3X5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.48Å | 1.49Å | |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| N2 | C27 | sing | 1.34Å | 1.35Å | Aromatic |
| N2 | C28 | doub | 1.31Å | 1.35Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | C26 | doub | 1.35Å | 1.39Å | Aromatic |
| C28 | N3 | sing | 1.35Å | 1.35Å | Aromatic |
| O1 | C24 | doub | 1.21Å | 1.22Å | |
| C24 | C23 | sing | 1.51Å | 1.51Å | |
| C1 | C | sing | 1.48Å | 1.50Å | |
| C1 | C12 | doub | 1.40Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | N3 | sing | 1.37Å | 1.35Å | Aromatic |
| C26 | C25 | sing | 1.51Å | 1.51Å | |
| C23 | C25 | sing | 1.53Å | 1.52Å | |
| C23 | N1 | sing | 1.47Å | 1.48Å | |
| O | C | doub | 1.22Å | 1.22Å | |
| C | N | sing | 1.35Å | 1.33Å | |
| N1 | C22 | sing | 1.47Å | 1.47Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| N | C21 | sing | 1.47Å | 1.47Å | |
| N | C13 | sing | 1.47Å | 1.46Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C14 | C19 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C24 | H1 | sing | 1.08Å | 1.08Å | |
| C23 | H2 | sing | 1.09Å | 1.10Å | |
| C25 | H3 | sing | 1.09Å | 1.10Å | |
| C25 | H4 | sing | 1.09Å | 1.10Å | |
| N3 | H5 | sing | 0.97Å | 1.00Å | |
| C28 | H6 | sing | 1.08Å | 1.08Å | |
| C27 | H8 | sing | 1.08Å | 1.08Å | |
| N1 | H9 | sing | 1.01Å | 1.00Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C14 | H25 | sing | 1.09Å | 1.10Å | |
| C13 | H26 | sing | 1.09Å | 1.10Å | |
| C13 | H27 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.08Å | 1.08Å | |
| C11 | H29 | sing | 1.08Å | 1.08Å | |
| C3 | H30 | sing | 1.08Å | 1.08Å | |
| C2 | H31 | sing | 1.08Å | 1.08Å | |
| C10 | H32 | sing | 1.08Å | 1.08Å | |
| C9 | H33 | sing | 1.08Å | 1.08Å | |
| C8 | H34 | sing | 1.08Å | 1.08Å | |
| C7 | H35 | sing | 1.08Å | 1.08Å | |
| C6 | H36 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C9 | C8 | 120.0° | 120.1° |
| C9 | C10 | C5 | 120.0° | 119.9° |
| C9 | C10 | H32 | 120.0° | 120.0° |
| C10 | C9 | H33 | 120.0° | 120.0° |
| C9 | C8 | C7 | 120.0° | 120.2° |
| C8 | C9 | H33 | 120.0° | 119.9° |
| C9 | C8 | H34 | 120.0° | 119.8° |
| C10 | C5 | C4 | 120.0° | 120.1° |
| C10 | C5 | C6 | 119.9° | 119.8° |
| C5 | C10 | H32 | 120.0° | 120.1° |
| C8 | C7 | C6 | 120.0° | 120.2° |
| C7 | C8 | H34 | 120.0° | 119.9° |
| C8 | C7 | H35 | 120.0° | 119.9° |
| C2 | C3 | C4 | 120.0° | 120.0° |
| C3 | C2 | C1 | 120.0° | 120.0° |
| C2 | C3 | H30 | 120.0° | 120.0° |
| C3 | C2 | H31 | 120.0° | 120.0° |
| C3 | C4 | C5 | 120.0° | 120.0° |
| C3 | C4 | C11 | 120.0° | 120.1° |
| C4 | C3 | H30 | 120.0° | 120.0° |
| C4 | C5 | C6 | 120.0° | 120.1° |
| C5 | C4 | C11 | 120.0° | 120.0° |
| C5 | C6 | C7 | 120.0° | 119.8° |
| C5 | C6 | H36 | 120.0° | 120.1° |
| C6 | C7 | H35 | 120.0° | 119.9° |
| C7 | C6 | H36 | 120.0° | 120.1° |
| C27 | N2 | C28 | 108.2° | 109.3° |
| N2 | C27 | C26 | 107.4° | 107.9° |
| N2 | C27 | H8 | 126.3° | 126.0° |
| N2 | C28 | N3 | 108.7° | 108.7° |
| N2 | C28 | H6 | 125.6° | 125.6° |
| C2 | C1 | C | 120.0° | 120.0° |
| C2 | C1 | C12 | 120.0° | 119.9° |
| C1 | C2 | H31 | 120.0° | 120.0° |
| C4 | C11 | C12 | 120.0° | 120.0° |
| C4 | C11 | H29 | 120.0° | 120.0° |
| C27 | C26 | N3 | 107.5° | 106.9° |
| C27 | C26 | C25 | 126.2° | 126.6° |
| C26 | C27 | H8 | 126.3° | 126.1° |
| C28 | N3 | C26 | 108.1° | 107.2° |
| C28 | N3 | H5 | 125.9° | 126.4° |
| N3 | C28 | H6 | 125.7° | 125.7° |
| O1 | C24 | C23 | 120.5° | 120.0° |
| O1 | C24 | H1 | 119.8° | 120.0° |
| C24 | C23 | C25 | 109.4° | 109.5° |
| C24 | C23 | N1 | 109.5° | 109.5° |
| C23 | C24 | H1 | 119.7° | 120.0° |
| C24 | C23 | H2 | 109.3° | 109.5° |
| C | C1 | C12 | 120.0° | 120.1° |
| C1 | C | O | 119.4° | 120.1° |
| C1 | C | N | 118.8° | 120.0° |
| C1 | C12 | C11 | 120.0° | 120.0° |
| C1 | C12 | H28 | 120.0° | 120.0° |
| C11 | C12 | H28 | 120.0° | 120.0° |
| C12 | C11 | H29 | 120.0° | 120.0° |
| N3 | C26 | C25 | 126.3° | 126.6° |
| C26 | N3 | H5 | 125.9° | 126.4° |
| C26 | C25 | C23 | 109.5° | 109.5° |
| C26 | C25 | H3 | 109.5° | 109.5° |
| C26 | C25 | H4 | 109.4° | 109.5° |
| C25 | C23 | N1 | 109.5° | 109.5° |
| C25 | C23 | H2 | 109.2° | 109.5° |
| C23 | C25 | H3 | 109.4° | 109.5° |
| C23 | C25 | H4 | 109.5° | 109.4° |
| C23 | N1 | C22 | 109.5° | 111.0° |
| N1 | C23 | H2 | 109.9° | 109.5° |
| C23 | N1 | H9 | 109.5° | 111.0° |
| O | C | N | 121.8° | 120.0° |
| C | N | C21 | 119.7° | 120.7° |
| C | N | C13 | 125.7° | 120.7° |
| N1 | C22 | C21 | 109.5° | 109.5° |
| C22 | N1 | H9 | 109.5° | 111.0° |
| N1 | C22 | H11 | 109.5° | 109.5° |
| N1 | C22 | H12 | 109.5° | 109.5° |
| C22 | C21 | N | 107.5° | 109.6° |
| C22 | C21 | C20 | 110.2° | 109.6° |
| C21 | C22 | H11 | 109.5° | 109.5° |
| C21 | C22 | H12 | 109.5° | 109.4° |
| C22 | C21 | H13 | 110.4° | 109.6° |
| C21 | N | C13 | 114.7° | 118.6° |
| N | C21 | C20 | 106.9° | 108.7° |
| N | C21 | H13 | 111.3° | 109.7° |
| N | C13 | C14 | 105.4° | 108.9° |
| N | C13 | H26 | 110.5° | 109.6° |
| N | C13 | H27 | 110.5° | 109.7° |
| C21 | C20 | C19 | 111.5° | 109.4° |
| C20 | C21 | H13 | 110.4° | 109.6° |
| C21 | C20 | H14 | 109.0° | 109.5° |
| C21 | C20 | H15 | 109.0° | 109.5° |
| C13 | C14 | C19 | 109.9° | 109.3° |
| C13 | C14 | C15 | 110.2° | 109.2° |
| C13 | C14 | H25 | 108.6° | 109.7° |
| C14 | C13 | H26 | 110.5° | 109.6° |
| C14 | C13 | H27 | 110.5° | 109.6° |
| C20 | C19 | C14 | 110.0° | 109.5° |
| C20 | C19 | C18 | 110.3° | 109.2° |
| C19 | C20 | H14 | 109.0° | 109.5° |
| C19 | C20 | H15 | 108.9° | 109.5° |
| C20 | C19 | H16 | 108.6° | 109.5° |
| C19 | C14 | C15 | 110.7° | 109.5° |
| C14 | C19 | C18 | 110.6° | 109.5° |
| C14 | C19 | H16 | 108.7° | 109.6° |
| C19 | C14 | H25 | 108.7° | 109.5° |
| C14 | C15 | C16 | 110.6° | 109.6° |
| C14 | C15 | H23 | 109.2° | 109.4° |
| C14 | C15 | H24 | 109.2° | 109.4° |
| C15 | C14 | H25 | 108.6° | 109.5° |
| C19 | C18 | C17 | 110.7° | 109.6° |
| C18 | C19 | H16 | 108.6° | 109.5° |
| C19 | C18 | H17 | 109.2° | 109.4° |
| C19 | C18 | H18 | 109.2° | 109.4° |
| C15 | C16 | C17 | 111.4° | 109.4° |
| C15 | C16 | H21 | 109.0° | 109.5° |
| C15 | C16 | H22 | 109.0° | 109.5° |
| C16 | C15 | H23 | 109.2° | 109.5° |
| C16 | C15 | H24 | 109.2° | 109.5° |
| C18 | C17 | C16 | 111.4° | 109.4° |
| C17 | C18 | H17 | 109.2° | 109.5° |
| C17 | C18 | H18 | 109.2° | 109.5° |
| C18 | C17 | H19 | 109.0° | 109.5° |
| C18 | C17 | H20 | 109.0° | 109.4° |
| C16 | C17 | H19 | 109.0° | 109.5° |
| C16 | C17 | H20 | 109.0° | 109.5° |
| C17 | C16 | H21 | 109.0° | 109.5° |
| C17 | C16 | H22 | 109.0° | 109.5° |
| H3 | C25 | H4 | 109.5° | 109.4° |
| H11 | C22 | H12 | 109.4° | 109.5° |
| H14 | C20 | H15 | 109.5° | 109.5° |
| H17 | C18 | H18 | 109.4° | 109.5° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H23 | C15 | H24 | 109.5° | 109.4° |
| H26 | C13 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C9 | C8 | H33 | 180.0° | 180.0° |
| C9 | C10 | C5 | H32 | 180.0° | 179.9° |
| C10 | C9 | C8 | C7 | 0.1° | 0.1° |
| C9 | C10 | C5 | C4 | 180.0° | 180.0° |
| C9 | C10 | C5 | C6 | 0.0° | 0.3° |
| C10 | C9 | C8 | H34 | 179.9° | 180.0° |
| C8 | C9 | C10 | C5 | 0.0° | 0.1° |
| C9 | C8 | C7 | H34 | 180.0° | 179.9° |
| C9 | C8 | C7 | C6 | 0.1° | 0.3° |
| C8 | C9 | C10 | H32 | 180.0° | 179.9° |
| C9 | C8 | C7 | H35 | 179.9° | 179.9° |
| C10 | C5 | C4 | C3 | 20.6° | 179.7° |
| C10 | C5 | C4 | C6 | 180.0° | 179.7° |
| C10 | C5 | C6 | C7 | 0.0° | 0.6° |
| C10 | C5 | C4 | C11 | 159.4° | 0.3° |
| C5 | C10 | C9 | H33 | 180.0° | 180.0° |
| C10 | C5 | C6 | H36 | 180.0° | 179.8° |
| C8 | C7 | C6 | C5 | 0.0° | 0.6° |
| C8 | C7 | C6 | H35 | 180.0° | 179.7° |
| C7 | C8 | C9 | H33 | 180.0° | 179.9° |
| C8 | C7 | C6 | H36 | 180.0° | 179.8° |
| C2 | C3 | C4 | H30 | 180.0° | 179.4° |
| C2 | C3 | C4 | C5 | 180.0° | 179.7° |
| C3 | C2 | C1 | H31 | 180.0° | 179.4° |
| C2 | C3 | C4 | C11 | 0.1° | 0.4° |
| C3 | C2 | C1 | C | 180.0° | 179.7° |
| C3 | C2 | C1 | C12 | 0.0° | 0.6° |
| C3 | C4 | C5 | C11 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 159.4° | 0.0° |
| C4 | C3 | C2 | C1 | 0.1° | 0.6° |
| C3 | C4 | C11 | C12 | 0.0° | 0.1° |
| C3 | C4 | C11 | H29 | 180.0° | 180.0° |
| C4 | C3 | C2 | H31 | 179.9° | 180.0° |
| C4 | C5 | C6 | C7 | 180.0° | 179.7° |
| C5 | C4 | C11 | C12 | 180.0° | 180.0° |
| C5 | C4 | C11 | H29 | 0.0° | 0.0° |
| C5 | C4 | C3 | H30 | 0.0° | 0.3° |
| C4 | C5 | C10 | H32 | 0.0° | 0.1° |
| C4 | C5 | C6 | H36 | 0.0° | 0.1° |
| C5 | C6 | C7 | H36 | 180.0° | 179.6° |
| C6 | C5 | C4 | C11 | 20.6° | 180.0° |
| C6 | C5 | C10 | H32 | 180.0° | 179.8° |
| C5 | C6 | C7 | H35 | 179.9° | 179.7° |
| C6 | C7 | C8 | H34 | 179.9° | 179.8° |
| N2 | C27 | C26 | H8 | 180.0° | 179.6° |
| C27 | N2 | C28 | N3 | 0.1° | 0.3° |
| N2 | C27 | C26 | N3 | 0.0° | 0.4° |
| N2 | C27 | C26 | C25 | 180.0° | 179.9° |
| C27 | N2 | C28 | H6 | 179.9° | 179.8° |
| C28 | N2 | C27 | C26 | 0.0° | 0.4° |
| N2 | C28 | N3 | H6 | 180.0° | 179.9° |
| N2 | C28 | N3 | C26 | 0.1° | 0.1° |
| N2 | C28 | N3 | H5 | 180.0° | 180.0° |
| C28 | N2 | C27 | H8 | 180.0° | 179.9° |
| C2 | C1 | C | C12 | 180.0° | 179.7° |
| C2 | C1 | C12 | C11 | 0.0° | 0.3° |
| C2 | C1 | C | O | 76.2° | 49.4° |
| C2 | C1 | C | N | 103.8° | 130.7° |
| C2 | C1 | C12 | H28 | 180.0° | 179.8° |
| C1 | C2 | C3 | H30 | 179.9° | 180.0° |
| C4 | C11 | C12 | C1 | 0.0° | 0.1° |
| C4 | C11 | C12 | H29 | 180.0° | 179.9° |
| C4 | C11 | C12 | H28 | 180.0° | 180.0° |
| C11 | C4 | C3 | H30 | 179.9° | 179.7° |
| C27 | C26 | N3 | C28 | 0.0° | 0.2° |
| C27 | C26 | N3 | C25 | 180.0° | 179.8° |
| C27 | C26 | C25 | C23 | 30.7° | 85.3° |
| C27 | C26 | C25 | H3 | 150.7° | 154.7° |
| C27 | C26 | C25 | H4 | 89.3° | 34.7° |
| C27 | C26 | N3 | H5 | 180.0° | 179.7° |
| C28 | N3 | C26 | H5 | 180.0° | 179.9° |
| C28 | N3 | C26 | C25 | 180.0° | 180.0° |
| O1 | C24 | C23 | H1 | 180.0° | 179.8° |
| O1 | C24 | C23 | C25 | 143.6° | 120.0° |
| O1 | C24 | C23 | N1 | 23.6° | 0.0° |
| O1 | C24 | C23 | H2 | 96.8° | 120.0° |
| C24 | C23 | C25 | C26 | 81.9° | 175.0° |
| C24 | C23 | C25 | N1 | 120.0° | 120.0° |
| C24 | C23 | C25 | H2 | 119.7° | 120.0° |
| C24 | C23 | N1 | H2 | 120.1° | 120.0° |
| C24 | C23 | N1 | C22 | 169.7° | 85.0° |
| C24 | C23 | C25 | H3 | 38.1° | 65.0° |
| C24 | C23 | C25 | H4 | 158.1° | 55.0° |
| C24 | C23 | N1 | H9 | 49.7° | 39.0° |
| C | C1 | C12 | C11 | 180.0° | 180.0° |
| C1 | C | O | N | 180.0° | 180.0° |
| C1 | C | N | C21 | 153.7° | 176.4° |
| C1 | C | N | C13 | 26.3° | 3.5° |
| C | C1 | C12 | H28 | 0.0° | 0.1° |
| C | C1 | C2 | H31 | 0.0° | 0.4° |
| C1 | C12 | C11 | H28 | 180.0° | 179.9° |
| C12 | C1 | C | O | 103.7° | 130.3° |
| C12 | C1 | C | N | 76.2° | 49.6° |
| C1 | C12 | C11 | H29 | 180.0° | 180.0° |
| C12 | C1 | C2 | H31 | 180.0° | 180.0° |
| N3 | C26 | C25 | C23 | 149.3° | 95.0° |
| N3 | C26 | C25 | H3 | 29.3° | 25.0° |
| N3 | C26 | C25 | H4 | 90.7° | 145.0° |
| C26 | N3 | C28 | H6 | 179.9° | 179.9° |
| N3 | C26 | C27 | H8 | 179.9° | 180.0° |
| C26 | C25 | C23 | H3 | 120.0° | 120.0° |
| C26 | C25 | C23 | H4 | 120.0° | 120.0° |
| C26 | C25 | C23 | N1 | 158.1° | 65.0° |
| C26 | C25 | C23 | H2 | 37.7° | 55.0° |
| C26 | C25 | H3 | H4 | 120.0° | 120.0° |
| C25 | C26 | N3 | H5 | 0.0° | 0.0° |
| C25 | C26 | C27 | H8 | 0.0° | 0.2° |
| C25 | C23 | N1 | H2 | 119.9° | 120.0° |
| C25 | C23 | N1 | C22 | 70.3° | 154.9° |
| C25 | C23 | C24 | H1 | 36.4° | 59.7° |
| C23 | C25 | H3 | H4 | 120.0° | 120.0° |
| C25 | C23 | N1 | H9 | 169.7° | 81.0° |
| C23 | N1 | C22 | H9 | 120.0° | 124.0° |
| C23 | N1 | C22 | C21 | 151.4° | 180.0° |
| N1 | C23 | C24 | H1 | 156.4° | 179.7° |
| N1 | C23 | C25 | H3 | 81.9° | 55.0° |
| N1 | C23 | C25 | H4 | 38.1° | 175.0° |
| C23 | N1 | C22 | H11 | 88.6° | 60.0° |
| C23 | N1 | C22 | H12 | 31.4° | 60.1° |
| O | C | N | C21 | 26.4° | 3.6° |
| O | C | N | C13 | 153.7° | 176.5° |
| C | N | C21 | C22 | 124.3° | 114.0° |
| C | N | C21 | C13 | 180.0° | 179.9° |
| C | N | C21 | C20 | 117.4° | 126.2° |
| C | N | C13 | C14 | 114.1° | 126.3° |
| C | N | C21 | H13 | 3.2° | 6.4° |
| C | N | C13 | H26 | 126.6° | 6.5° |
| C | N | C13 | H27 | 5.3° | 113.8° |
| N1 | C22 | C21 | H11 | 120.0° | 120.1° |
| N1 | C22 | C21 | H12 | 120.0° | 120.0° |
| N1 | C22 | C21 | N | 155.7° | 55.7° |
| N1 | C22 | C21 | C20 | 88.1° | 175.0° |
| C22 | N1 | C23 | H2 | 49.6° | 34.9° |
| N1 | C22 | H11 | H12 | 120.0° | 120.0° |
| N1 | C22 | C21 | H13 | 34.1° | 64.7° |
| C22 | C21 | N | C20 | 118.3° | 119.8° |
| C22 | C21 | N | H13 | 121.0° | 120.4° |
| C22 | C21 | N | C13 | 55.7° | 66.1° |
| C22 | C21 | C20 | H13 | 122.2° | 120.3° |
| C22 | C21 | C20 | C19 | 62.3° | 65.0° |
| C21 | C22 | N1 | H9 | 31.4° | 56.0° |
| C21 | C22 | H11 | H12 | 120.0° | 120.0° |
| C22 | C21 | C20 | H14 | 177.4° | 175.0° |
| C22 | C21 | C20 | H15 | 58.0° | 54.9° |
| N | C21 | C20 | H13 | 121.2° | 119.9° |
| C21 | N | C13 | C14 | 65.9° | 53.6° |
| N | C21 | C20 | C19 | 54.2° | 54.8° |
| N | C21 | C22 | H11 | 84.3° | 175.8° |
| N | C21 | C22 | H12 | 35.7° | 64.2° |
| N | C21 | C20 | H14 | 66.1° | 65.3° |
| N | C21 | C20 | H15 | 174.5° | 174.7° |
| C21 | N | C13 | H26 | 53.4° | 173.5° |
| C21 | N | C13 | H27 | 174.7° | 66.3° |
| C13 | N | C21 | C20 | 62.6° | 53.7° |
| N | C13 | C14 | H26 | 119.3° | 119.8° |
| N | C13 | C14 | H27 | 119.3° | 120.0° |
| N | C13 | C14 | C19 | 60.8° | 54.5° |
| N | C13 | C14 | C15 | 176.9° | 174.3° |
| C13 | N | C21 | H13 | 176.7° | 173.6° |
| N | C13 | C14 | H25 | 58.0° | 65.6° |
| N | C13 | H26 | H27 | 121.9° | 120.4° |
| C21 | C20 | C19 | H14 | 120.3° | 120.0° |
| C21 | C20 | C19 | H15 | 120.3° | 120.0° |
| C21 | C20 | C19 | C14 | 54.4° | 61.3° |
| C21 | C20 | C19 | C18 | 176.7° | 178.8° |
| C20 | C21 | C22 | H11 | 31.9° | 65.0° |
| C20 | C21 | C22 | H12 | 151.8° | 55.0° |
| C21 | C20 | H14 | H15 | 119.1° | 120.0° |
| C21 | C20 | C19 | H16 | 64.4° | 58.9° |
| C13 | C14 | C19 | C20 | 57.7° | 61.1° |
| C13 | C14 | C19 | C15 | 122.0° | 119.6° |
| C13 | C14 | C19 | H25 | 118.8° | 120.3° |
| C13 | C14 | C15 | H25 | 118.9° | 120.2° |
| C13 | C14 | C19 | C18 | 179.8° | 179.2° |
| C13 | C14 | C15 | C16 | 178.9° | 179.5° |
| C13 | C14 | C19 | H16 | 61.0° | 59.1° |
| C13 | C14 | C15 | H23 | 58.8° | 60.4° |
| C13 | C14 | C15 | H24 | 60.9° | 59.4° |
| C14 | C13 | H26 | H27 | 121.9° | 120.2° |
| C20 | C19 | C14 | C18 | 122.1° | 119.7° |
| C20 | C19 | C14 | H16 | 118.7° | 120.2° |
| C20 | C19 | C14 | C15 | 179.7° | 179.3° |
| C20 | C19 | C18 | H16 | 118.9° | 119.9° |
| C20 | C19 | C18 | C17 | 179.0° | 179.8° |
| C19 | C20 | C21 | H13 | 175.4° | 174.7° |
| C19 | C20 | H14 | H15 | 119.1° | 120.0° |
| C20 | C19 | C18 | H17 | 58.8° | 59.7° |
| C20 | C19 | C18 | H18 | 60.8° | 60.2° |
| C20 | C19 | C14 | H25 | 61.0° | 59.2° |
| C19 | C14 | C15 | H25 | 119.3° | 120.2° |
| C14 | C19 | C18 | H16 | 119.2° | 120.1° |
| C19 | C14 | C15 | C16 | 57.1° | 59.8° |
| C14 | C19 | C18 | C17 | 57.1° | 59.8° |
| C14 | C19 | C20 | H14 | 65.9° | 58.7° |
| C14 | C19 | C20 | H15 | 174.7° | 178.8° |
| C14 | C19 | C18 | H17 | 63.1° | 60.2° |
| C14 | C19 | C18 | H18 | 177.3° | 179.9° |
| C19 | C14 | C15 | H23 | 63.0° | 179.9° |
| C19 | C14 | C15 | H24 | 177.3° | 60.2° |
| C19 | C14 | C13 | H26 | 58.5° | 174.3° |
| C19 | C14 | C13 | H27 | 179.8° | 65.5° |
| C15 | C14 | C19 | C18 | 58.2° | 59.6° |
| C14 | C15 | C16 | H23 | 120.2° | 120.0° |
| C14 | C15 | C16 | H24 | 120.2° | 120.0° |
| C14 | C15 | C16 | C17 | 55.4° | 60.1° |
| C15 | C14 | C19 | H16 | 61.0° | 60.5° |
| C14 | C15 | C16 | H21 | 175.7° | 59.9° |
| C14 | C15 | C16 | H22 | 64.9° | 179.9° |
| C14 | C15 | H23 | H24 | 119.5° | 119.9° |
| C15 | C14 | C13 | H26 | 63.8° | 65.9° |
| C15 | C14 | C13 | H27 | 57.6° | 54.3° |
| C19 | C18 | C17 | H17 | 120.2° | 120.0° |
| C19 | C18 | C17 | H18 | 120.2° | 120.0° |
| C19 | C18 | C17 | C16 | 55.4° | 60.1° |
| C18 | C19 | C20 | H14 | 56.4° | 61.2° |
| C18 | C19 | C20 | H15 | 63.0° | 58.8° |
| C19 | C18 | H17 | H18 | 119.5° | 119.9° |
| C19 | C18 | C17 | H19 | 175.7° | 179.9° |
| C19 | C18 | C17 | H20 | 64.9° | 59.9° |
| C18 | C19 | C14 | H25 | 61.0° | 60.6° |
| C15 | C16 | C17 | C18 | 54.8° | 60.1° |
| C15 | C16 | C17 | H21 | 120.3° | 120.0° |
| C15 | C16 | C17 | H22 | 120.3° | 120.0° |
| C15 | C16 | C17 | H19 | 175.1° | 179.9° |
| C15 | C16 | C17 | H20 | 65.5° | 59.8° |
| C15 | C16 | H21 | H22 | 119.2° | 120.0° |
| C16 | C15 | H23 | H24 | 119.5° | 120.0° |
| C16 | C15 | C14 | H25 | 62.1° | 60.3° |
| C18 | C17 | C16 | H19 | 120.3° | 120.0° |
| C18 | C17 | C16 | H20 | 120.3° | 119.9° |
| C17 | C18 | C19 | H16 | 62.1° | 60.3° |
| C17 | C18 | H17 | H18 | 119.4° | 120.0° |
| C18 | C17 | H19 | H20 | 119.1° | 120.0° |
| C18 | C17 | C16 | H21 | 175.1° | 59.8° |
| C18 | C17 | C16 | H22 | 65.5° | 179.8° |
| C16 | C17 | C18 | H17 | 64.8° | 59.9° |
| C16 | C17 | C18 | H18 | 175.7° | 179.9° |
| C16 | C17 | H19 | H20 | 119.2° | 120.1° |
| C17 | C16 | H21 | H22 | 119.1° | 120.0° |
| C17 | C16 | C15 | H23 | 64.7° | 179.9° |
| C17 | C16 | C15 | H24 | 175.6° | 60.0° |
| H1 | C24 | C23 | H2 | 83.2° | 60.3° |
| H2 | C23 | C25 | H3 | 157.7° | 175.0° |
| H2 | C23 | C25 | H4 | 82.3° | 65.0° |
| H2 | C23 | N1 | H9 | 70.4° | 159.0° |
| H5 | N3 | C28 | H6 | 0.1° | 0.1° |
| H9 | N1 | C22 | H11 | 151.4° | 176.0° |
| H9 | N1 | C22 | H12 | 88.6° | 63.9° |
| H11 | C22 | C21 | H13 | 154.1° | 55.3° |
| H12 | C22 | C21 | H13 | 85.9° | 175.3° |
| H13 | C21 | C20 | H14 | 55.1° | 54.7° |
| H13 | C21 | C20 | H15 | 64.3° | 65.3° |
| H14 | C20 | C19 | H16 | 175.3° | 178.9° |
| H15 | C20 | C19 | H16 | 55.9° | 61.1° |
| H16 | C19 | C18 | H17 | 177.7° | 179.6° |
| H16 | C19 | C18 | H18 | 58.1° | 59.7° |
| H16 | C19 | C14 | H25 | 179.8° | 179.3° |
| H17 | C18 | C17 | H19 | 55.5° | 60.1° |
| H17 | C18 | C17 | H20 | 175.0° | 179.9° |
| H18 | C18 | C17 | H19 | 64.1° | 59.9° |
| H18 | C18 | C17 | H20 | 55.4° | 60.1° |
| H19 | C17 | C16 | H21 | 64.6° | 60.2° |
| H19 | C17 | C16 | H22 | 54.8° | 59.8° |
| H20 | C17 | C16 | H21 | 54.8° | 179.8° |
| H20 | C17 | C16 | H22 | 174.2° | 60.2° |
| H21 | C16 | C15 | H23 | 55.5° | 60.1° |
| H21 | C16 | C15 | H24 | 64.2° | 179.9° |
| H22 | C16 | C15 | H23 | 175.0° | 59.9° |
| H22 | C16 | C15 | H24 | 55.3° | 60.1° |
| H23 | C15 | C14 | H25 | 177.7° | 59.7° |
| H24 | C15 | C14 | H25 | 58.0° | 179.6° |
| H25 | C14 | C13 | H26 | 177.3° | 54.2° |
| H25 | C14 | C13 | H27 | 61.4° | 174.4° |
| H28 | C12 | C11 | H29 | 0.0° | 0.1° |
| H30 | C3 | C2 | H31 | 0.1° | 0.6° |
| H32 | C10 | C9 | H33 | 0.0° | 0.1° |
| H33 | C9 | C8 | H34 | 0.1° | 0.1° |
| H34 | C8 | C7 | H35 | 0.1° | 0.0° |
| H35 | C7 | C6 | H36 | 0.1° | 0.1° |
