O7 | H3 | 120.6° | 120.0° |
| C2 | C1 | C27 | H3 | 120.3° | 120.0° |
| C2 | C1 | C27 | C28 | 158.5° | 175.0° |
| C1 | C2 | N1 | H1 | 73.8° | 61.3° |
| C2 | C1 | C27 | H16 | 37.8° | 55.1° |
| C2 | C1 | C27 | H17 | 80.9° | 65.0° |
| O7 | C1 | C27 | H3 | 119.8° | 120.0° |
| O7 | C1 | C27 | C28 | 81.7° | 65.0° |
| O7 | C1 | C2 | H4 | 26.3° | 177.4° |
| O7 | C1 | C27 | H16 | 157.7° | 175.0° |
| O7 | C1 | C27 | H17 | 39.0° | 55.0° |
| C1 | C27 | C28 | N3 | 44.2° | 65.0° |
| C1 | C27 | C28 | H16 | 120.6° | 120.0° |
| C1 | C27 | C28 | H17 | 120.6° | 120.0° |
| C1 | C27 | C28 | C42 | 170.6° | 175.0° |
| C27 | C1 | C2 | H4 | 145.3° | 57.4° |
| C1 | C27 | H16 | H17 | 118.1° | 120.1° |
| C1 | C27 | C28 | H18 | 71.8° | 55.0° |
| C41 | N3 | C28 | H19 | 121.1° | 120.0° |
| C41 | N3 | C28 | H20 | 121.1° | 120.0° |
| C41 | N3 | C28 | C27 | 61.2° | 173.9° |
| C41 | N3 | C28 | C42 | 67.1° | 66.1° |
| C41 | N3 | C28 | H18 | 176.9° | 53.9° |
| C41 | N3 | H19 | H20 | 116.5° | 120.0° |
| N3 | C41 | H21 | H22 | 120.0° | 120.0° |
| N3 | C41 | H21 | H23 | 120.0° | 120.0° |
| N3 | C41 | H22 | H23 | 120.0° | 120.0° |
| N3 | C28 | C27 | C42 | 126.4° | 120.0° |
| N3 | C28 | C27 | H18 | 116.0° | 120.0° |
| N3 | C28 | C42 | H18 | 116.3° | 120.0° |
| N3 | C28 | C42 | C43 | 77.1° | 65.7° |
| N3 | C28 | C42 | C44 | 158.6° | 174.2° |
| N3 | C28 | C27 | H16 | 76.4° | 55.0° |
| N3 | C28 | C27 | H17 | 164.8° | 175.0° |
| C28 | N3 | H19 | H20 | 116.5° | 119.9° |
| C28 | N3 | C41 | H21 | 180.0° | 179.2° |
| C28 | N3 | C41 | H22 | 60.0° | 59.2° |
| C28 | N3 | C41 | H23 | 60.0° | 60.8° |
| N3 | C28 | C42 | H24 | 40.4° | 54.2° |
| C27 | C28 | C42 | H18 | 117.6° | 120.0° |
| C27 | C28 | C42 | C43 | 156.9° | 54.3° |
| C27 | C28 | C42 | C44 | 32.5° | 65.7° |
| C28 | C27 | C1 | H3 | 38.2° | 55.0° |
| C28 | C27 | H16 | H17 | 118.1° | 119.9° |
| C27 | C28 | N3 | H19 | 60.0° | 53.8° |
| C27 | C28 | N3 | H20 | 177.8° | 66.1° |
| C27 | C28 | C42 | H24 | 85.6° | 174.3° |
| C28 | C42 | C43 | C44 | 125.5° | 120.0° |
| C28 | C42 | C43 | H24 | 117.4° | 120.0° |
| C28 | C42 | C44 | H24 | 118.0° | 120.0° |
| C42 | C28 | C27 | H16 | 49.9° | 65.0° |
| C42 | C28 | C27 | H17 | 68.8° | 54.9° |
| C42 | C28 | N3 | H19 | 171.8° | 173.9° |
| C42 | C28 | N3 | H20 | 54.0° | 53.9° |
| C28 | C42 | C43 | H25 | 180.0° | 180.0° |
| C28 | C42 | C43 | H26 | 60.0° | 60.0° |
| C28 | C42 | C43 | H27 | 60.0° | 60.0° |
| C28 | C42 | C44 | H28 | 180.0° | 53.3° |
| C28 | C42 | C44 | H29 | 60.0° | 173.3° |
| C28 | C42 | C44 | H30 | 60.0° | 66.7° |
| C43 | C42 | C44 | H24 | 117.1° | 120.0° |
| C43 | C42 | C28 | H18 | 39.2° | 174.3° |
| C42 | C43 | H25 | H26 | 120.0° | 120.0° |
| C42 | C43 | H25 | H27 | 120.0° | 120.0° |
| C42 | C43 | H26 | H27 | 120.0° | 120.0° |
| C43 | C42 | C44 | H28 | 55.1° | 173.2° |
| C43 | C42 | C44 | H29 | 175.1° | 66.8° |
| C43 | C42 | C44 | H30 | 64.9° | 53.3° |
| C44 | C42 | C28 | H18 | 85.1° | 54.3° |
| C44 | C42 | C43 | H25 | 54.5° | 60.0° |
| C44 | C42 | C43 | H26 | 65.5° | 180.0° |
| C44 | C42 | C43 | H27 | 174.4° | 60.0° |
| C42 | C44 | H28 | H29 | 120.0° | 120.0° |
| C42 | C44 | H28 | H30 | 120.0° | 120.0° |
| C42 | C44 | H29 | H30 | 120.0° | 120.0° |
| H1 | N1 | C2 | H4 | 164.2° | 61.2° |
| H3 | C1 | C2 | H4 | 94.6° | 62.6° |
| H3 | C1 | C27 | H16 | 82.5° | 65.0° |
| H3 | C1 | C27 | H17 | 158.8° | 175.0° |
| H5 | C18 | C19 | H7 | 78.7° | 180.0° |
| H5 | C18 | C19 | H8 | 41.2° | 60.1° |
| H6 | C18 | C19 | H7 | 162.3° | 60.1° |
| H6 | C18 | C19 | H8 | 77.8° | 180.0° |
| H11 | C22 | C23 | H12 | 0.1° | 0.0° |
| H12 | C23 | C24 | H13 | 0.1° | 0.0° |
| H13 | C24 | C25 | H14 | 0.1° | 0.1° |
| H14 | C25 | C26 | H15 | 0.0° | 0.2° |
| H16 | C27 | C28 | H18 | 167.6° | 175.0° |
| H17 | C27 | C28 | H18 | 48.8° | 65.1° |
| H18 | C28 | N3 | H19 | 55.8° | 66.1° |
| H18 | C28 | N3 | H20 | 62.0° | 173.9° |
| H18 | C28 | C42 | H24 | 156.8° | 65.7° |
| H19 | N3 | C41 | H21 | 58.9° | 60.8° |
| H19 | N3 | C41 | H22 | 61.1° | 179.2° |
| H19 | N3 | C41 | H23 | 178.9° | 59.2° |
| H20 | N3 | C41 | H21 | 58.9° | 59.2° |
| H20 | N3 | C41 | H22 | 178.9° | 60.8° |
| H20 | N3 | C41 | H23 | 61.1° | 179.2° |
| H21 | C41 | H22 | H23 | 120.0° | 120.0° |
| H24 | C42 | C43 | H25 | 62.6° | 60.0° |
| H24 | C42 | C43 | H26 | 177.4° | 60.0° |
| H24 | C42 | C43 | H27 | 57.4° | 179.9° |
| H24 | C42 | C44 | H28 | 62.0° | 66.8° |
| H24 | C42 | C44 | H29 | 58.1° | 53.2° |
| H24 | C42 | C44 | H30 | 178.0° | 173.3° |
| H25 | C43 | H26 | H27 | 120.0° | 120.0° |
| H28 | C44 | H29 | H30 | 120.0° | 119.9° |
| H31 | C46 | H32 | H33 | 120.0° | 119.9° |
