0V2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.36Å | 1.36Å | |
| C1 | C2 | sing | 1.39Å | 1.43Å | Aromatic |
| C2 | C3 | sing | 1.51Å | 1.49Å | |
| C2 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | N2 | sing | 1.47Å | 1.48Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| N2 | H6 | sing | 1.01Å | 1.00Å | |
| C5 | N2 | sing | 1.47Å | 1.48Å | |
| C5 | C6 | sing | 1.53Å | 1.56Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | C7 | sing | 1.53Å | 1.56Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | C8 | sing | 1.53Å | 1.56Å | |
| C9 | H15 | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.47Å | 1.37Å | |
| C24 | C9 | sing | 1.53Å | 1.56Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | C6 | sing | 1.53Å | 1.56Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | N5 | sing | 1.36Å | 1.34Å | Aromatic |
| C27 | C26 | sing | 1.41Å | 1.39Å | Aromatic |
| C27 | N3 | sing | 1.39Å | 1.34Å | Aromatic |
| N3 | C28 | sing | 1.37Å | 1.34Å | Aromatic |
| N3 | H21 | sing | 0.97Å | 1.00Å | |
| C28 | N4 | sing | 1.38Å | 1.40Å | |
| N4 | C29 | sing | 1.46Å | 1.48Å | |
| N4 | H22 | sing | 0.97Å | 1.00Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| N5 | C28 | doub | 1.31Å | 1.35Å | Aromatic |
| C30 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C30 | H27 | sing | 1.08Å | 1.08Å | |
| C40 | C1 | doub | 1.42Å | 1.43Å | Aromatic |
| C40 | C30 | sing | 1.39Å | 1.42Å | Aromatic |
| C41 | C40 | sing | 1.47Å | 1.41Å | |
| O1 | C41 | doub | 1.22Å | 1.25Å | |
| N6 | C42 | sing | 1.37Å | 1.35Å | |
| N6 | C41 | sing | 1.35Å | 1.36Å | |
| C42 | N1 | doub | 1.31Å | 1.35Å | |
| N7 | C42 | sing | 1.37Å | 1.39Å | |
| N7 | H28 | sing | 0.97Å | 1.00Å | |
| N7 | H29 | sing | 0.97Å | 1.00Å | |
| C10 | C11 | trip | 1.17Å | 1.19Å | |
| C11 | C12 | sing | 1.43Å | 1.30Å | |
| C12 | C13 | sing | 1.40Å | 1.41Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.41Å | Aromatic |
| C13 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | sing | 1.40Å | 1.41Å | Aromatic |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C15 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C15 | C18 | sing | 1.48Å | 1.41Å | |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | H30 | sing | 1.08Å | 1.08Å | |
| C17 | C12 | doub | 1.40Å | 1.41Å | Aromatic |
| C17 | H31 | sing | 1.08Å | 1.08Å | |
| C18 | C19 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C19 | H26 | sing | 1.08Å | 1.08Å | |
| C20 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | H32 | sing | 1.08Å | 1.08Å | |
| C21 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
| C21 | H33 | sing | 1.08Å | 1.08Å | |
| C22 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | H34 | sing | 1.08Å | 1.08Å | |
| C23 | C18 | doub | 1.39Å | 1.41Å | Aromatic |
| C23 | H35 | sing | 1.08Å | 1.08Å | |
| N6 | H351 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | C2 | 120.9° | 121.2° |
| N1 | C1 | C40 | 118.7° | 119.0° |
| C1 | N1 | C42 | 122.2° | 121.5° |
| C1 | C2 | C3 | 123.0° | 120.2° |
| C1 | C2 | C26 | 117.5° | 119.6° |
| C2 | C1 | C40 | 120.4° | 119.8° |
| C3 | C2 | C26 | 119.5° | 120.2° |
| C2 | C3 | C4 | 112.1° | 109.5° |
| C2 | C3 | H2 | 108.8° | 109.5° |
| C2 | C3 | H3 | 108.8° | 109.5° |
| C2 | C26 | N5 | 130.1° | 132.8° |
| C2 | C26 | C27 | 121.7° | 120.2° |
| C4 | C3 | H2 | 108.8° | 109.5° |
| C4 | C3 | H3 | 108.8° | 109.5° |
| C3 | C4 | N2 | 110.7° | 109.5° |
| C3 | C4 | H4 | 109.2° | 109.5° |
| C3 | C4 | H5 | 109.2° | 109.5° |
| H2 | C3 | H3 | 109.5° | 109.4° |
| N2 | C4 | H4 | 109.2° | 109.4° |
| N2 | C4 | H5 | 109.2° | 109.5° |
| C4 | N2 | H6 | 108.0° | 111.0° |
| C4 | N2 | C5 | 115.4° | 111.0° |
| H4 | C4 | H5 | 109.5° | 109.4° |
| H6 | N2 | C5 | 107.9° | 111.0° |
| N2 | C5 | C6 | 110.5° | 109.5° |
| N2 | C5 | H8 | 109.2° | 109.5° |
| N2 | C5 | H9 | 109.2° | 109.5° |
| C6 | C5 | H8 | 109.2° | 109.4° |
| C6 | C5 | H9 | 109.2° | 109.5° |
| C5 | C6 | C7 | 112.5° | 109.5° |
| C5 | C6 | H10 | 107.6° | 109.5° |
| C5 | C6 | C25 | 110.5° | 109.5° |
| H8 | C5 | H9 | 109.5° | 109.5° |
| C7 | C6 | H10 | 107.5° | 109.4° |
| C6 | C7 | C8 | 112.2° | 109.5° |
| C6 | C7 | H11 | 108.8° | 109.5° |
| C6 | C7 | H12 | 108.8° | 109.4° |
| C7 | C6 | C25 | 110.9° | 109.5° |
| H10 | C6 | C25 | 107.6° | 109.4° |
| C8 | C7 | H11 | 108.8° | 109.5° |
| C8 | C7 | H12 | 108.8° | 109.5° |
| C7 | C8 | H13 | 109.0° | 109.5° |
| C7 | C8 | H14 | 109.0° | 109.5° |
| C7 | C8 | C9 | 111.5° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.5° |
| H13 | C8 | H14 | 109.5° | 109.5° |
| H13 | C8 | C9 | 108.9° | 109.5° |
| H14 | C8 | C9 | 109.0° | 109.5° |
| C8 | C9 | H15 | 107.3° | 109.5° |
| C8 | C9 | C10 | 110.8° | 109.5° |
| C8 | C9 | C24 | 111.2° | 109.5° |
| H15 | C9 | C10 | 109.8° | 109.5° |
| H15 | C9 | C24 | 107.3° | 109.4° |
| C10 | C9 | C24 | 110.3° | 109.5° |
| C9 | C10 | C11 | 179.4° | 180.0° |
| C9 | C24 | H17 | 109.0° | 109.5° |
| C9 | C24 | H18 | 109.0° | 109.5° |
| C9 | C24 | C25 | 111.3° | 109.5° |
| H17 | C24 | H18 | 109.5° | 109.4° |
| H17 | C24 | C25 | 109.0° | 109.5° |
| H18 | C24 | C25 | 109.0° | 109.4° |
| C6 | C25 | C24 | 112.5° | 109.5° |
| C6 | C25 | H19 | 108.7° | 109.5° |
| C6 | C25 | H20 | 108.7° | 109.4° |
| C24 | C25 | H19 | 108.7° | 109.5° |
| C24 | C25 | H20 | 108.7° | 109.4° |
| H19 | C25 | H20 | 109.5° | 109.5° |
| N5 | C26 | C27 | 108.2° | 107.0° |
| C26 | N5 | C28 | 106.4° | 109.8° |
| C26 | C27 | N3 | 107.6° | 106.0° |
| C26 | C27 | C30 | 121.8° | 120.5° |
| C27 | N3 | C28 | 107.2° | 107.2° |
| C27 | N3 | H21 | 126.4° | 126.4° |
| N3 | C27 | C30 | 130.6° | 133.5° |
| C28 | N3 | H21 | 126.4° | 126.4° |
| N3 | C28 | N4 | 125.4° | 125.0° |
| N3 | C28 | N5 | 110.6° | 110.0° |
| C28 | N4 | C29 | 112.4° | 120.0° |
| C28 | N4 | H22 | 108.8° | 120.0° |
| N4 | C28 | N5 | 124.0° | 125.0° |
| C29 | N4 | H22 | 108.7° | 120.0° |
| N4 | C29 | H23 | 109.5° | 109.5° |
| N4 | C29 | H24 | 109.4° | 109.5° |
| N4 | C29 | H25 | 109.5° | 109.5° |
| H23 | C29 | H24 | 109.5° | 109.4° |
| H23 | C29 | H25 | 109.4° | 109.5° |
| H24 | C29 | H25 | 109.5° | 109.5° |
| C27 | C30 | H27 | 120.9° | 120.2° |
| C27 | C30 | C40 | 118.3° | 119.6° |
| H27 | C30 | C40 | 120.8° | 120.2° |
| C1 | C40 | C30 | 120.3° | 120.3° |
| C1 | C40 | C41 | 117.4° | 118.1° |
| C30 | C40 | C41 | 122.3° | 121.5° |
| C40 | C41 | O1 | 122.4° | 121.2° |
| C40 | C41 | N6 | 120.2° | 117.7° |
| O1 | C41 | N6 | 117.4° | 121.2° |
| C42 | N6 | C41 | 121.5° | 120.6° |
| N6 | C42 | N1 | 120.0° | 123.1° |
| N6 | C42 | N7 | 119.9° | 118.5° |
| C42 | N6 | H351 | 119.2° | 119.7° |
| C41 | N6 | H351 | 119.3° | 119.7° |
| N1 | C42 | N7 | 120.0° | 118.4° |
| C42 | N7 | H28 | 120.0° | 120.0° |
| C42 | N7 | H29 | 120.0° | 120.0° |
| H28 | N7 | H29 | 120.0° | 120.0° |
| C10 | C11 | C12 | 179.5° | 180.0° |
| C11 | C12 | C13 | 120.2° | 120.0° |
| C11 | C12 | C17 | 120.0° | 120.0° |
| C12 | C13 | C14 | 120.0° | 120.0° |
| C12 | C13 | H7 | 120.0° | 120.0° |
| C13 | C12 | C17 | 119.8° | 119.9° |
| C14 | C13 | H7 | 120.0° | 120.0° |
| C13 | C14 | C15 | 120.5° | 120.0° |
| C13 | C14 | H16 | 119.7° | 120.0° |
| C15 | C14 | H16 | 119.8° | 120.0° |
| C14 | C15 | C16 | 119.1° | 120.0° |
| C14 | C15 | C18 | 120.4° | 120.0° |
| C16 | C15 | C18 | 120.5° | 120.0° |
| C15 | C16 | C17 | 120.6° | 120.0° |
| C15 | C16 | H30 | 119.7° | 120.0° |
| C15 | C18 | C19 | 120.5° | 120.2° |
| C15 | C18 | C23 | 120.5° | 120.1° |
| C17 | C16 | H30 | 119.7° | 120.0° |
| C16 | C17 | C12 | 120.0° | 120.0° |
| C16 | C17 | H31 | 120.0° | 120.0° |
| C12 | C17 | H31 | 120.0° | 120.0° |
| C18 | C19 | C20 | 120.5° | 119.9° |
| C18 | C19 | H26 | 119.8° | 120.0° |
| C19 | C18 | C23 | 119.0° | 119.7° |
| C20 | C19 | H26 | 119.8° | 120.0° |
| C19 | C20 | C21 | 120.0° | 120.1° |
| C19 | C20 | H32 | 120.0° | 120.0° |
| C21 | C20 | H32 | 120.0° | 119.9° |
| C20 | C21 | C22 | 120.1° | 120.3° |
| C20 | C21 | H33 | 119.9° | 119.8° |
| C22 | C21 | H33 | 120.0° | 119.9° |
| C21 | C22 | C23 | 120.0° | 120.1° |
| C21 | C22 | H34 | 120.0° | 119.9° |
| C23 | C22 | H34 | 120.0° | 119.9° |
| C22 | C23 | C18 | 120.5° | 119.9° |
| C22 | C23 | H35 | 119.8° | 120.0° |
| C18 | C23 | H35 | 119.8° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | C2 | C40 | 179.2° | 179.9° |
| N1 | C1 | C2 | C3 | 1.1° | 0.0° |
| N1 | C1 | C2 | C26 | 179.1° | 180.0° |
| N1 | C1 | C40 | C30 | 179.5° | 179.9° |
| N1 | C1 | C40 | C41 | 0.1° | 0.0° |
| C1 | N1 | C42 | N6 | 0.3° | 0.0° |
| C1 | N1 | C42 | N7 | 179.4° | 180.0° |
| C1 | C2 | C3 | C26 | 177.9° | 180.0° |
| C1 | C2 | C3 | C4 | 89.6° | 90.0° |
| C1 | C2 | C3 | H2 | 30.8° | 150.0° |
| C1 | C2 | C3 | H3 | 150.0° | 30.0° |
| C1 | C2 | C26 | N5 | 178.6° | 180.0° |
| C1 | C2 | C26 | C27 | 0.2° | 0.1° |
| C2 | C1 | C40 | C30 | 0.3° | 0.0° |
| C2 | C1 | C40 | C41 | 179.3° | 179.9° |
| C2 | C1 | N1 | C42 | 179.0° | 180.0° |
| C2 | C3 | C4 | H2 | 120.4° | 120.0° |
| C2 | C3 | C4 | H3 | 120.4° | 120.1° |
| C2 | C3 | H2 | H3 | 118.8° | 120.0° |
| C2 | C3 | C4 | N2 | 58.9° | 180.0° |
| C2 | C3 | C4 | H4 | 179.1° | 60.0° |
| C2 | C3 | C4 | H5 | 61.3° | 59.9° |
| C3 | C2 | C26 | N5 | 0.5° | 0.0° |
| C3 | C2 | C26 | C27 | 178.2° | 179.9° |
| C3 | C2 | C1 | C40 | 178.1° | 180.0° |
| C26 | C2 | C3 | C4 | 88.3° | 90.0° |
| C26 | C2 | C3 | H2 | 151.3° | 30.0° |
| C26 | C2 | C3 | H3 | 32.1° | 150.0° |
| C2 | C26 | N5 | C27 | 178.9° | 179.9° |
| C2 | C26 | C27 | N3 | 179.2° | 180.0° |
| C2 | C26 | N5 | C28 | 178.5° | 180.0° |
| C2 | C26 | C27 | C30 | 0.1° | 0.0° |
| C26 | C2 | C1 | C40 | 0.1° | 0.0° |
| C4 | C3 | H2 | H3 | 118.8° | 120.0° |
| C3 | C4 | N2 | H4 | 120.2° | 120.0° |
| C3 | C4 | N2 | H5 | 120.2° | 120.1° |
| C3 | C4 | H4 | H5 | 119.4° | 120.0° |
| C3 | C4 | N2 | H6 | 56.4° | 56.1° |
| C3 | C4 | N2 | C5 | 177.2° | 180.0° |
| H2 | C3 | C4 | N2 | 61.5° | 60.0° |
| H2 | C3 | C4 | H4 | 58.7° | 180.0° |
| H2 | C3 | C4 | H5 | 178.3° | 60.1° |
| H3 | C3 | C4 | N2 | 179.3° | 60.0° |
| H3 | C3 | C4 | H4 | 60.5° | 60.0° |
| H3 | C3 | C4 | H5 | 59.1° | 180.0° |
| N2 | C4 | H4 | H5 | 119.4° | 120.0° |
| C4 | N2 | H6 | C5 | 125.4° | 123.9° |
| C4 | N2 | C5 | C6 | 178.1° | 180.0° |
| C4 | N2 | C5 | H8 | 61.8° | 60.0° |
| C4 | N2 | C5 | H9 | 57.9° | 60.0° |
| H4 | C4 | N2 | H6 | 176.6° | 176.1° |
| H4 | C4 | N2 | C5 | 62.6° | 60.0° |
| H5 | C4 | N2 | H6 | 63.8° | 64.0° |
| H5 | C4 | N2 | C5 | 57.1° | 59.9° |
| H6 | N2 | C5 | C6 | 57.2° | 56.1° |
| H6 | N2 | C5 | H8 | 177.4° | 176.0° |
| H6 | N2 | C5 | H9 | 63.0° | 63.9° |
| N2 | C5 | C6 | H8 | 120.2° | 120.0° |
| N2 | C5 | C6 | H9 | 120.2° | 120.0° |
| N2 | C5 | H8 | H9 | 119.5° | 120.1° |
| N2 | C5 | C6 | C7 | 59.5° | 175.0° |
| N2 | C5 | C6 | H10 | 58.8° | 55.0° |
| N2 | C5 | C6 | C25 | 176.0° | 64.9° |
| C6 | C5 | H8 | H9 | 119.5° | 120.0° |
| C5 | C6 | C7 | H10 | 118.3° | 120.0° |
| C5 | C6 | C7 | C25 | 124.3° | 120.1° |
| C5 | C6 | H10 | C25 | 119.0° | 120.0° |
| C5 | C6 | C7 | C8 | 177.3° | 180.0° |
| C5 | C6 | C7 | H11 | 56.9° | 60.0° |
| C5 | C6 | C7 | H12 | 62.3° | 60.0° |
| C5 | C6 | C25 | C24 | 178.8° | 180.0° |
| C5 | C6 | C25 | H19 | 60.7° | 60.0° |
| C5 | C6 | C25 | H20 | 58.4° | 60.1° |
| H8 | C5 | C6 | C7 | 179.6° | 65.0° |
| H8 | C5 | C6 | H10 | 61.4° | 175.0° |
| H8 | C5 | C6 | C25 | 55.8° | 55.0° |
| H9 | C5 | C6 | C7 | 60.7° | 55.0° |
| H9 | C5 | C6 | H10 | 179.0° | 65.0° |
| H9 | C5 | C6 | C25 | 63.9° | 175.0° |
| C7 | C6 | H10 | C25 | 119.5° | 120.0° |
| C6 | C7 | C8 | H11 | 120.4° | 120.0° |
| C6 | C7 | C8 | H12 | 120.4° | 120.0° |
| C6 | C7 | H11 | H12 | 118.8° | 120.0° |
| C6 | C7 | C8 | H13 | 174.8° | 180.0° |
| C6 | C7 | C8 | H14 | 65.8° | 60.0° |
| C6 | C7 | C8 | C9 | 54.5° | 60.0° |
| C7 | C6 | C25 | C24 | 53.3° | 59.9° |
| C7 | C6 | C25 | H19 | 173.8° | 180.0° |
| C7 | C6 | C25 | H20 | 67.1° | 60.0° |
| H10 | C6 | C7 | C8 | 64.3° | 60.0° |
| H10 | C6 | C7 | H11 | 175.2° | 180.0° |
| H10 | C6 | C7 | H12 | 56.0° | 60.0° |
| H10 | C6 | C25 | C24 | 64.0° | 60.0° |
| H10 | C6 | C25 | H19 | 56.4° | 60.0° |
| H10 | C6 | C25 | H20 | 175.5° | 179.9° |
| C8 | C7 | H11 | H12 | 118.7° | 120.0° |
| C7 | C8 | H13 | H14 | 119.1° | 120.0° |
| C7 | C8 | H13 | C9 | 121.9° | 120.0° |
| C7 | C8 | H14 | C9 | 121.9° | 120.0° |
| C7 | C8 | C9 | H15 | 61.9° | 60.0° |
| C7 | C8 | C9 | C10 | 178.3° | 180.0° |
| C7 | C8 | C9 | C24 | 55.2° | 60.0° |
| C8 | C7 | C6 | C25 | 53.0° | 60.0° |
| H11 | C7 | C8 | H13 | 54.4° | 60.0° |
| H11 | C7 | C8 | H14 | 173.8° | 180.0° |
| H11 | C7 | C8 | C9 | 65.9° | 60.0° |
| H11 | C7 | C6 | C25 | 67.4° | 60.0° |
| H12 | C7 | C8 | H13 | 64.8° | 60.0° |
| H12 | C7 | C8 | H14 | 54.6° | 60.0° |
| H12 | C7 | C8 | C9 | 174.9° | 180.0° |
| H12 | C7 | C6 | C25 | 173.4° | 180.0° |
| H13 | C8 | H14 | C9 | 119.0° | 120.0° |
| H13 | C8 | C9 | H15 | 58.4° | 60.0° |
| H13 | C8 | C9 | C10 | 61.4° | 60.0° |
| H13 | C8 | C9 | C24 | 175.5° | 180.0° |
| H14 | C8 | C9 | H15 | 177.8° | 179.9° |
| H14 | C8 | C9 | C10 | 57.9° | 60.0° |
| H14 | C8 | C9 | C24 | 65.1° | 60.0° |
| C8 | C9 | H15 | C10 | 120.5° | 120.0° |
| C8 | C9 | H15 | C24 | 119.6° | 120.0° |
| C8 | C9 | C10 | C24 | 123.6° | 120.0° |
| C8 | C9 | C24 | H17 | 175.5° | 180.0° |
| C8 | C9 | C24 | H18 | 65.0° | 60.0° |
| C8 | C9 | C24 | C25 | 55.3° | 60.0° |
| C8 | C9 | C10 | C11 | 88.5° | 75.4° |
| H15 | C9 | C10 | C24 | 118.1° | 120.0° |
| H15 | C9 | C24 | H17 | 58.4° | 60.0° |
| H15 | C9 | C24 | H18 | 177.9° | 180.0° |
| H15 | C9 | C24 | C25 | 61.8° | 60.0° |
| H15 | C9 | C10 | C11 | 153.1° | 164.5° |
| C10 | C9 | C24 | H17 | 61.1° | 60.0° |
| C10 | C9 | C24 | H18 | 58.3° | 60.0° |
| C10 | C9 | C24 | C25 | 178.6° | 180.0° |
| C9 | C10 | C11 | C12 | 27.2° | 153.8° |
| C9 | C24 | H17 | H18 | 119.2° | 120.0° |
| C9 | C24 | H17 | C25 | 121.7° | 120.1° |
| C9 | C24 | H18 | C25 | 121.7° | 120.0° |
| C9 | C24 | C25 | C6 | 54.8° | 60.0° |
| C9 | C24 | C25 | H19 | 175.3° | 180.0° |
| C9 | C24 | C25 | H20 | 65.6° | 60.0° |
| C24 | C9 | C10 | C11 | 35.1° | 44.6° |
| H17 | C24 | H18 | C25 | 119.2° | 120.0° |
| H17 | C24 | C25 | C6 | 175.1° | 180.0° |
| H17 | C24 | C25 | H19 | 64.5° | 60.0° |
| H17 | C24 | C25 | H20 | 54.6° | 60.1° |
| H18 | C24 | C25 | C6 | 65.5° | 60.1° |
| H18 | C24 | C25 | H19 | 55.0° | 60.0° |
| H18 | C24 | C25 | H20 | 174.1° | 180.0° |
| C6 | C25 | C24 | H19 | 120.4° | 120.0° |
| C6 | C25 | C24 | H20 | 120.5° | 119.9° |
| C6 | C25 | H19 | H20 | 118.6° | 120.0° |
| C24 | C25 | H19 | H20 | 118.6° | 120.0° |
| N5 | C26 | C27 | N3 | 0.2° | 0.0° |
| C26 | N5 | C28 | N3 | 0.9° | 0.0° |
| C26 | N5 | C28 | N4 | 178.5° | 180.0° |
| N5 | C26 | C27 | C30 | 179.1° | 180.0° |
| C26 | C27 | N3 | C30 | 179.2° | 179.9° |
| C26 | C27 | N3 | C28 | 0.7° | 0.1° |
| C26 | C27 | N3 | H21 | 179.3° | 179.9° |
| C27 | C26 | N5 | C28 | 0.4° | 0.0° |
| C26 | C27 | C30 | H27 | 179.6° | 180.0° |
| C26 | C27 | C30 | C40 | 0.5° | 0.0° |
| C27 | N3 | C28 | H21 | 180.0° | 179.9° |
| C27 | N3 | C28 | N4 | 178.3° | 180.0° |
| C27 | N3 | C28 | N5 | 1.0° | 0.1° |
| N3 | C27 | C30 | H27 | 1.4° | 0.1° |
| N3 | C27 | C30 | C40 | 178.6° | 179.9° |
| N3 | C28 | N4 | N5 | 179.2° | 179.9° |
| N3 | C28 | N4 | C29 | 88.2° | 0.0° |
| N3 | C28 | N4 | H22 | 151.4° | 180.0° |
| C28 | N3 | C27 | C30 | 178.5° | 180.0° |
| H21 | N3 | C28 | N4 | 1.6° | 0.1° |
| H21 | N3 | C28 | N5 | 179.0° | 179.9° |
| H21 | N3 | C27 | C30 | 1.5° | 0.1° |
| C28 | N4 | C29 | H22 | 120.4° | 180.0° |
| C28 | N4 | C29 | H23 | 180.0° | 60.0° |
| C28 | N4 | C29 | H24 | 60.0° | 60.0° |
| C28 | N4 | C29 | H25 | 60.0° | 180.0° |
| N4 | C29 | H23 | H24 | 120.0° | 120.0° |
| N4 | C29 | H23 | H25 | 120.0° | 120.1° |
| N4 | C29 | H24 | H25 | 120.0° | 120.1° |
| C29 | N4 | C28 | N5 | 91.0° | 180.0° |
| H22 | N4 | C29 | H23 | 59.5° | 120.0° |
| H22 | N4 | C29 | H24 | 179.6° | 120.1° |
| H22 | N4 | C29 | H25 | 60.4° | 0.0° |
| H22 | N4 | C28 | N5 | 29.4° | 0.1° |
| H23 | C29 | H24 | H25 | 120.0° | 119.9° |
| C27 | C30 | H27 | C40 | 180.0° | 180.0° |
| C27 | C30 | C40 | C1 | 0.5° | 0.0° |
| C27 | C30 | C40 | C41 | 179.0° | 179.9° |
| H27 | C30 | C40 | C1 | 179.5° | 180.0° |
| H27 | C30 | C40 | C41 | 1.0° | 0.1° |
| C1 | C40 | C30 | C41 | 179.5° | 179.9° |
| C1 | C40 | C41 | O1 | 179.8° | 180.0° |
| C1 | C40 | C41 | N6 | 0.3° | 0.1° |
| C40 | C1 | N1 | C42 | 0.2° | 0.0° |
| C30 | C40 | C41 | O1 | 0.3° | 0.1° |
| C30 | C40 | C41 | N6 | 179.3° | 180.0° |
| C40 | C41 | O1 | N6 | 179.6° | 180.0° |
| C40 | C41 | N6 | C42 | 0.2° | 0.1° |
| C40 | C41 | N6 | H351 | 179.8° | 179.9° |
| O1 | C41 | N6 | C42 | 179.8° | 180.0° |
| O1 | C41 | N6 | H351 | 0.2° | 0.0° |
| C42 | N6 | C41 | H351 | 180.0° | 180.0° |
| N6 | C42 | N1 | N7 | 179.7° | 180.0° |
| N6 | C42 | N7 | H28 | 179.7° | 0.1° |
| N6 | C42 | N7 | H29 | 0.3° | 180.0° |
| C41 | N6 | C42 | N1 | 0.1° | 0.0° |
| C41 | N6 | C42 | N7 | 179.6° | 180.0° |
| N1 | C42 | N7 | H28 | 0.0° | 179.9° |
| N1 | C42 | N7 | H29 | 180.0° | 0.0° |
| N1 | C42 | N6 | H351 | 179.9° | 180.0° |
| C42 | N7 | H28 | H29 | 180.0° | 179.9° |
| N7 | C42 | N6 | H351 | 0.4° | 0.0° |
| C10 | C11 | C12 | C13 | 80.9° | 101.6° |
| C10 | C11 | C12 | C17 | 99.1° | 78.1° |
| C11 | C12 | C13 | C17 | 179.9° | 179.7° |
| C11 | C12 | C13 | C14 | 179.8° | 180.0° |
| C11 | C12 | C13 | H7 | 0.2° | 0.1° |
| C11 | C12 | C17 | C16 | 179.8° | 179.7° |
| C11 | C12 | C17 | H31 | 0.1° | 0.3° |
| C12 | C13 | C14 | H7 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.3° | 0.0° |
| C12 | C13 | C14 | H16 | 179.7° | 179.9° |
| C13 | C12 | C17 | C16 | 0.2° | 0.6° |
| C13 | C12 | C17 | H31 | 179.8° | 180.0° |
| C13 | C14 | C15 | H16 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 0.2° | 0.1° |
| C13 | C14 | C15 | C18 | 179.5° | 180.0° |
| C14 | C13 | C12 | C17 | 0.1° | 0.3° |
| H7 | C13 | C14 | C15 | 179.7° | 179.9° |
| H7 | C13 | C14 | H16 | 0.3° | 0.0° |
| H7 | C13 | C12 | C17 | 179.9° | 179.8° |
| C14 | C15 | C16 | C18 | 179.8° | 179.9° |
| C14 | C15 | C16 | C17 | 0.1° | 0.2° |
| C14 | C15 | C16 | H30 | 179.9° | 179.9° |
| C14 | C15 | C18 | C19 | 58.8° | 180.0° |
| C14 | C15 | C18 | C23 | 121.3° | 0.4° |
| H16 | C14 | C15 | C16 | 179.8° | 180.0° |
| H16 | C14 | C15 | C18 | 0.5° | 0.1° |
| C15 | C16 | C17 | H30 | 180.0° | 179.8° |
| C15 | C16 | C17 | C12 | 0.3° | 0.6° |
| C15 | C16 | C17 | H31 | 179.7° | 180.0° |
| C16 | C15 | C18 | C19 | 121.5° | 0.1° |
| C16 | C15 | C18 | C23 | 58.5° | 179.7° |
| C18 | C15 | C16 | C17 | 179.9° | 179.7° |
| C18 | C15 | C16 | H30 | 0.1° | 0.1° |
| C15 | C18 | C19 | C23 | 179.9° | 179.6° |
| C15 | C18 | C19 | C20 | 179.8° | 180.0° |
| C15 | C18 | C19 | H26 | 0.2° | 0.2° |
| C15 | C18 | C23 | C22 | 179.8° | 179.8° |
| C15 | C18 | C23 | H35 | 0.2° | 0.3° |
| C16 | C17 | C12 | H31 | 180.0° | 179.4° |
| H30 | C16 | C17 | C12 | 179.7° | 179.6° |
| H30 | C16 | C17 | H31 | 0.3° | 0.2° |
| C18 | C19 | C20 | H26 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.3° | 0.1° |
| C18 | C19 | C20 | H32 | 179.7° | 180.0° |
| C19 | C18 | C23 | C22 | 0.2° | 0.6° |
| C19 | C18 | C23 | H35 | 179.8° | 180.0° |
| C19 | C20 | C21 | H32 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.2° | 0.1° |
| C19 | C20 | C21 | H33 | 179.8° | 180.0° |
| C20 | C19 | C18 | C23 | 0.1° | 0.3° |
| H26 | C19 | C20 | C21 | 179.7° | 180.0° |
| H26 | C19 | C20 | H32 | 0.3° | 0.1° |
| H26 | C19 | C18 | C23 | 179.9° | 179.8° |
| C20 | C21 | C22 | H33 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.2° | 0.4° |
| C20 | C21 | C22 | H34 | 179.8° | 180.0° |
| H32 | C20 | C21 | C22 | 179.8° | 179.9° |
| H32 | C20 | C21 | H33 | 0.2° | 0.1° |
| C21 | C22 | C23 | H34 | 180.0° | 179.7° |
| C21 | C22 | C23 | C18 | 0.4° | 0.6° |
| C21 | C22 | C23 | H35 | 179.6° | 179.9° |
| H33 | C21 | C22 | C23 | 179.9° | 179.7° |
| H33 | C21 | C22 | H34 | 0.2° | 0.1° |
| C22 | C23 | C18 | H35 | 180.0° | 179.5° |
| H34 | C22 | C23 | C18 | 179.6° | 179.7° |
| H34 | C22 | C23 | H35 | 0.4° | 0.3° |
