G26
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.54Å | 1.54Å | |
| C | C5 | sing | 1.53Å | 1.53Å | |
| C | C6 | sing | 1.53Å | 1.53Å | |
| C | S | sing | 1.84Å | 1.84Å | |
| C1 | C7 | sing | 1.51Å | 1.54Å | |
| C1 | N | sing | 1.47Å | 1.48Å | |
| C1 | H1 | sing | 1.09Å | 1.11Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | N | sing | 1.49Å | 1.45Å | |
| C2 | S | sing | 1.85Å | 1.81Å | |
| C2 | H2 | sing | 1.09Å | 1.11Å | |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| C3 | N2 | sing | 1.47Å | 1.47Å | |
| C3 | H3 | sing | 1.09Å | 1.11Å | |
| C4 | N3 | sing | 1.35Å | 1.33Å | |
| C4 | O1 | doub | 1.21Å | 1.22Å | |
| C5 | H51 | sing | 1.09Å | 1.11Å | |
| C5 | H52 | sing | 1.09Å | 1.11Å | |
| C5 | H53 | sing | 1.09Å | 1.12Å | |
| C6 | H61 | sing | 1.09Å | 1.11Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C6 | H63 | sing | 1.09Å | 1.12Å | |
| C7 | N1 | sing | 1.35Å | 1.33Å | |
| C7 | O | doub | 1.21Å | 1.22Å | |
| C8 | C10 | sing | 1.53Å | 1.53Å | |
| C8 | C19 | sing | 1.53Å | 1.54Å | |
| C8 | N1 | sing | 1.46Å | 1.47Å | |
| C8 | H8 | sing | 1.09Å | 1.11Å | |
| C9 | C30 | sing | 1.51Å | 1.51Å | |
| C9 | N3 | sing | 1.46Å | 1.47Å | |
| C9 | H91 | sing | 1.09Å | 1.12Å | |
| C9 | H92 | sing | 1.09Å | 1.11Å | |
| C10 | O4 | sing | 1.43Å | 1.42Å | |
| C10 | H101 | sing | 1.09Å | 1.11Å | |
| C10 | H102 | sing | 1.09Å | 1.11Å | |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | N2 | sing | 1.35Å | 1.32Å | |
| C11 | O2 | doub | 1.21Å | 1.22Å | |
| C12 | C14 | sing | 1.51Å | 1.51Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.12Å | |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.10Å | |
| C14 | C15 | sing | 1.38Å | 1.37Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.37Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.10Å | |
| C16 | C17 | sing | 1.38Å | 1.37Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.10Å | |
| C17 | C18 | doub | 1.38Å | 1.37Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.10Å | |
| C19 | C23 | sing | 1.51Å | 1.51Å | |
| C19 | H191 | sing | 1.09Å | 1.11Å | |
| C19 | H192 | sing | 1.09Å | 1.12Å | |
| C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.10Å | |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.10Å | |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.10Å | |
| C23 | C24 | sing | 1.38Å | 1.37Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.10Å | |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.10Å | |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.10Å | |
| C28 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.10Å | |
| C29 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.10Å | |
| C30 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | H31 | sing | 1.08Å | 1.10Å | |
| N | HN | sing | 1.01Å | 1.02Å | |
| N1 | HN1 | sing | 0.97Å | 1.02Å | |
| N2 | HN2 | sing | 0.97Å | 1.02Å | |
| N3 | HN3 | sing | 0.97Å | 1.02Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C | C5 | 114.3° | 111.0° |
| C1 | C | C6 | 111.6° | 111.0° |
| C1 | C | S | 103.8° | 101.8° |
| C | C1 | C7 | 113.0° | 108.5° |
| C | C1 | N | 105.5° | 113.8° |
| C | C1 | H1 | 111.6° | 108.7° |
| C5 | C | C6 | 110.7° | 110.8° |
| C5 | C | S | 105.3° | 111.0° |
| C | C5 | H51 | 114.3° | 109.5° |
| C | C5 | H52 | 110.4° | 109.5° |
| C | C5 | H53 | 110.5° | 109.4° |
| C6 | C | S | 110.7° | 110.9° |
| C | C6 | H61 | 111.5° | 109.5° |
| C | C6 | H62 | 111.4° | 109.5° |
| C | C6 | H63 | 111.4° | 109.4° |
| C | S | C2 | 95.6° | 97.2° |
| C7 | C1 | N | 114.2° | 108.7° |
| C7 | C1 | H1 | 102.4° | 108.5° |
| C1 | C7 | N1 | 117.1° | 120.1° |
| C1 | C7 | O | 122.6° | 120.0° |
| N | C1 | H1 | 110.3° | 108.5° |
| C1 | N | C2 | 115.5° | 112.4° |
| C1 | N | HN | 110.0° | 106.6° |
| C3 | C2 | N | 109.4° | 111.4° |
| C3 | C2 | S | 108.7° | 111.4° |
| C3 | C2 | H2 | 108.7° | 111.1° |
| C2 | C3 | C4 | 113.4° | 109.5° |
| C2 | C3 | N2 | 107.1° | 109.4° |
| C2 | C3 | H3 | 109.8° | 109.5° |
| N | C2 | S | 104.9° | 99.5° |
| N | C2 | H2 | 112.1° | 111.5° |
| C2 | N | HN | 110.0° | 106.6° |
| S | C2 | H2 | 112.9° | 111.4° |
| C4 | C3 | N2 | 113.2° | 109.5° |
| C4 | C3 | H3 | 103.2° | 109.5° |
| C3 | C4 | N3 | 116.0° | 120.0° |
| C3 | C4 | O1 | 122.6° | 120.0° |
| N2 | C3 | H3 | 110.0° | 109.4° |
| C3 | N2 | C11 | 118.5° | 120.0° |
| C3 | N2 | HN2 | 126.0° | 119.9° |
| N3 | C4 | O1 | 121.3° | 120.0° |
| C4 | N3 | C9 | 120.5° | 120.0° |
| C4 | N3 | HN3 | 114.7° | 120.0° |
| H51 | C5 | H52 | 110.5° | 109.4° |
| H51 | C5 | H53 | 110.4° | 109.5° |
| H52 | C5 | H53 | 99.7° | 109.4° |
| H61 | C6 | H62 | 111.5° | 109.5° |
| H61 | C6 | H63 | 111.4° | 109.5° |
| H62 | C6 | H63 | 98.9° | 109.5° |
| N1 | C7 | O | 120.3° | 120.0° |
| C7 | N1 | C8 | 119.9° | 120.1° |
| C7 | N1 | HN1 | 115.1° | 120.0° |
| C10 | C8 | C19 | 113.2° | 109.5° |
| C10 | C8 | N1 | 110.7° | 109.5° |
| C10 | C8 | H8 | 107.0° | 109.5° |
| C8 | C10 | O4 | 110.4° | 109.5° |
| C8 | C10 | H101 | 111.8° | 109.5° |
| C8 | C10 | H102 | 111.9° | 109.5° |
| C19 | C8 | N1 | 112.2° | 109.5° |
| C19 | C8 | H8 | 105.3° | 109.4° |
| C8 | C19 | C23 | 111.8° | 109.5° |
| C8 | C19 | H191 | 111.3° | 109.5° |
| C8 | C19 | H192 | 111.3° | 109.4° |
| N1 | C8 | H8 | 108.1° | 109.4° |
| C8 | N1 | HN1 | 125.1° | 120.0° |
| C30 | C9 | N3 | 112.7° | 109.5° |
| C30 | C9 | H91 | 111.0° | 109.4° |
| C30 | C9 | H92 | 111.0° | 109.4° |
| C9 | C30 | C29 | 120.5° | 120.0° |
| C9 | C30 | C31 | 120.3° | 120.0° |
| N3 | C9 | H91 | 111.0° | 109.5° |
| N3 | C9 | H92 | 111.0° | 109.5° |
| C9 | N3 | HN3 | 124.8° | 120.0° |
| H91 | C9 | H92 | 99.3° | 109.5° |
| O4 | C10 | H101 | 111.9° | 109.5° |
| O4 | C10 | H102 | 111.9° | 109.5° |
| C10 | O4 | HO4 | 110.4° | 106.8° |
| H101 | C10 | H102 | 98.5° | 109.4° |
| C12 | C11 | N2 | 114.3° | 119.9° |
| C12 | C11 | O2 | 123.1° | 120.0° |
| C11 | C12 | C14 | 108.1° | 109.5° |
| C11 | C12 | H121 | 112.8° | 109.5° |
| C11 | C12 | H122 | 112.7° | 109.5° |
| N2 | C11 | O2 | 122.6° | 120.1° |
| C11 | N2 | HN2 | 115.5° | 120.1° |
| C14 | C12 | H121 | 112.7° | 109.4° |
| C14 | C12 | H122 | 112.7° | 109.4° |
| C12 | C14 | C13 | 119.7° | 120.0° |
| C12 | C14 | C15 | 120.9° | 120.0° |
| H121 | C12 | H122 | 97.7° | 109.5° |
| C14 | C13 | C18 | 121.0° | 120.1° |
| C14 | C13 | H13 | 119.8° | 120.0° |
| C13 | C14 | C15 | 119.4° | 120.0° |
| C18 | C13 | H13 | 119.2° | 120.0° |
| C13 | C18 | C17 | 118.9° | 120.0° |
| C13 | C18 | H18 | 120.7° | 120.1° |
| C14 | C15 | C16 | 119.6° | 120.0° |
| C14 | C15 | H15 | 120.1° | 120.0° |
| C16 | C15 | H15 | 120.3° | 120.0° |
| C15 | C16 | C17 | 120.9° | 120.0° |
| C15 | C16 | H16 | 119.6° | 120.0° |
| C17 | C16 | H16 | 119.6° | 120.0° |
| C16 | C17 | C18 | 120.2° | 120.0° |
| C16 | C17 | H17 | 120.0° | 120.0° |
| C18 | C17 | H17 | 119.8° | 120.0° |
| C17 | C18 | H18 | 120.4° | 119.9° |
| C23 | C19 | H191 | 111.4° | 109.5° |
| C23 | C19 | H192 | 111.3° | 109.5° |
| C19 | C23 | C22 | 121.2° | 120.0° |
| C19 | C23 | C24 | 119.5° | 120.0° |
| H191 | C19 | H192 | 99.1° | 109.4° |
| C21 | C20 | C25 | 119.7° | 120.0° |
| C21 | C20 | H20 | 120.2° | 120.0° |
| C20 | C21 | C22 | 120.1° | 120.0° |
| C20 | C21 | H21 | 119.8° | 119.9° |
| C25 | C20 | H20 | 120.1° | 120.0° |
| C20 | C25 | C24 | 119.9° | 120.0° |
| C20 | C25 | H25 | 119.9° | 120.0° |
| C22 | C21 | H21 | 120.2° | 120.1° |
| C21 | C22 | C23 | 120.5° | 120.1° |
| C21 | C22 | H22 | 120.0° | 119.9° |
| C23 | C22 | H22 | 119.5° | 120.0° |
| C22 | C23 | C24 | 119.2° | 120.0° |
| C23 | C24 | C25 | 120.6° | 120.0° |
| C23 | C24 | H24 | 119.4° | 120.0° |
| C25 | C24 | H24 | 119.9° | 120.0° |
| C24 | C25 | H25 | 120.2° | 120.0° |
| C27 | C26 | C31 | 120.1° | 120.0° |
| C27 | C26 | H26 | 119.9° | 120.0° |
| C26 | C27 | C28 | 119.9° | 120.0° |
| C26 | C27 | H27 | 120.0° | 120.0° |
| C31 | C26 | H26 | 120.0° | 120.1° |
| C26 | C31 | C30 | 120.3° | 120.0° |
| C26 | C31 | H31 | 119.8° | 120.0° |
| C28 | C27 | H27 | 120.1° | 120.0° |
| C27 | C28 | C29 | 119.8° | 120.0° |
| C27 | C28 | H28 | 120.1° | 120.0° |
| C29 | C28 | H28 | 120.1° | 120.0° |
| C28 | C29 | C30 | 120.6° | 120.0° |
| C28 | C29 | H29 | 119.6° | 120.0° |
| C30 | C29 | H29 | 119.8° | 120.0° |
| C29 | C30 | C31 | 119.3° | 120.0° |
| C30 | C31 | H31 | 119.8° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C | C5 | C6 | 127.0° | 123.8° |
| C1 | C | C5 | S | 113.3° | 112.4° |
| C1 | C | C6 | S | 115.1° | 112.4° |
| C | C1 | C7 | N | 120.7° | 124.2° |
| C | C1 | C7 | H1 | 120.2° | 117.9° |
| C | C1 | N | H1 | 120.7° | 121.2° |
| C | C1 | N | C2 | 41.6° | 32.5° |
| C1 | C | S | C2 | 19.6° | 16.1° |
| C1 | C | C5 | H51 | 180.0° | 176.9° |
| C1 | C | C5 | H52 | 54.7° | 63.1° |
| C1 | C | C5 | H53 | 54.7° | 56.9° |
| C1 | C | C6 | H61 | 180.0° | 176.9° |
| C1 | C | C6 | H62 | 54.7° | 56.9° |
| C1 | C | C6 | H63 | 54.8° | 63.1° |
| C | C1 | C7 | N1 | 79.2° | 84.4° |
| C | C1 | C7 | O | 99.5° | 95.6° |
| C | C1 | N | HN | 166.9° | 149.0° |
| C5 | C | C6 | S | 116.4° | 123.8° |
| C5 | C | C1 | C7 | 46.4° | 2.7° |
| C5 | C | C1 | N | 79.1° | 123.8° |
| C5 | C | C1 | H1 | 161.1° | 115.2° |
| C5 | C | S | C2 | 100.8° | 102.0° |
| C | C5 | H51 | H52 | 125.3° | 120.0° |
| C | C5 | H51 | H53 | 125.3° | 120.0° |
| C | C5 | H52 | H53 | 116.3° | 120.0° |
| C5 | C | C6 | H61 | 51.5° | 59.3° |
| C5 | C | C6 | H62 | 176.8° | 179.3° |
| C5 | C | C6 | H63 | 73.7° | 60.7° |
| C6 | C | C1 | C7 | 80.2° | 126.4° |
| C6 | C | C1 | N | 154.4° | 112.5° |
| C6 | C | C1 | H1 | 34.6° | 8.6° |
| C6 | C | S | C2 | 139.5° | 134.3° |
| C6 | C | C5 | H51 | 53.0° | 59.2° |
| C6 | C | C5 | H52 | 72.3° | 60.8° |
| C6 | C | C5 | H53 | 178.3° | 179.3° |
| C | C6 | H61 | H62 | 125.3° | 120.0° |
| C | C6 | H61 | H63 | 125.2° | 120.0° |
| C | C6 | H62 | H63 | 117.3° | 120.0° |
| S | C | C1 | C7 | 160.6° | 115.5° |
| S | C | C1 | N | 35.1° | 5.6° |
| S | C | C1 | H1 | 84.7° | 126.7° |
| C | S | C2 | C3 | 115.1° | 149.7° |
| C | S | C2 | N | 1.9° | 32.1° |
| C | S | C2 | H2 | 124.3° | 85.5° |
| S | C | C5 | H51 | 66.7° | 64.5° |
| S | C | C5 | H52 | 168.0° | 175.5° |
| S | C | C5 | H53 | 58.6° | 55.6° |
| S | C | C6 | H61 | 64.9° | 64.5° |
| S | C | C6 | H62 | 60.4° | 55.5° |
| S | C | C6 | H63 | 169.9° | 175.5° |
| C7 | C1 | N | H1 | 114.6° | 117.8° |
| C7 | C1 | N | C2 | 166.3° | 88.5° |
| C1 | C7 | N1 | O | 178.7° | 180.0° |
| C1 | C7 | N1 | C8 | 171.9° | 179.9° |
| C7 | C1 | N | HN | 68.4° | 28.0° |
| C1 | C7 | N1 | HN1 | 8.0° | 0.0° |
| C1 | N | C2 | C3 | 90.7° | 158.1° |
| C1 | N | C2 | HN | 125.3° | 116.5° |
| C1 | N | C2 | S | 25.8° | 40.5° |
| C1 | N | C2 | H2 | 148.6° | 77.1° |
| N | C1 | C7 | N1 | 160.2° | 151.4° |
| N | C1 | C7 | O | 21.1° | 28.6° |
| H1 | C1 | N | C2 | 79.0° | 153.6° |
| H1 | C1 | C7 | N1 | 41.0° | 33.6° |
| H1 | C1 | C7 | O | 140.3° | 146.4° |
| H1 | C1 | N | HN | 46.3° | 89.9° |
| C3 | C2 | N | S | 116.5° | 117.6° |
| C3 | C2 | N | H2 | 120.6° | 124.8° |
| C3 | C2 | S | H2 | 120.6° | 124.7° |
| C2 | C3 | C4 | N2 | 122.3° | 120.0° |
| C2 | C3 | C4 | H3 | 118.8° | 120.0° |
| C2 | C3 | N2 | H3 | 119.3° | 120.0° |
| C2 | C3 | C4 | N3 | 148.1° | 90.0° |
| C2 | C3 | C4 | O1 | 34.8° | 90.1° |
| C2 | C3 | N2 | C11 | 118.4° | 150.0° |
| C3 | C2 | N | HN | 34.6° | 85.4° |
| C2 | C3 | N2 | HN2 | 61.5° | 30.0° |
| N | C2 | S | H2 | 122.4° | 117.7° |
| N | C2 | C3 | C4 | 177.1° | 68.4° |
| N | C2 | C3 | N2 | 57.2° | 51.6° |
| N | C2 | C3 | H3 | 62.2° | 171.6° |
| S | C2 | C3 | C4 | 63.0° | 178.6° |
| S | C2 | C3 | N2 | 171.3° | 58.5° |
| S | C2 | C3 | H3 | 51.8° | 61.4° |
| S | C2 | N | HN | 151.1° | 157.0° |
| H2 | C2 | C3 | C4 | 60.2° | 56.6° |
| H2 | C2 | C3 | N2 | 65.5° | 176.6° |
| H2 | C2 | C3 | H3 | 175.0° | 63.5° |
| H2 | C2 | N | HN | 86.1° | 39.4° |
| C4 | C3 | N2 | H3 | 114.9° | 120.0° |
| C3 | C4 | N3 | O1 | 177.2° | 179.9° |
| C3 | C4 | N3 | C9 | 171.4° | 180.0° |
| C4 | C3 | N2 | C11 | 115.8° | 89.9° |
| C4 | C3 | N2 | HN2 | 64.3° | 90.0° |
| C3 | C4 | N3 | HN3 | 8.6° | 0.0° |
| N2 | C3 | C4 | N3 | 89.6° | 30.0° |
| N2 | C3 | C4 | O1 | 87.5° | 149.9° |
| C3 | N2 | C11 | C12 | 166.4° | 180.0° |
| C3 | N2 | C11 | HN2 | 179.9° | 179.9° |
| C3 | N2 | C11 | O2 | 12.4° | 0.1° |
| H3 | C3 | C4 | N3 | 29.3° | 150.0° |
| H3 | C3 | C4 | O1 | 153.6° | 30.0° |
| H3 | C3 | N2 | C11 | 0.9° | 30.1° |
| H3 | C3 | N2 | HN2 | 179.2° | 150.0° |
| C4 | N3 | C9 | C30 | 70.3° | 180.0° |
| C4 | N3 | C9 | HN3 | 180.0° | 179.9° |
| C4 | N3 | C9 | H91 | 54.9° | 60.1° |
| C4 | N3 | C9 | H92 | 164.4° | 60.0° |
| O1 | C4 | N3 | C9 | 5.8° | 0.1° |
| O1 | C4 | N3 | HN3 | 174.2° | 180.0° |
| H51 | C5 | H52 | H53 | 116.2° | 120.0° |
| H61 | C6 | H62 | H63 | 117.3° | 120.0° |
| C7 | N1 | C8 | C10 | 154.2° | 90.0° |
| C7 | N1 | C8 | C19 | 78.4° | 150.0° |
| C7 | N1 | C8 | HN1 | 179.9° | 179.9° |
| C7 | N1 | C8 | H8 | 37.2° | 30.0° |
| O | C7 | N1 | C8 | 6.8° | 0.0° |
| O | C7 | N1 | HN1 | 173.2° | 180.0° |
| C10 | C8 | C19 | N1 | 126.1° | 120.0° |
| C10 | C8 | C19 | H8 | 116.5° | 120.0° |
| C10 | C8 | N1 | H8 | 116.9° | 120.0° |
| C8 | C10 | O4 | H101 | 125.2° | 120.1° |
| C8 | C10 | O4 | H102 | 125.3° | 120.0° |
| C8 | C10 | H101 | H102 | 117.8° | 120.0° |
| C10 | C8 | C19 | C23 | 62.4° | 180.0° |
| C10 | C8 | C19 | H191 | 62.9° | 59.9° |
| C10 | C8 | C19 | H192 | 172.4° | 60.0° |
| C10 | C8 | N1 | HN1 | 25.8° | 89.9° |
| C8 | C10 | O4 | HO4 | 180.0° | 180.0° |
| C19 | C8 | N1 | H8 | 115.6° | 119.9° |
| C19 | C8 | C10 | O4 | 59.6° | 60.1° |
| C19 | C8 | C10 | H101 | 65.7° | 60.0° |
| C19 | C8 | C10 | H102 | 175.1° | 179.9° |
| C8 | C19 | C23 | H191 | 125.2° | 120.1° |
| C8 | C19 | C23 | H192 | 125.2° | 120.0° |
| C8 | C19 | H191 | H192 | 117.2° | 119.9° |
| C8 | C19 | C23 | C22 | 86.9° | 90.1° |
| C8 | C19 | C23 | C24 | 91.2° | 90.2° |
| C19 | C8 | N1 | HN1 | 101.6° | 30.1° |
| N1 | C8 | C10 | O4 | 67.3° | 60.0° |
| N1 | C8 | C10 | H101 | 167.4° | 180.0° |
| N1 | C8 | C10 | H102 | 58.0° | 60.0° |
| N1 | C8 | C19 | C23 | 171.5° | 59.9° |
| N1 | C8 | C19 | H191 | 63.2° | 180.0° |
| N1 | C8 | C19 | H192 | 46.3° | 60.1° |
| H8 | C8 | C10 | O4 | 175.1° | 180.0° |
| H8 | C8 | C10 | H101 | 49.8° | 60.0° |
| H8 | C8 | C10 | H102 | 59.6° | 60.0° |
| H8 | C8 | C19 | C23 | 54.2° | 60.0° |
| H8 | C8 | C19 | H191 | 179.5° | 60.1° |
| H8 | C8 | C19 | H192 | 71.0° | 180.0° |
| H8 | C8 | N1 | HN1 | 142.7° | 150.0° |
| C30 | C9 | N3 | H91 | 125.3° | 119.9° |
| C30 | C9 | N3 | H92 | 125.3° | 120.0° |
| C30 | C9 | H91 | H92 | 116.9° | 120.0° |
| C9 | C30 | C31 | C26 | 178.2° | 179.8° |
| C9 | C30 | C29 | C28 | 178.3° | 180.0° |
| C9 | C30 | C29 | C31 | 178.9° | 179.8° |
| C9 | C30 | C29 | H29 | 1.7° | 0.0° |
| C9 | C30 | C31 | H31 | 1.8° | 0.2° |
| C30 | C9 | N3 | HN3 | 109.7° | 0.0° |
| N3 | C9 | H91 | H92 | 116.9° | 120.1° |
| N3 | C9 | C30 | C29 | 91.9° | 89.9° |
| N3 | C9 | C30 | C31 | 87.1° | 90.3° |
| H91 | C9 | C30 | C29 | 33.4° | 30.0° |
| H91 | C9 | C30 | C31 | 147.7° | 149.8° |
| H91 | C9 | N3 | HN3 | 125.0° | 120.0° |
| H92 | C9 | C30 | C29 | 142.9° | 150.0° |
| H92 | C9 | C30 | C31 | 38.2° | 29.8° |
| H92 | C9 | N3 | HN3 | 15.6° | 119.9° |
| O4 | C10 | H101 | H102 | 117.8° | 120.0° |
| H101 | C10 | O4 | HO4 | 54.8° | 59.9° |
| H102 | C10 | O4 | HO4 | 54.7° | 60.0° |
| C12 | C11 | N2 | O2 | 178.7° | 179.9° |
| C11 | C12 | C14 | H121 | 125.3° | 120.0° |
| C11 | C12 | C14 | H122 | 125.3° | 120.0° |
| C11 | C12 | H121 | H122 | 118.7° | 120.1° |
| C11 | C12 | C14 | C13 | 69.3° | 90.0° |
| C11 | C12 | C14 | C15 | 109.4° | 90.3° |
| C12 | C11 | N2 | HN2 | 13.6° | 0.1° |
| N2 | C11 | C12 | C14 | 110.7° | 180.0° |
| N2 | C11 | C12 | H121 | 124.0° | 60.1° |
| N2 | C11 | C12 | H122 | 14.5° | 60.0° |
| O2 | C11 | C12 | C14 | 68.0° | 0.0° |
| O2 | C11 | C12 | H121 | 57.3° | 120.0° |
| O2 | C11 | C12 | H122 | 166.8° | 120.0° |
| O2 | C11 | N2 | HN2 | 167.7° | 180.0° |
| C14 | C12 | H121 | H122 | 118.6° | 119.9° |
| C12 | C14 | C13 | C15 | 178.7° | 179.8° |
| C12 | C14 | C13 | C18 | 178.4° | 180.0° |
| C12 | C14 | C13 | H13 | 1.6° | 0.0° |
| C12 | C14 | C15 | C16 | 178.6° | 179.7° |
| C12 | C14 | C15 | H15 | 1.5° | 0.2° |
| H121 | C12 | C14 | C13 | 165.4° | 30.1° |
| H121 | C12 | C14 | C15 | 15.9° | 149.7° |
| H122 | C12 | C14 | C13 | 56.0° | 150.0° |
| H122 | C12 | C14 | C15 | 125.3° | 29.8° |
| C14 | C13 | C18 | H13 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.2° | 0.5° |
| C13 | C14 | C15 | H15 | 179.8° | 180.0° |
| C14 | C13 | C18 | C17 | 0.4° | 0.0° |
| C14 | C13 | C18 | H18 | 179.6° | 180.0° |
| C18 | C13 | C14 | C15 | 0.3° | 0.2° |
| C13 | C18 | C17 | C16 | 0.3° | 0.0° |
| C13 | C18 | C17 | H18 | 180.0° | 180.0° |
| C13 | C18 | C17 | H17 | 179.7° | 179.9° |
| H13 | C13 | C14 | C15 | 179.6° | 179.8° |
| H13 | C13 | C18 | C17 | 179.6° | 180.0° |
| H13 | C13 | C18 | H18 | 0.5° | 0.0° |
| C14 | C15 | C16 | H15 | 180.0° | 179.5° |
| C14 | C15 | C16 | C17 | 0.1° | 0.5° |
| C14 | C15 | C16 | H16 | 179.9° | 179.8° |
| C15 | C16 | C17 | H16 | 180.0° | 179.7° |
| C15 | C16 | C17 | C18 | 0.2° | 0.3° |
| C15 | C16 | C17 | H17 | 179.9° | 179.8° |
| H15 | C15 | C16 | C17 | 179.9° | 180.0° |
| H15 | C15 | C16 | H16 | 0.1° | 0.3° |
| C16 | C17 | C18 | H17 | 180.0° | 179.9° |
| C16 | C17 | C18 | H18 | 179.7° | 180.0° |
| H16 | C16 | C17 | C18 | 179.8° | 180.0° |
| H16 | C16 | C17 | H17 | 0.1° | 0.1° |
| H17 | C17 | C18 | H18 | 0.3° | 0.1° |
| C23 | C19 | H191 | H192 | 117.3° | 120.0° |
| C19 | C23 | C22 | C21 | 178.0° | 180.0° |
| C19 | C23 | C22 | C24 | 178.1° | 179.8° |
| C19 | C23 | C22 | H22 | 2.0° | 0.1° |
| C19 | C23 | C24 | C25 | 178.4° | 179.8° |
| C19 | C23 | C24 | H24 | 1.6° | 0.2° |
| H191 | C19 | C23 | C22 | 38.3° | 30.0° |
| H191 | C19 | C23 | C24 | 143.6° | 149.7° |
| H192 | C19 | C23 | C22 | 147.9° | 150.0° |
| H192 | C19 | C23 | C24 | 34.0° | 29.8° |
| C21 | C20 | C25 | H20 | 180.0° | 180.0° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.4° | 0.1° |
| C20 | C21 | C22 | H22 | 179.6° | 180.0° |
| C21 | C20 | C25 | C24 | 0.0° | 0.2° |
| C21 | C20 | C25 | H25 | 180.0° | 180.0° |
| C25 | C20 | C21 | C22 | 0.3° | 0.0° |
| C25 | C20 | C21 | H21 | 179.7° | 180.0° |
| C20 | C25 | C24 | C23 | 0.3° | 0.4° |
| C20 | C25 | C24 | H25 | 180.0° | 179.8° |
| C20 | C25 | C24 | H24 | 179.7° | 180.0° |
| H20 | C20 | C21 | C22 | 179.7° | 180.0° |
| H20 | C20 | C21 | H21 | 0.3° | 0.0° |
| H20 | C20 | C25 | C24 | 180.0° | 179.8° |
| H20 | C20 | C25 | H25 | 0.0° | 0.0° |
| C21 | C22 | C23 | H22 | 179.9° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.3° |
| H21 | C21 | C22 | C23 | 179.6° | 179.9° |
| H21 | C21 | C22 | H22 | 0.3° | 0.0° |
| C22 | C23 | C24 | C25 | 0.2° | 0.5° |
| C22 | C23 | C24 | H24 | 179.7° | 179.9° |
| H22 | C22 | C23 | C24 | 179.9° | 179.8° |
| C23 | C24 | C25 | H24 | 180.0° | 179.6° |
| C23 | C24 | C25 | H25 | 179.7° | 179.8° |
| H24 | C24 | C25 | H25 | 0.4° | 0.2° |
| C27 | C26 | C31 | H26 | 179.9° | 179.9° |
| C26 | C27 | C28 | H27 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.3° | 0.0° |
| C26 | C27 | C28 | H28 | 179.7° | 180.0° |
| C27 | C26 | C31 | C30 | 0.3° | 0.3° |
| C27 | C26 | C31 | H31 | 179.7° | 180.0° |
| C31 | C26 | C27 | C28 | 0.2° | 0.1° |
| C31 | C26 | C27 | H27 | 179.8° | 179.9° |
| C26 | C31 | C30 | C29 | 0.8° | 0.4° |
| C26 | C31 | C30 | H31 | 180.0° | 179.7° |
| H26 | C26 | C27 | C28 | 179.8° | 180.0° |
| H26 | C26 | C27 | H27 | 0.2° | 0.0° |
| H26 | C26 | C31 | C30 | 179.6° | 179.8° |
| H26 | C26 | C31 | H31 | 0.3° | 0.1° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.0° |
| C27 | C28 | C29 | H29 | 179.9° | 180.0° |
| H27 | C27 | C28 | C29 | 179.7° | 179.9° |
| H27 | C27 | C28 | H28 | 0.3° | 0.0° |
| C28 | C29 | C30 | H29 | 179.9° | 180.0° |
| C28 | C29 | C30 | C31 | 0.7° | 0.2° |
| H28 | C28 | C29 | C30 | 179.8° | 180.0° |
| H28 | C28 | C29 | H29 | 0.1° | 0.1° |
| C29 | C30 | C31 | H31 | 179.3° | 180.0° |
| H29 | C29 | C30 | C31 | 179.4° | 179.8° |
