A1AH6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | O | sing | 1.43Å | 1.43Å | |
| O | C3 | sing | 1.36Å | 1.37Å | |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.48Å | 1.47Å | |
| N | C6 | sing | 1.34Å | 1.36Å | |
| C7 | N | sing | 1.46Å | 1.46Å | |
| C8 | C7 | sing | 1.53Å | 1.51Å | |
| O1 | C8 | sing | 1.45Å | 1.45Å | |
| C9 | O1 | sing | 1.35Å | 1.33Å | |
| N1 | C9 | sing | 1.35Å | 1.34Å | |
| C10 | N1 | sing | 1.47Å | 1.45Å | |
| C11 | C10 | sing | 1.51Å | 1.51Å | |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.39Å | 1.38Å | Aromatic |
| C16 | C15 | sing | 1.48Å | 1.48Å | |
| C16 | C17 | doub | 1.36Å | 1.37Å | Aromatic |
| C17 | N2 | sing | 1.37Å | 1.37Å | Aromatic |
| N2 | C18 | sing | 1.35Å | 1.33Å | Aromatic |
| C18 | N3 | doub | 1.30Å | 1.33Å | Aromatic |
| N3 | C16 | sing | 1.35Å | 1.38Å | Aromatic |
| C15 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| O2 | C9 | doub | 1.22Å | 1.21Å | |
| C20 | N | sing | 1.47Å | 1.46Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C6 | O3 | doub | 1.22Å | 1.21Å | |
| C5 | C22 | doub | 1.40Å | 1.37Å | Aromatic |
| C22 | C20 | sing | 1.51Å | 1.50Å | |
| C23 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C25 | C1 | sing | 1.51Å | 1.52Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.37Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| N1 | H11 | sing | 0.97Å | 1.00Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | H15 | sing | 1.08Å | 1.08Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.08Å | 1.08Å | |
| C24 | H26 | sing | 1.08Å | 1.08Å | |
| C26 | H27 | sing | 1.08Å | 1.08Å | |
| C27 | H28 | sing | 1.08Å | 1.08Å | |
| C28 | H29 | sing | 1.08Å | 1.08Å | |
| C29 | H30 | sing | 1.08Å | 1.08Å | |
| C30 | H31 | sing | 1.08Å | 1.08Å | |
| N2 | H18 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 110.1° | 109.5° |
| C | C1 | C25 | 112.2° | 109.4° |
| C1 | C | H2 | 109.5° | 109.4° |
| C1 | C | H | 109.5° | 109.5° |
| C1 | C | H1 | 109.5° | 109.5° |
| C | C1 | H3 | 108.0° | 109.5° |
| C1 | C2 | O | 107.2° | 109.5° |
| C2 | C1 | C25 | 110.4° | 109.5° |
| C2 | C1 | H3 | 108.1° | 109.5° |
| C1 | C2 | H4 | 110.0° | 109.4° |
| C1 | C2 | H5 | 110.0° | 109.5° |
| C2 | O | C3 | 118.6° | 117.0° |
| O | C2 | H4 | 110.0° | 109.5° |
| O | C2 | H5 | 110.0° | 109.5° |
| O | C3 | C4 | 117.8° | 119.9° |
| O | C3 | C24 | 121.2° | 119.8° |
| C3 | C4 | C5 | 118.2° | 119.8° |
| C4 | C3 | C24 | 120.9° | 120.2° |
| C3 | C4 | H6 | 120.9° | 120.1° |
| C4 | C5 | C6 | 129.9° | 132.3° |
| C4 | C5 | C22 | 121.3° | 119.4° |
| C5 | C4 | H6 | 120.9° | 120.1° |
| C5 | C6 | N | 106.2° | 110.3° |
| C5 | C6 | O3 | 128.5° | 124.9° |
| C6 | C5 | C22 | 108.8° | 108.3° |
| C6 | N | C7 | 125.7° | 125.6° |
| C6 | N | C20 | 113.4° | 108.7° |
| N | C6 | O3 | 125.2° | 124.8° |
| N | C7 | C8 | 111.7° | 109.5° |
| C7 | N | C20 | 120.9° | 125.6° |
| N | C7 | H8 | 108.9° | 109.5° |
| N | C7 | H7 | 108.9° | 109.5° |
| C7 | C8 | O1 | 105.4° | 109.5° |
| C7 | C8 | H9 | 110.5° | 109.4° |
| C7 | C8 | H10 | 110.5° | 109.5° |
| C8 | C7 | H8 | 108.9° | 109.5° |
| C8 | C7 | H7 | 108.9° | 109.4° |
| C8 | O1 | C9 | 117.2° | 117.0° |
| O1 | C8 | H9 | 110.5° | 109.5° |
| O1 | C8 | H10 | 110.5° | 109.5° |
| O1 | C9 | N1 | 109.9° | 120.0° |
| O1 | C9 | O2 | 124.7° | 120.0° |
| C9 | N1 | C10 | 121.7° | 120.0° |
| N1 | C9 | O2 | 125.4° | 120.0° |
| C9 | N1 | H11 | 119.2° | 120.0° |
| N1 | C10 | C11 | 113.6° | 109.5° |
| C10 | N1 | H11 | 119.1° | 120.0° |
| N1 | C10 | H13 | 108.4° | 109.4° |
| N1 | C10 | H12 | 108.4° | 109.5° |
| C10 | C11 | C12 | 122.0° | 119.9° |
| C10 | C11 | C19 | 118.9° | 119.9° |
| C11 | C10 | H13 | 108.4° | 109.5° |
| C11 | C10 | H12 | 108.4° | 109.5° |
| C11 | C12 | C13 | 120.5° | 120.2° |
| C12 | C11 | C19 | 118.9° | 120.1° |
| C11 | C12 | H14 | 119.8° | 119.9° |
| C12 | C13 | C14 | 120.1° | 120.1° |
| C13 | C12 | H14 | 119.7° | 119.9° |
| C12 | C13 | H15 | 120.0° | 119.9° |
| C13 | C14 | C15 | 120.2° | 119.9° |
| C14 | C13 | H15 | 120.0° | 120.0° |
| C13 | C14 | H16 | 119.9° | 120.0° |
| C14 | C15 | C16 | 120.6° | 120.1° |
| C14 | C15 | C19 | 119.4° | 119.8° |
| C15 | C14 | H16 | 119.9° | 120.1° |
| C15 | C16 | C17 | 128.6° | 126.1° |
| C15 | C16 | N3 | 121.3° | 126.1° |
| C16 | C15 | C19 | 119.9° | 120.1° |
| C16 | C17 | N2 | 106.0° | 106.7° |
| C17 | C16 | N3 | 110.0° | 107.7° |
| C16 | C17 | H17 | 127.0° | 126.7° |
| C17 | N2 | C18 | 107.3° | 107.4° |
| N2 | C17 | H17 | 127.0° | 126.6° |
| C17 | N2 | H18 | 126.4° | 126.3° |
| N2 | C18 | N3 | 112.5° | 109.0° |
| N2 | C18 | H19 | 123.8° | 125.5° |
| C18 | N2 | H18 | 126.3° | 126.3° |
| C18 | N3 | C16 | 104.2° | 109.1° |
| N3 | C18 | H19 | 123.8° | 125.5° |
| C15 | C19 | C11 | 120.9° | 119.9° |
| C15 | C19 | H20 | 119.5° | 120.1° |
| C11 | C19 | H20 | 119.6° | 120.0° |
| N | C20 | C21 | 112.9° | 110.1° |
| N | C20 | C22 | 101.7° | 106.3° |
| N | C20 | H21 | 110.6° | 110.1° |
| C21 | C20 | C22 | 111.5° | 110.2° |
| C21 | C20 | H21 | 109.8° | 110.1° |
| C20 | C21 | H24 | 109.5° | 109.5° |
| C20 | C21 | H23 | 109.5° | 109.5° |
| C20 | C21 | H22 | 109.5° | 109.5° |
| C5 | C22 | C20 | 109.9° | 106.4° |
| C5 | C22 | C23 | 120.2° | 120.4° |
| C20 | C22 | C23 | 129.9° | 133.2° |
| C22 | C20 | H21 | 110.1° | 110.1° |
| C22 | C23 | C24 | 119.5° | 120.0° |
| C22 | C23 | H25 | 120.3° | 120.0° |
| C23 | C24 | C3 | 120.0° | 120.1° |
| C24 | C23 | H25 | 120.2° | 120.0° |
| C23 | C24 | H26 | 120.0° | 119.9° |
| C3 | C24 | H26 | 120.0° | 120.0° |
| C1 | C25 | C26 | 120.7° | 120.0° |
| C1 | C25 | C30 | 121.0° | 120.0° |
| C25 | C1 | H3 | 108.0° | 109.4° |
| C25 | C26 | C27 | 120.6° | 120.0° |
| C26 | C25 | C30 | 118.3° | 120.1° |
| C25 | C26 | H27 | 119.7° | 120.0° |
| C26 | C27 | C28 | 120.4° | 120.0° |
| C27 | C26 | H27 | 119.7° | 120.0° |
| C26 | C27 | H28 | 119.8° | 120.0° |
| C27 | C28 | C29 | 119.7° | 120.0° |
| C28 | C27 | H28 | 119.8° | 120.0° |
| C27 | C28 | H29 | 120.2° | 120.0° |
| C28 | C29 | C30 | 120.2° | 120.0° |
| C29 | C28 | H29 | 120.2° | 120.0° |
| C28 | C29 | H30 | 119.9° | 120.0° |
| C29 | C30 | C25 | 120.9° | 120.0° |
| C30 | C29 | H30 | 119.9° | 120.0° |
| C29 | C30 | H31 | 119.6° | 120.0° |
| C25 | C30 | H31 | 119.6° | 120.0° |
| H2 | C | H | 109.5° | 109.4° |
| H2 | C | H1 | 109.5° | 109.5° |
| H | C | H1 | 109.5° | 109.5° |
| H4 | C2 | H5 | 109.5° | 109.4° |
| H9 | C8 | H10 | 109.5° | 109.4° |
| H8 | C7 | H7 | 109.5° | 109.4° |
| H13 | C10 | H12 | 109.5° | 109.5° |
| H24 | C21 | H23 | 109.5° | 109.5° |
| H24 | C21 | H22 | 109.5° | 109.5° |
| H23 | C21 | H22 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | C25 | 124.4° | 120.0° |
| C | C1 | C2 | H3 | 117.7° | 120.0° |
| C | C1 | C2 | O | 156.8° | 65.0° |
| C | C1 | C25 | H3 | 118.9° | 120.0° |
| C | C1 | C25 | C26 | 121.6° | 120.0° |
| C | C1 | C25 | C30 | 60.0° | 60.4° |
| C1 | C | H2 | H | 120.0° | 120.0° |
| C1 | C | H2 | H1 | 120.0° | 120.0° |
| C1 | C | H | H1 | 120.0° | 120.0° |
| C | C1 | C2 | H4 | 37.2° | 55.1° |
| C | C1 | C2 | H5 | 83.5° | 175.0° |
| C1 | C2 | O | H4 | 119.6° | 120.0° |
| C1 | C2 | O | H5 | 119.6° | 120.0° |
| C1 | C2 | O | C3 | 170.4° | 180.0° |
| C2 | C1 | C25 | H3 | 118.0° | 120.0° |
| C2 | C1 | C25 | C26 | 115.3° | 119.9° |
| C2 | C1 | C25 | C30 | 63.1° | 59.7° |
| C2 | C1 | C | H2 | 180.0° | 60.0° |
| C2 | C1 | C | H | 60.0° | 179.9° |
| C2 | C1 | C | H1 | 60.0° | 60.0° |
| C1 | C2 | H4 | H5 | 121.0° | 119.9° |
| C2 | O | C3 | C4 | 171.6° | 180.0° |
| C2 | O | C3 | C24 | 5.8° | 0.0° |
| O | C2 | C1 | C25 | 78.8° | 175.0° |
| O | C2 | C1 | H3 | 39.2° | 55.0° |
| O | C2 | H4 | H5 | 121.1° | 120.0° |
| O | C3 | C4 | C24 | 177.4° | 179.9° |
| O | C3 | C4 | C5 | 176.0° | 180.0° |
| O | C3 | C24 | C23 | 176.9° | 179.4° |
| C3 | O | C2 | H4 | 70.0° | 60.0° |
| C3 | O | C2 | H5 | 50.7° | 60.0° |
| O | C3 | C4 | H6 | 4.0° | 0.3° |
| O | C3 | C24 | H26 | 3.0° | 0.0° |
| C3 | C4 | C5 | H6 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 177.2° | 179.7° |
| C3 | C4 | C5 | C22 | 0.5° | 0.3° |
| C4 | C3 | C24 | C23 | 0.4° | 0.5° |
| C4 | C3 | C24 | H26 | 179.7° | 180.0° |
| C4 | C5 | C6 | C22 | 177.9° | 180.0° |
| C4 | C5 | C6 | N | 175.9° | 180.0° |
| C4 | C5 | C6 | O3 | 6.1° | 0.0° |
| C4 | C5 | C22 | C20 | 176.4° | 180.0° |
| C4 | C5 | C22 | C23 | 1.6° | 0.0° |
| C5 | C4 | C3 | C24 | 1.4° | 0.0° |
| C5 | C6 | N | O3 | 178.1° | 180.0° |
| C5 | C6 | N | C7 | 176.4° | 180.0° |
| C5 | C6 | N | C20 | 1.6° | 0.0° |
| C6 | C5 | C22 | C20 | 1.8° | 0.0° |
| C6 | C5 | C22 | C23 | 179.7° | 180.0° |
| C6 | C5 | C4 | H6 | 2.7° | 0.0° |
| C6 | N | C7 | C20 | 177.8° | 179.9° |
| C6 | N | C7 | C8 | 110.1° | 90.0° |
| C6 | N | C20 | C21 | 119.0° | 119.2° |
| N | C6 | C5 | C22 | 2.1° | 0.0° |
| C6 | N | C20 | C22 | 0.6° | 0.1° |
| C6 | N | C7 | H8 | 129.5° | 30.0° |
| C6 | N | C7 | H7 | 10.2° | 150.0° |
| C6 | N | C20 | H21 | 117.5° | 119.2° |
| N | C7 | C8 | H8 | 120.3° | 120.1° |
| N | C7 | C8 | H7 | 120.3° | 120.0° |
| N | C7 | C8 | O1 | 102.5° | 65.0° |
| C7 | N | C20 | C21 | 62.9° | 60.7° |
| C7 | N | C6 | O3 | 5.5° | 0.0° |
| C7 | N | C20 | C22 | 177.5° | 180.0° |
| N | C7 | C8 | H9 | 16.9° | 55.0° |
| N | C7 | C8 | H10 | 138.1° | 175.0° |
| N | C7 | H8 | H7 | 119.0° | 120.0° |
| C7 | N | C20 | H21 | 60.6° | 60.8° |
| C7 | C8 | O1 | H9 | 119.3° | 120.0° |
| C7 | C8 | O1 | H10 | 119.3° | 120.1° |
| C7 | C8 | O1 | C9 | 102.7° | 179.9° |
| C8 | C7 | N | C20 | 67.7° | 90.0° |
| C7 | C8 | H9 | H10 | 121.9° | 120.0° |
| C8 | C7 | H8 | H7 | 119.0° | 119.9° |
| C8 | O1 | C9 | N1 | 160.4° | 180.0° |
| C8 | O1 | C9 | O2 | 19.7° | 0.0° |
| O1 | C8 | H9 | H10 | 121.9° | 120.0° |
| O1 | C8 | C7 | H8 | 137.2° | 175.0° |
| O1 | C8 | C7 | H7 | 17.9° | 55.1° |
| O1 | C9 | N1 | O2 | 180.0° | 179.9° |
| O1 | C9 | N1 | C10 | 148.5° | 180.0° |
| C9 | O1 | C8 | H9 | 16.7° | 60.0° |
| C9 | O1 | C8 | H10 | 138.0° | 60.0° |
| O1 | C9 | N1 | H11 | 31.5° | 0.1° |
| C9 | N1 | C10 | H11 | 180.0° | 179.9° |
| C9 | N1 | C10 | C11 | 166.8° | 180.0° |
| C9 | N1 | C10 | H13 | 72.6° | 60.0° |
| C9 | N1 | C10 | H12 | 46.2° | 60.0° |
| N1 | C10 | C11 | H13 | 120.6° | 120.0° |
| N1 | C10 | C11 | H12 | 120.6° | 120.0° |
| N1 | C10 | C11 | C12 | 15.3° | 90.0° |
| N1 | C10 | C11 | C19 | 159.4° | 90.3° |
| C10 | N1 | C9 | O2 | 31.5° | 0.1° |
| N1 | C10 | H13 | H12 | 118.1° | 120.0° |
| C10 | C11 | C12 | C19 | 174.7° | 179.7° |
| C10 | C11 | C12 | C13 | 173.4° | 180.0° |
| C10 | C11 | C19 | C15 | 173.2° | 179.7° |
| C11 | C10 | N1 | H11 | 13.1° | 0.1° |
| C11 | C10 | H13 | H12 | 118.1° | 120.0° |
| C10 | C11 | C12 | H14 | 6.6° | 0.1° |
| C10 | C11 | C19 | H20 | 6.8° | 0.3° |
| C11 | C12 | C13 | H14 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.3° | 0.0° |
| C12 | C11 | C19 | C15 | 1.7° | 0.6° |
| C12 | C11 | C10 | H13 | 105.3° | 30.0° |
| C12 | C11 | C10 | H12 | 135.9° | 150.0° |
| C11 | C12 | C13 | H15 | 179.7° | 180.0° |
| C12 | C11 | C19 | H20 | 178.3° | 180.0° |
| C12 | C13 | C14 | H15 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 0.3° | 0.0° |
| C13 | C12 | C11 | C19 | 1.3° | 0.3° |
| C12 | C13 | C14 | H16 | 179.7° | 180.0° |
| C13 | C14 | C15 | H16 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 178.9° | 180.0° |
| C13 | C14 | C15 | C19 | 0.0° | 0.3° |
| C14 | C13 | C12 | H14 | 179.7° | 179.9° |
| C14 | C15 | C16 | C19 | 178.9° | 179.8° |
| C14 | C15 | C16 | C17 | 35.2° | 5.0° |
| C14 | C15 | C16 | N3 | 147.3° | 175.0° |
| C14 | C15 | C19 | C11 | 1.1° | 0.5° |
| C15 | C14 | C13 | H15 | 179.7° | 180.0° |
| C14 | C15 | C19 | H20 | 178.9° | 180.0° |
| C15 | C16 | C17 | N3 | 177.7° | 180.0° |
| C15 | C16 | C17 | N2 | 177.3° | 180.0° |
| C15 | C16 | N3 | C18 | 177.7° | 180.0° |
| C16 | C15 | C19 | C11 | 177.9° | 179.7° |
| C16 | C15 | C14 | H16 | 1.1° | 0.0° |
| C15 | C16 | C17 | H17 | 2.6° | 0.1° |
| C16 | C15 | C19 | H20 | 2.2° | 0.3° |
| C16 | C17 | N2 | H17 | 180.0° | 180.0° |
| C16 | C17 | N2 | C18 | 0.4° | 0.0° |
| C17 | C16 | N3 | C18 | 0.2° | 0.0° |
| C17 | C16 | C15 | C19 | 143.7° | 174.7° |
| C16 | C17 | N2 | H18 | 179.6° | 179.9° |
| C17 | N2 | C18 | H18 | 180.0° | 179.9° |
| C17 | N2 | C18 | N3 | 0.3° | 0.0° |
| N2 | C17 | C16 | N3 | 0.4° | 0.0° |
| C17 | N2 | C18 | H19 | 179.7° | 180.0° |
| N2 | C18 | N3 | H19 | 180.0° | 180.0° |
| N2 | C18 | N3 | C16 | 0.1° | 0.0° |
| C18 | N2 | C17 | H17 | 179.6° | 180.0° |
| N3 | C18 | N2 | H18 | 179.6° | 179.9° |
| N3 | C16 | C15 | C19 | 33.8° | 5.2° |
| N3 | C16 | C17 | H17 | 179.6° | 180.0° |
| C16 | N3 | C18 | H19 | 179.9° | 180.0° |
| C15 | C19 | C11 | H20 | 180.0° | 179.4° |
| C19 | C15 | C14 | H16 | 179.9° | 179.7° |
| C19 | C11 | C10 | H13 | 79.9° | 149.7° |
| C19 | C11 | C10 | H12 | 38.8° | 29.7° |
| C19 | C11 | C12 | H14 | 178.7° | 179.8° |
| O2 | C9 | N1 | H11 | 148.5° | 180.0° |
| N | C20 | C21 | C22 | 113.7° | 116.9° |
| N | C20 | C21 | H21 | 123.9° | 121.5° |
| C20 | N | C6 | O3 | 176.6° | 180.0° |
| N | C20 | C22 | C5 | 0.8° | 0.1° |
| N | C20 | C22 | H21 | 117.3° | 119.1° |
| N | C20 | C22 | C23 | 178.5° | 179.9° |
| C20 | N | C7 | H8 | 52.6° | 149.9° |
| C20 | N | C7 | H7 | 171.9° | 30.0° |
| N | C20 | C21 | H24 | 180.0° | 60.0° |
| N | C20 | C21 | H23 | 60.0° | 180.0° |
| N | C20 | C21 | H22 | 60.0° | 60.0° |
| C21 | C20 | C22 | C5 | 121.4° | 119.2° |
| C21 | C20 | C22 | H21 | 122.2° | 121.6° |
| C21 | C20 | C22 | C23 | 61.0° | 60.8° |
| C20 | C21 | H24 | H23 | 120.0° | 120.0° |
| C20 | C21 | H24 | H22 | 120.0° | 120.0° |
| C20 | C21 | H23 | H22 | 120.0° | 120.0° |
| O3 | C6 | C5 | C22 | 176.0° | 180.0° |
| C5 | C22 | C20 | C23 | 177.7° | 180.0° |
| C5 | C22 | C23 | C24 | 2.6° | 0.5° |
| C22 | C5 | C4 | H6 | 179.6° | 180.0° |
| C5 | C22 | C20 | H21 | 116.5° | 119.2° |
| C5 | C22 | C23 | H25 | 177.4° | 179.9° |
| C20 | C22 | C23 | C24 | 174.8° | 179.5° |
| C22 | C20 | C21 | H24 | 66.2° | 176.9° |
| C22 | C20 | C21 | H23 | 53.8° | 63.1° |
| C22 | C20 | C21 | H22 | 173.7° | 56.9° |
| C20 | C22 | C23 | H25 | 5.2° | 0.1° |
| C22 | C23 | C24 | H25 | 180.0° | 179.5° |
| C22 | C23 | C24 | C3 | 1.7° | 0.8° |
| C23 | C22 | C20 | H21 | 61.2° | 60.8° |
| C22 | C23 | C24 | H26 | 178.3° | 179.8° |
| C23 | C24 | C3 | H26 | 180.0° | 179.5° |
| C24 | C3 | C4 | H6 | 178.6° | 179.8° |
| C3 | C24 | C23 | H25 | 178.3° | 179.7° |
| C1 | C25 | C26 | C30 | 178.5° | 179.6° |
| C1 | C25 | C26 | C27 | 178.3° | 180.0° |
| C1 | C25 | C30 | C29 | 178.6° | 179.9° |
| C25 | C1 | C | H2 | 56.7° | 179.9° |
| C25 | C1 | C | H | 63.3° | 60.0° |
| C25 | C1 | C | H1 | 176.7° | 60.0° |
| C25 | C1 | C2 | H4 | 161.6° | 64.9° |
| C25 | C1 | C2 | H5 | 40.8° | 55.0° |
| C1 | C25 | C26 | H27 | 1.7° | 0.1° |
| C1 | C25 | C30 | H31 | 1.4° | 0.3° |
| C25 | C26 | C27 | H27 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.3° | 0.1° |
| C26 | C25 | C30 | C29 | 0.1° | 0.5° |
| C26 | C25 | C1 | H3 | 2.7° | 0.1° |
| C25 | C26 | C27 | H28 | 179.7° | 179.9° |
| C26 | C25 | C30 | H31 | 179.9° | 179.9° |
| C26 | C27 | C28 | H28 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.1° | 0.0° |
| C27 | C26 | C25 | C30 | 0.2° | 0.4° |
| C26 | C27 | C28 | H29 | 179.9° | 180.0° |
| C27 | C28 | C29 | H29 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.2° | 0.1° |
| C28 | C27 | C26 | H27 | 179.7° | 180.0° |
| C27 | C28 | C29 | H30 | 179.8° | 180.0° |
| C28 | C29 | C30 | H30 | 180.0° | 179.9° |
| C28 | C29 | C30 | C25 | 0.3° | 0.4° |
| C29 | C28 | C27 | H28 | 179.9° | 179.9° |
| C28 | C29 | C30 | H31 | 179.7° | 180.0° |
| C29 | C30 | C25 | H31 | 180.0° | 179.6° |
| C30 | C29 | C28 | H29 | 179.8° | 179.8° |
| C30 | C25 | C1 | H3 | 178.9° | 179.7° |
| C30 | C25 | C26 | H27 | 179.8° | 179.7° |
| C25 | C30 | C29 | H30 | 179.7° | 179.7° |
| H2 | C | H | H1 | 120.0° | 120.0° |
| H2 | C | C1 | H3 | 62.3° | 60.0° |
| H | C | C1 | H3 | 177.7° | 59.9° |
| H1 | C | C1 | H3 | 57.8° | 180.0° |
| H3 | C1 | C2 | H4 | 80.5° | 175.1° |
| H3 | C1 | C2 | H5 | 158.8° | 65.0° |
| H9 | C8 | C7 | H8 | 103.5° | 65.0° |
| H9 | C8 | C7 | H7 | 137.2° | 175.0° |
| H10 | C8 | C7 | H8 | 17.8° | 54.9° |
| H10 | C8 | C7 | H7 | 101.5° | 65.0° |
| H11 | N1 | C10 | H13 | 107.5° | 120.1° |
| H11 | N1 | C10 | H12 | 133.7° | 119.9° |
| H14 | C12 | C13 | H15 | 0.3° | 0.1° |
| H15 | C13 | C14 | H16 | 0.3° | 0.0° |
| H17 | C17 | N2 | H18 | 0.4° | 0.0° |
| H19 | C18 | N2 | H18 | 0.3° | 0.1° |
| H21 | C20 | C21 | H24 | 56.1° | 61.6° |
| H21 | C20 | C21 | H23 | 176.1° | 58.5° |
| H21 | C20 | C21 | H22 | 63.9° | 178.4° |
| H24 | C21 | H23 | H22 | 120.0° | 120.0° |
| H25 | C23 | C24 | H26 | 1.7° | 0.2° |
| H27 | C26 | C27 | H28 | 0.2° | 0.0° |
| H28 | C27 | C28 | H29 | 0.1° | 0.0° |
| H29 | C28 | C29 | H30 | 0.2° | 0.1° |
| H30 | C29 | C30 | H31 | 0.3° | 0.1° |
