A1BLL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C13 | doub | 1.22Å | 1.23Å | |
| C21 | C18 | sing | 1.54Å | 1.54Å | |
| C21 | C20 | sing | 1.54Å | 1.54Å | |
| C13 | C14 | sing | 1.48Å | 1.49Å | |
| C13 | N3 | sing | 1.35Å | 1.33Å | |
| C22 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C22 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| N5 | C18 | sing | 1.47Å | 1.45Å | |
| N5 | C17 | sing | 1.39Å | 1.36Å | |
| C12 | N3 | sing | 1.47Å | 1.45Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| O1 | C11 | sing | 1.43Å | 1.42Å | |
| C14 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.54Å | 1.54Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | N2 | sing | 1.47Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C23 | N2 | sing | 1.47Å | 1.46Å | |
| C17 | N4 | doub | 1.32Å | 1.34Å | Aromatic |
| C20 | C19 | sing | 1.54Å | 1.53Å | |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| N2 | C9 | sing | 1.47Å | 1.47Å | |
| C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| N4 | C16 | sing | 1.32Å | 1.34Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C26 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | O | sing | 1.36Å | 1.37Å | |
| C5 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
| C4 | O | sing | 1.43Å | 1.42Å | |
| C4 | C3 | sing | 1.51Å | 1.49Å | |
| C7 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.35Å | 1.38Å | Aromatic |
| C3 | N | sing | 1.35Å | 1.35Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| C | N | sing | 1.46Å | 1.45Å | |
| N | N1 | sing | 1.40Å | 1.36Å | Aromatic |
| C1 | N1 | doub | 1.31Å | 1.33Å | Aromatic |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.08Å | 1.08Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H20 | sing | 1.08Å | 1.08Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.08Å | 1.08Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C2 | H28 | sing | 1.08Å | 1.08Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C9 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H32 | sing | 1.09Å | 1.10Å | |
| N5 | H34 | sing | 0.97Å | 1.00Å | |
| O1 | H35 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C13 | C14 | 121.0° | 120.0° |
| O2 | C13 | N3 | 122.2° | 120.0° |
| C18 | C21 | C20 | 88.5° | 87.1° |
| C21 | C18 | N5 | 117.0° | 113.6° |
| C21 | C18 | C19 | 88.8° | 87.1° |
| C18 | C21 | H11 | 114.4° | 113.6° |
| C18 | C21 | H12 | 114.4° | 113.6° |
| C21 | C18 | H25 | 110.4° | 113.7° |
| C21 | C20 | C19 | 89.2° | 87.1° |
| C21 | C20 | H9 | 114.3° | 113.7° |
| C21 | C20 | H10 | 114.3° | 113.7° |
| C20 | C21 | H11 | 114.4° | 113.6° |
| C20 | C21 | H12 | 114.4° | 113.6° |
| C14 | C13 | N3 | 116.8° | 120.0° |
| C13 | C14 | C22 | 118.7° | 120.9° |
| C13 | C14 | C15 | 122.1° | 120.9° |
| C13 | N3 | C12 | 122.1° | 120.0° |
| C13 | N3 | H1 | 118.9° | 120.0° |
| C14 | C22 | C17 | 117.8° | 119.0° |
| C22 | C14 | C15 | 119.2° | 118.2° |
| C14 | C22 | H13 | 121.1° | 120.5° |
| C22 | C17 | N5 | 118.9° | 119.7° |
| C22 | C17 | N4 | 123.6° | 120.7° |
| C17 | C22 | H13 | 121.1° | 120.5° |
| C18 | N5 | C17 | 124.0° | 120.0° |
| N5 | C18 | C19 | 116.4° | 113.6° |
| N5 | C18 | H25 | 111.8° | 112.9° |
| C18 | N5 | H34 | 105.7° | 120.0° |
| N5 | C17 | N4 | 117.5° | 119.6° |
| C17 | N5 | H34 | 105.7° | 120.0° |
| N3 | C12 | C11 | 107.8° | 109.5° |
| C12 | N3 | H1 | 119.0° | 120.0° |
| N3 | C12 | H22 | 109.9° | 109.5° |
| N3 | C12 | H23 | 109.9° | 109.5° |
| C12 | C11 | O1 | 109.5° | 109.4° |
| C12 | C11 | C10 | 112.8° | 109.5° |
| C12 | C11 | H21 | 108.0° | 109.5° |
| C11 | C12 | H22 | 109.9° | 109.5° |
| C11 | C12 | H23 | 109.9° | 109.4° |
| O1 | C11 | C10 | 109.4° | 109.5° |
| O1 | C11 | H21 | 109.2° | 109.5° |
| C11 | O1 | H35 | 109.5° | 114.0° |
| C14 | C15 | C16 | 118.6° | 119.2° |
| C14 | C15 | H8 | 120.7° | 120.4° |
| C18 | C19 | C20 | 88.8° | 87.1° |
| C19 | C18 | H25 | 110.4° | 113.6° |
| C18 | C19 | H26 | 114.3° | 113.6° |
| C18 | C19 | H27 | 114.3° | 113.6° |
| C11 | C10 | N2 | 111.9° | 109.5° |
| C11 | C10 | H6 | 108.8° | 109.5° |
| C11 | C10 | H7 | 108.9° | 109.5° |
| C10 | C11 | H21 | 107.9° | 109.5° |
| C10 | N2 | C23 | 110.6° | 111.0° |
| C10 | N2 | C9 | 111.4° | 111.0° |
| N2 | C10 | H6 | 108.9° | 109.4° |
| N2 | C10 | H7 | 108.9° | 109.5° |
| C24 | C23 | N2 | 110.8° | 108.3° |
| C23 | C24 | C25 | 109.2° | 109.8° |
| C23 | C24 | H14 | 109.5° | 109.5° |
| C23 | C24 | H15 | 109.5° | 109.3° |
| C24 | C23 | H29 | 109.1° | 109.6° |
| C24 | C23 | H30 | 109.1° | 109.6° |
| C23 | N2 | C9 | 109.8° | 110.3° |
| N2 | C23 | H29 | 109.1° | 109.4° |
| N2 | C23 | H30 | 109.1° | 110.1° |
| C17 | N4 | C16 | 117.1° | 121.9° |
| C19 | C20 | H9 | 114.3° | 113.6° |
| C19 | C20 | H10 | 114.3° | 113.6° |
| C20 | C19 | H26 | 114.3° | 113.6° |
| C20 | C19 | H27 | 114.4° | 113.6° |
| C24 | C25 | C26 | 120.1° | 118.4° |
| C24 | C25 | C8 | 120.6° | 121.7° |
| C25 | C24 | H14 | 109.5° | 109.4° |
| C25 | C24 | H15 | 109.5° | 109.4° |
| N2 | C9 | C8 | 113.8° | 110.5° |
| N2 | C9 | H31 | 108.4° | 109.3° |
| N2 | C9 | H32 | 108.4° | 109.3° |
| C15 | C16 | N4 | 123.7° | 121.0° |
| C16 | C15 | H8 | 120.7° | 120.4° |
| C15 | C16 | H24 | 118.1° | 119.5° |
| N4 | C16 | H24 | 118.2° | 119.5° |
| C26 | C25 | C8 | 119.4° | 119.9° |
| C25 | C26 | C5 | 120.5° | 120.3° |
| C25 | C26 | H16 | 119.8° | 119.9° |
| C25 | C8 | C9 | 120.8° | 121.8° |
| C25 | C8 | C7 | 119.1° | 119.8° |
| C9 | C8 | C7 | 120.1° | 118.4° |
| C8 | C9 | H31 | 108.4° | 109.2° |
| C8 | C9 | H32 | 108.4° | 109.3° |
| C26 | C5 | O | 125.6° | 120.2° |
| C26 | C5 | C6 | 120.3° | 119.7° |
| C5 | C26 | H16 | 119.7° | 119.8° |
| C8 | C7 | C6 | 121.1° | 120.4° |
| C8 | C7 | H5 | 119.4° | 119.8° |
| O | C5 | C6 | 113.8° | 120.2° |
| C5 | O | C4 | 121.8° | 117.0° |
| C5 | C6 | C7 | 119.6° | 119.8° |
| C5 | C6 | H4 | 120.2° | 120.1° |
| O | C4 | C3 | 105.9° | 109.4° |
| O | C4 | H2 | 110.4° | 109.5° |
| O | C4 | H3 | 110.4° | 109.4° |
| C4 | C3 | C2 | 127.1° | 126.1° |
| C4 | C3 | N | 126.6° | 126.1° |
| C3 | C4 | H2 | 110.4° | 109.5° |
| C3 | C4 | H3 | 110.3° | 109.5° |
| C7 | C6 | H4 | 120.2° | 120.1° |
| C6 | C7 | H5 | 119.4° | 119.8° |
| C2 | C3 | N | 106.3° | 107.8° |
| C3 | C2 | C1 | 105.1° | 107.9° |
| C3 | C2 | H28 | 127.5° | 126.1° |
| C3 | N | C | 129.0° | 126.1° |
| C3 | N | N1 | 112.4° | 107.9° |
| C2 | C1 | N1 | 112.4° | 108.2° |
| C2 | C1 | H20 | 123.8° | 125.9° |
| C1 | C2 | H28 | 127.4° | 126.0° |
| C | N | N1 | 118.6° | 126.1° |
| N | C | H17 | 109.5° | 109.4° |
| N | C | H18 | 109.5° | 109.5° |
| N | C | H19 | 109.4° | 109.5° |
| N | N1 | C1 | 103.8° | 108.3° |
| N1 | C1 | H20 | 123.8° | 125.9° |
| H2 | C4 | H3 | 109.4° | 109.5° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 112.8° |
| H11 | C21 | H12 | 109.5° | 112.9° |
| H14 | C24 | H15 | 109.5° | 109.4° |
| H17 | C | H18 | 109.5° | 109.4° |
| H17 | C | H19 | 109.4° | 109.5° |
| H18 | C | H19 | 109.5° | 109.5° |
| H22 | C12 | H23 | 109.5° | 109.5° |
| H26 | C19 | H27 | 109.5° | 112.9° |
| H29 | C23 | H30 | 109.5° | 109.8° |
| H31 | C9 | H32 | 109.4° | 109.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C13 | C14 | N3 | 179.1° | 180.0° |
| O2 | C13 | C14 | C22 | 37.4° | 0.0° |
| O2 | C13 | N3 | C12 | 9.1° | 0.0° |
| O2 | C13 | C14 | C15 | 141.7° | 180.0° |
| O2 | C13 | N3 | H1 | 170.9° | 180.0° |
| C18 | C21 | C20 | H11 | 116.3° | 114.6° |
| C18 | C21 | C20 | H12 | 116.3° | 114.5° |
| C21 | C18 | N5 | C19 | 103.0° | 97.5° |
| C21 | C18 | N5 | H25 | 128.7° | 131.3° |
| C21 | C18 | N5 | C17 | 154.2° | 155.0° |
| C21 | C18 | C19 | H25 | 111.4° | 114.6° |
| C18 | C21 | C20 | C19 | 16.4° | 25.4° |
| C18 | C21 | C20 | H9 | 100.0° | 89.1° |
| C18 | C21 | C20 | H10 | 132.8° | 140.0° |
| C18 | C21 | H11 | H12 | 130.0° | 131.2° |
| C21 | C18 | C19 | H26 | 99.9° | 140.0° |
| C21 | C18 | C19 | H27 | 132.7° | 89.1° |
| C21 | C18 | N5 | H34 | 83.8° | 25.0° |
| C20 | C21 | C18 | N5 | 135.5° | 140.0° |
| C21 | C20 | C19 | H9 | 116.4° | 114.6° |
| C21 | C20 | C19 | H10 | 116.4° | 114.6° |
| C21 | C20 | H9 | H10 | 129.7° | 131.3° |
| C20 | C21 | H11 | H12 | 130.0° | 131.3° |
| C20 | C21 | C18 | H25 | 95.1° | 89.1° |
| C21 | C20 | C19 | H26 | 99.9° | 140.0° |
| C21 | C20 | C19 | H27 | 132.7° | 89.1° |
| C13 | C14 | C22 | C15 | 179.1° | 180.0° |
| C13 | C14 | C22 | C17 | 178.7° | 179.5° |
| C14 | C13 | N3 | C12 | 170.0° | 180.0° |
| C13 | C14 | C15 | C16 | 178.9° | 180.0° |
| C14 | C13 | N3 | H1 | 10.0° | 0.0° |
| C13 | C14 | C15 | H8 | 1.1° | 0.2° |
| C13 | C14 | C22 | H13 | 1.3° | 0.0° |
| N3 | C13 | C14 | C22 | 141.7° | 180.0° |
| C13 | N3 | C12 | H1 | 180.0° | 180.0° |
| C13 | N3 | C12 | C11 | 106.3° | 180.0° |
| N3 | C13 | C14 | C15 | 39.2° | 0.0° |
| C13 | N3 | C12 | H22 | 13.5° | 60.0° |
| C13 | N3 | C12 | H23 | 134.0° | 60.0° |
| C14 | C22 | C17 | H13 | 180.0° | 179.6° |
| C14 | C22 | C17 | N5 | 176.0° | 179.8° |
| C14 | C22 | C17 | N4 | 0.9° | 0.7° |
| C22 | C14 | C15 | C16 | 0.2° | 0.0° |
| C22 | C14 | C15 | H8 | 179.8° | 179.7° |
| C22 | C17 | N5 | C18 | 179.6° | 0.5° |
| C22 | C17 | N5 | N4 | 177.1° | 179.5° |
| C17 | C22 | C14 | C15 | 0.4° | 0.5° |
| C22 | C17 | N4 | C16 | 1.1° | 0.5° |
| C22 | C17 | N5 | H34 | 57.7° | 179.6° |
| C18 | N5 | C17 | H34 | 122.0° | 180.0° |
| N5 | C18 | C19 | H25 | 128.9° | 130.8° |
| C18 | N5 | C17 | N4 | 3.3° | 180.0° |
| N5 | C18 | C19 | C20 | 136.1° | 140.0° |
| N5 | C18 | C21 | H11 | 108.2° | 25.4° |
| N5 | C18 | C21 | H12 | 19.3° | 105.5° |
| N5 | C18 | C19 | H26 | 19.8° | 105.5° |
| N5 | C18 | C19 | H27 | 107.5° | 25.5° |
| C17 | N5 | C18 | C19 | 102.8° | 107.5° |
| N5 | C17 | N4 | C16 | 175.8° | 180.0° |
| N5 | C17 | C22 | H13 | 4.0° | 0.2° |
| C17 | N5 | C18 | H25 | 25.4° | 23.7° |
| N3 | C12 | C11 | H22 | 119.7° | 120.0° |
| N3 | C12 | C11 | H23 | 119.7° | 120.0° |
| N3 | C12 | C11 | O1 | 175.4° | 60.0° |
| N3 | C12 | C11 | C10 | 53.3° | 180.0° |
| N3 | C12 | C11 | H21 | 65.8° | 60.0° |
| N3 | C12 | H22 | H23 | 120.8° | 120.0° |
| C12 | C11 | O1 | C10 | 124.1° | 120.0° |
| C12 | C11 | O1 | H21 | 118.0° | 120.0° |
| C12 | C11 | C10 | H21 | 119.2° | 120.0° |
| C12 | C11 | C10 | N2 | 175.4° | 175.0° |
| C11 | C12 | N3 | H1 | 73.8° | 0.0° |
| C12 | C11 | C10 | H6 | 55.0° | 55.0° |
| C12 | C11 | C10 | H7 | 64.2° | 65.0° |
| C11 | C12 | H22 | H23 | 120.7° | 120.0° |
| C12 | C11 | O1 | H35 | 180.0° | 60.0° |
| O1 | C11 | C10 | H21 | 118.7° | 120.0° |
| O1 | C11 | C10 | N2 | 62.5° | 65.1° |
| O1 | C11 | C10 | H6 | 177.2° | 175.0° |
| O1 | C11 | C10 | H7 | 57.9° | 54.9° |
| O1 | C11 | C12 | H22 | 55.6° | 180.0° |
| O1 | C11 | C12 | H23 | 64.9° | 60.0° |
| C14 | C15 | C16 | H8 | 180.0° | 179.8° |
| C14 | C15 | C16 | N4 | 0.4° | 0.2° |
| C15 | C14 | C22 | H13 | 179.6° | 179.9° |
| C14 | C15 | C16 | H24 | 179.6° | 179.8° |
| C18 | C19 | C20 | H26 | 116.3° | 114.6° |
| C18 | C19 | C20 | H27 | 116.3° | 114.6° |
| C18 | C19 | C20 | H9 | 100.0° | 89.1° |
| C18 | C19 | C20 | H10 | 132.8° | 140.1° |
| C19 | C18 | C21 | H11 | 132.6° | 89.1° |
| C19 | C18 | C21 | H12 | 100.0° | 140.0° |
| C18 | C19 | H26 | H27 | 129.8° | 131.3° |
| C19 | C18 | N5 | H34 | 19.2° | 72.5° |
| C11 | C10 | N2 | H6 | 120.4° | 120.0° |
| C11 | C10 | N2 | H7 | 120.4° | 120.0° |
| C11 | C10 | N2 | C23 | 161.9° | 170.0° |
| C11 | C10 | N2 | C9 | 75.6° | 66.9° |
| C11 | C10 | H6 | H7 | 118.9° | 120.0° |
| C10 | C11 | C12 | H22 | 66.5° | 60.0° |
| C10 | C11 | C12 | H23 | 173.0° | 60.0° |
| C10 | C11 | O1 | H35 | 55.9° | 60.0° |
| C10 | N2 | C23 | C24 | 168.6° | 165.1° |
| C10 | N2 | C23 | C9 | 123.4° | 123.4° |
| C10 | N2 | C9 | C8 | 167.4° | 176.0° |
| N2 | C10 | H6 | H7 | 118.9° | 120.0° |
| N2 | C10 | C11 | H21 | 56.2° | 55.0° |
| C10 | N2 | C23 | H29 | 48.3° | 45.6° |
| C10 | N2 | C23 | H30 | 71.2° | 75.1° |
| C10 | N2 | C9 | H31 | 71.9° | 55.7° |
| C10 | N2 | C9 | H32 | 46.7° | 63.8° |
| C24 | C23 | N2 | H29 | 120.2° | 119.4° |
| C24 | C23 | N2 | H30 | 120.2° | 119.8° |
| C23 | C24 | C25 | H14 | 120.0° | 120.2° |
| C23 | C24 | C25 | H15 | 120.0° | 120.0° |
| C24 | C23 | N2 | C9 | 68.1° | 71.5° |
| C23 | C24 | C25 | C26 | 154.8° | 163.1° |
| C23 | C24 | C25 | C8 | 24.7° | 17.5° |
| C23 | C24 | H14 | H15 | 120.1° | 119.8° |
| C24 | C23 | H29 | H30 | 119.4° | 120.4° |
| N2 | C23 | C24 | C25 | 56.4° | 50.8° |
| C23 | N2 | C9 | C8 | 44.5° | 52.5° |
| C23 | N2 | C10 | H6 | 77.7° | 70.0° |
| C23 | N2 | C10 | H7 | 41.6° | 50.0° |
| N2 | C23 | C24 | H14 | 176.4° | 171.0° |
| N2 | C23 | C24 | H15 | 63.6° | 69.2° |
| N2 | C23 | H29 | H30 | 119.4° | 120.9° |
| C23 | N2 | C9 | H31 | 165.1° | 67.7° |
| C23 | N2 | C9 | H32 | 76.2° | 172.8° |
| C17 | N4 | C16 | C15 | 0.9° | 0.0° |
| N4 | C17 | C22 | H13 | 179.1° | 179.7° |
| C17 | N4 | C16 | H24 | 179.1° | 180.0° |
| N4 | C17 | N5 | H34 | 125.3° | 0.0° |
| C19 | C20 | H9 | H10 | 129.6° | 131.2° |
| C19 | C20 | C21 | H11 | 132.7° | 89.1° |
| C19 | C20 | C21 | H12 | 99.8° | 140.0° |
| C20 | C19 | C18 | H25 | 95.0° | 89.2° |
| C20 | C19 | H26 | H27 | 129.8° | 131.2° |
| C24 | C25 | C26 | C8 | 179.6° | 179.4° |
| C24 | C25 | C8 | C9 | 4.5° | 0.9° |
| C24 | C25 | C26 | C5 | 180.0° | 179.8° |
| C24 | C25 | C8 | C7 | 178.0° | 179.4° |
| C25 | C24 | H14 | H15 | 120.1° | 119.8° |
| C24 | C25 | C26 | H16 | 0.1° | 0.5° |
| C25 | C24 | C23 | H29 | 176.6° | 170.2° |
| C25 | C24 | C23 | H30 | 63.8° | 69.3° |
| N2 | C9 | C8 | C25 | 13.9° | 17.6° |
| N2 | C9 | C8 | H31 | 120.7° | 120.3° |
| N2 | C9 | C8 | H32 | 120.7° | 120.3° |
| N2 | C9 | C8 | C7 | 168.6° | 162.7° |
| C9 | N2 | C10 | H6 | 44.7° | 53.1° |
| C9 | N2 | C10 | H7 | 164.0° | 173.0° |
| C9 | N2 | C23 | H29 | 171.7° | 169.1° |
| C9 | N2 | C23 | H30 | 52.1° | 48.3° |
| N2 | C9 | H31 | H32 | 118.0° | 119.5° |
| C15 | C16 | N4 | H24 | 180.0° | 179.9° |
| N4 | C16 | C15 | H8 | 179.6° | 180.0° |
| C26 | C25 | C8 | C9 | 175.1° | 179.7° |
| C25 | C26 | C5 | H16 | 180.0° | 179.7° |
| C26 | C25 | C8 | C7 | 2.4° | 0.0° |
| C25 | C26 | C5 | O | 171.3° | 179.7° |
| C25 | C26 | C5 | C6 | 2.1° | 0.6° |
| C26 | C25 | C24 | H14 | 34.8° | 42.9° |
| C26 | C25 | C24 | H15 | 85.2° | 77.0° |
| C25 | C8 | C9 | C7 | 177.4° | 179.7° |
| C8 | C25 | C26 | C5 | 0.4° | 0.4° |
| C25 | C8 | C7 | C6 | 2.0° | 0.1° |
| C25 | C8 | C7 | H5 | 178.0° | 179.8° |
| C8 | C25 | C24 | H14 | 144.7° | 137.7° |
| C8 | C25 | C24 | H15 | 95.2° | 102.4° |
| C8 | C25 | C26 | H16 | 179.6° | 179.9° |
| C25 | C8 | C9 | H31 | 134.6° | 102.7° |
| C25 | C8 | C9 | H32 | 106.8° | 137.9° |
| C9 | C8 | C7 | C6 | 175.5° | 179.6° |
| C9 | C8 | C7 | H5 | 4.5° | 0.5° |
| C8 | C9 | H31 | H32 | 118.0° | 119.5° |
| C26 | C5 | O | C6 | 173.8° | 179.7° |
| C26 | C5 | O | C4 | 3.2° | 179.7° |
| C26 | C5 | C6 | C7 | 2.5° | 0.4° |
| C26 | C5 | C6 | H4 | 177.5° | 179.7° |
| C8 | C7 | C6 | C5 | 0.5° | 0.1° |
| C8 | C7 | C6 | H5 | 180.0° | 179.9° |
| C8 | C7 | C6 | H4 | 179.5° | 180.0° |
| C7 | C8 | C9 | H31 | 48.0° | 77.0° |
| C7 | C8 | C9 | H32 | 70.7° | 42.4° |
| C5 | O | C4 | C3 | 172.5° | 180.0° |
| O | C5 | C6 | C7 | 171.6° | 179.9° |
| C5 | O | C4 | H2 | 53.1° | 60.0° |
| C5 | O | C4 | H3 | 68.0° | 60.0° |
| O | C5 | C6 | H4 | 8.4° | 0.1° |
| O | C5 | C26 | H16 | 8.7° | 0.0° |
| C6 | C5 | O | C4 | 170.6° | 0.0° |
| C5 | C6 | C7 | H4 | 180.0° | 179.9° |
| C5 | C6 | C7 | H5 | 179.5° | 180.0° |
| C6 | C5 | C26 | H16 | 177.9° | 179.7° |
| O | C4 | C3 | H2 | 119.4° | 120.0° |
| O | C4 | C3 | H3 | 119.5° | 120.0° |
| O | C4 | C3 | C2 | 87.6° | 0.1° |
| O | C4 | C3 | N | 89.3° | 180.0° |
| O | C4 | H2 | H3 | 121.7° | 120.0° |
| C4 | C3 | C2 | N | 177.4° | 180.0° |
| C4 | C3 | C2 | C1 | 177.0° | 180.0° |
| C4 | C3 | N | C | 3.8° | 0.0° |
| C4 | C3 | N | N1 | 177.0° | 179.9° |
| C3 | C4 | H2 | H3 | 121.6° | 120.1° |
| C4 | C3 | C2 | H28 | 3.0° | 0.1° |
| C3 | C2 | C1 | H28 | 180.0° | 180.0° |
| C2 | C3 | N | C | 178.8° | 180.0° |
| C2 | C3 | N | N1 | 0.4° | 0.0° |
| C3 | C2 | C1 | N1 | 0.2° | 0.0° |
| C2 | C3 | C4 | H2 | 31.9° | 120.0° |
| C2 | C3 | C4 | H3 | 153.0° | 119.9° |
| C3 | C2 | C1 | H20 | 179.8° | 180.0° |
| N | C3 | C2 | C1 | 0.4° | 0.0° |
| C3 | N | C | N1 | 179.2° | 179.9° |
| C3 | N | N1 | C1 | 0.3° | 0.0° |
| N | C3 | C4 | H2 | 151.2° | 60.0° |
| N | C3 | C4 | H3 | 30.1° | 60.0° |
| C3 | N | C | H17 | 179.2° | 90.0° |
| C3 | N | C | H18 | 59.2° | 29.9° |
| C3 | N | C | H19 | 60.8° | 150.0° |
| N | C3 | C2 | H28 | 179.6° | 179.9° |
| C2 | C1 | N1 | N | 0.0° | 0.0° |
| C2 | C1 | N1 | H20 | 180.0° | 180.0° |
| C | N | N1 | C1 | 179.1° | 180.0° |
| N | C | H17 | H18 | 120.0° | 120.0° |
| N | C | H17 | H19 | 120.0° | 120.0° |
| N | C | H18 | H19 | 120.0° | 120.1° |
| N1 | N | C | H17 | 0.0° | 90.0° |
| N1 | N | C | H18 | 120.0° | 150.0° |
| N1 | N | C | H19 | 120.0° | 30.0° |
| N | N1 | C1 | H20 | 180.0° | 180.0° |
| N1 | C1 | C2 | H28 | 179.8° | 180.0° |
| H1 | N3 | C12 | H22 | 166.5° | 120.0° |
| H1 | N3 | C12 | H23 | 46.0° | 120.0° |
| H4 | C6 | C7 | H5 | 0.5° | 0.1° |
| H6 | C10 | C11 | H21 | 64.1° | 65.0° |
| H7 | C10 | C11 | H21 | 176.6° | 175.0° |
| H8 | C15 | C16 | H24 | 0.4° | 0.0° |
| H9 | C20 | C21 | H11 | 16.3° | 156.4° |
| H9 | C20 | C21 | H12 | 143.8° | 25.4° |
| H9 | C20 | C19 | H26 | 143.7° | 25.4° |
| H9 | C20 | C19 | H27 | 16.3° | 156.3° |
| H10 | C20 | C21 | H11 | 110.9° | 25.4° |
| H10 | C20 | C21 | H12 | 16.5° | 105.5° |
| H10 | C20 | C19 | H26 | 16.5° | 105.4° |
| H10 | C20 | C19 | H27 | 110.9° | 25.5° |
| H11 | C21 | C18 | H25 | 21.2° | 156.3° |
| H12 | C21 | C18 | H25 | 148.7° | 25.4° |
| H14 | C24 | C23 | H29 | 63.4° | 69.7° |
| H14 | C24 | C23 | H30 | 56.1° | 50.8° |
| H15 | C24 | C23 | H29 | 56.6° | 50.2° |
| H15 | C24 | C23 | H30 | 176.2° | 170.7° |
| H17 | C | H18 | H19 | 120.0° | 120.0° |
| H20 | C1 | C2 | H28 | 0.2° | 0.0° |
| H21 | C11 | C12 | H22 | 174.4° | 60.0° |
| H21 | C11 | C12 | H23 | 53.9° | 180.0° |
| H21 | C11 | O1 | H35 | 62.0° | 180.0° |
| H25 | C18 | C19 | H26 | 148.7° | 25.4° |
| H25 | C18 | C19 | H27 | 21.4° | 156.3° |
| H25 | C18 | N5 | H34 | 147.4° | 156.3° |
