Z74
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | doub | 1.40Å | 1.42Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.42Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| F1 | C24 | sing | 1.35Å | 1.33Å | |
| C16 | N1 | sing | 1.46Å | 1.48Å | |
| N1 | C7 | sing | 1.35Å | 1.38Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| O1 | S1 | doub | 1.42Å | 1.43Å | |
| C29 | S1 | sing | 1.76Å | 1.79Å | |
| S1 | N3 | sing | 1.66Å | 1.75Å | |
| S1 | O2 | doub | 1.42Å | 1.44Å | |
| C8 | C2 | sing | 1.48Å | 1.49Å | |
| C3 | C2 | sing | 1.39Å | 1.42Å | Aromatic |
| F2 | C22 | sing | 1.35Å | 1.34Å | |
| C10 | N2 | sing | 1.47Å | 1.50Å | |
| C9 | N2 | sing | 1.47Å | 1.50Å | |
| N2 | C8 | sing | 1.35Å | 1.42Å | |
| C3 | C4 | doub | 1.39Å | 1.42Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C26 | N3 | sing | 1.47Å | 1.48Å | |
| N3 | C27 | sing | 1.47Å | 1.50Å | |
| C8 | O3 | doub | 1.22Å | 1.23Å | |
| C7 | C4 | sing | 1.48Å | 1.48Å | |
| C4 | C5 | sing | 1.40Å | 1.43Å | Aromatic |
| C18 | N4 | sing | 1.47Å | 1.48Å | |
| N4 | C28 | sing | 1.47Å | 1.48Å | |
| N4 | HN4 | sing | 1.01Å | 1.00Å | |
| O4 | C7 | doub | 1.22Å | 1.23Å | |
| C5 | C6 | doub | 1.38Å | 1.42Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| O5 | C17 | sing | 1.43Å | 1.42Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C6 | C15 | sing | 1.51Å | 1.51Å | |
| C13 | C9 | sing | 1.53Å | 1.55Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C12 | H12B | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C19 | C16 | sing | 1.53Å | 1.56Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | C18 | sing | 1.53Å | 1.56Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | C19 | sing | 1.51Å | 1.52Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C21 | C20 | doub | 1.38Å | 1.43Å | Aromatic |
| C25 | C20 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.41Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | C25 | doub | 1.39Å | 1.41Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.53Å | 1.54Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C30 | C29 | doub | 1.38Å | 1.42Å | Aromatic |
| C29 | C34 | sing | 1.38Å | 1.42Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.42Å | Aromatic |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | C32 | doub | 1.38Å | 1.42Å | Aromatic |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | C33 | sing | 1.38Å | 1.41Å | Aromatic |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | C34 | doub | 1.38Å | 1.42Å | Aromatic |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 121.0° | 120.1° |
| C2 | C1 | H1 | 119.5° | 119.9° |
| C1 | C2 | C8 | 118.9° | 120.0° |
| C1 | C2 | C3 | 119.3° | 119.9° |
| C6 | C1 | H1 | 119.5° | 120.0° |
| C1 | C6 | C5 | 119.0° | 120.4° |
| C1 | C6 | C15 | 120.0° | 119.8° |
| F1 | C24 | C23 | 119.2° | 120.1° |
| F1 | C24 | C25 | 118.3° | 120.0° |
| C16 | N1 | C7 | 123.1° | 120.0° |
| C16 | N1 | HN1 | 118.5° | 120.0° |
| N1 | C16 | C19 | 108.7° | 109.5° |
| N1 | C16 | C17 | 109.8° | 109.5° |
| N1 | C16 | H16 | 110.7° | 109.5° |
| C7 | N1 | HN1 | 118.5° | 120.0° |
| N1 | C7 | C4 | 115.5° | 120.0° |
| N1 | C7 | O4 | 121.6° | 120.0° |
| O1 | S1 | C29 | 110.3° | 106.4° |
| O1 | S1 | N3 | 105.2° | 106.4° |
| O1 | S1 | O2 | 119.4° | 123.1° |
| C29 | S1 | N3 | 105.9° | 107.2° |
| C29 | S1 | O2 | 109.8° | 106.4° |
| S1 | C29 | C30 | 119.5° | 120.0° |
| S1 | C29 | C34 | 120.2° | 120.0° |
| N3 | S1 | O2 | 105.2° | 106.4° |
| S1 | N3 | C26 | 114.9° | 120.9° |
| S1 | N3 | C27 | 116.2° | 120.9° |
| C8 | C2 | C3 | 121.9° | 120.1° |
| C2 | C8 | N2 | 122.6° | 120.0° |
| C2 | C8 | O3 | 117.1° | 120.0° |
| C2 | C3 | C4 | 120.6° | 119.7° |
| C2 | C3 | H3 | 119.7° | 120.2° |
| F2 | C22 | C21 | 119.0° | 120.0° |
| F2 | C22 | C23 | 119.2° | 120.0° |
| C10 | N2 | C9 | 117.3° | 120.0° |
| C10 | N2 | C8 | 125.9° | 120.0° |
| N2 | C10 | C11 | 113.1° | 109.5° |
| N2 | C10 | H10 | 108.3° | 109.5° |
| N2 | C10 | H10A | 108.3° | 109.5° |
| C9 | N2 | C8 | 116.7° | 120.0° |
| N2 | C9 | C13 | 113.7° | 109.5° |
| N2 | C9 | H9 | 108.1° | 109.5° |
| N2 | C9 | H9A | 108.1° | 109.5° |
| N2 | C8 | O3 | 120.3° | 120.0° |
| C4 | C3 | H3 | 119.7° | 120.2° |
| C3 | C4 | C7 | 121.8° | 120.0° |
| C3 | C4 | C5 | 119.3° | 119.9° |
| C26 | N3 | C27 | 112.8° | 118.2° |
| N3 | C26 | C18 | 115.4° | 108.5° |
| N3 | C26 | H26 | 107.6° | 109.6° |
| N3 | C26 | H26A | 107.5° | 109.6° |
| N3 | C27 | C28 | 114.6° | 108.5° |
| N3 | C27 | H27 | 107.8° | 109.6° |
| N3 | C27 | H27A | 107.8° | 109.6° |
| C7 | C4 | C5 | 119.0° | 120.1° |
| C4 | C7 | O4 | 122.9° | 120.0° |
| C4 | C5 | C6 | 120.8° | 120.1° |
| C4 | C5 | H5 | 119.6° | 119.9° |
| C18 | N4 | C28 | 112.6° | 111.1° |
| C18 | N4 | HN4 | 108.5° | 111.3° |
| N4 | C18 | C17 | 108.0° | 109.5° |
| N4 | C18 | C26 | 109.9° | 109.4° |
| N4 | C18 | H18 | 111.3° | 109.5° |
| C28 | N4 | HN4 | 108.4° | 111.0° |
| N4 | C28 | C27 | 111.3° | 109.4° |
| N4 | C28 | H28 | 108.9° | 109.5° |
| N4 | C28 | H28A | 108.9° | 109.5° |
| C6 | C5 | H5 | 119.6° | 120.0° |
| C5 | C6 | C15 | 121.0° | 119.8° |
| C17 | O5 | HO5 | 109.5° | 114.1° |
| O5 | C17 | C16 | 109.3° | 109.5° |
| O5 | C17 | C18 | 107.5° | 109.4° |
| O5 | C17 | H17 | 112.9° | 109.5° |
| C6 | C15 | H15 | 109.5° | 109.5° |
| C6 | C15 | H15A | 109.4° | 109.5° |
| C6 | C15 | H15B | 109.4° | 109.5° |
| C13 | C9 | H9 | 108.1° | 109.5° |
| C13 | C9 | H9A | 108.1° | 109.5° |
| C9 | C13 | C14 | 113.8° | 109.5° |
| C9 | C13 | H13 | 108.1° | 109.5° |
| C9 | C13 | H13A | 108.1° | 109.5° |
| H9 | C9 | H9A | 110.8° | 109.4° |
| C11 | C10 | H10 | 108.3° | 109.5° |
| C11 | C10 | H10A | 108.3° | 109.5° |
| C10 | C11 | C12 | 112.9° | 109.5° |
| C10 | C11 | H11 | 108.4° | 109.5° |
| C10 | C11 | H11A | 108.4° | 109.5° |
| H10 | C10 | H10A | 110.6° | 109.5° |
| C12 | C11 | H11 | 108.3° | 109.5° |
| C12 | C11 | H11A | 108.3° | 109.5° |
| C11 | C12 | H12 | 109.5° | 109.5° |
| C11 | C12 | H12A | 109.5° | 109.4° |
| C11 | C12 | H12B | 109.4° | 109.4° |
| H11 | C11 | H11A | 110.6° | 109.4° |
| H12 | C12 | H12A | 109.5° | 109.5° |
| H12 | C12 | H12B | 109.5° | 109.5° |
| H12A | C12 | H12B | 109.5° | 109.5° |
| C14 | C13 | H13 | 108.0° | 109.4° |
| C14 | C13 | H13A | 108.1° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.4° |
| C13 | C14 | H14A | 109.5° | 109.5° |
| C13 | C14 | H14B | 109.4° | 109.4° |
| H13 | C13 | H13A | 110.8° | 109.4° |
| H14 | C14 | H14A | 109.5° | 109.5° |
| H14 | C14 | H14B | 109.5° | 109.5° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H15 | C15 | H15A | 109.5° | 109.4° |
| H15 | C15 | H15B | 109.5° | 109.5° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| C19 | C16 | C17 | 112.2° | 109.5° |
| C19 | C16 | H16 | 108.3° | 109.5° |
| C16 | C19 | C20 | 113.6° | 109.5° |
| C16 | C19 | H19 | 108.1° | 109.5° |
| C16 | C19 | H19A | 108.1° | 109.5° |
| C17 | C16 | H16 | 107.2° | 109.5° |
| C16 | C17 | C18 | 114.8° | 109.5° |
| C16 | C17 | H17 | 105.3° | 109.5° |
| C18 | C17 | H17 | 107.2° | 109.5° |
| C17 | C18 | C26 | 112.6° | 109.3° |
| C17 | C18 | H18 | 108.5° | 109.5° |
| C26 | C18 | H18 | 106.5° | 109.7° |
| C18 | C26 | H26 | 107.5° | 109.6° |
| C18 | C26 | H26A | 107.6° | 109.6° |
| C20 | C19 | H19 | 108.1° | 109.4° |
| C20 | C19 | H19A | 108.2° | 109.5° |
| C19 | C20 | C21 | 121.1° | 120.0° |
| C19 | C20 | C25 | 119.9° | 120.0° |
| H19 | C19 | H19A | 110.8° | 109.5° |
| C21 | C20 | C25 | 119.0° | 120.0° |
| C20 | C21 | C22 | 119.9° | 120.0° |
| C20 | C21 | H21 | 120.0° | 120.0° |
| C20 | C25 | C24 | 119.4° | 120.1° |
| C20 | C25 | H25 | 120.3° | 119.9° |
| C22 | C21 | H21 | 120.1° | 120.0° |
| C21 | C22 | C23 | 121.8° | 120.0° |
| C22 | C23 | C24 | 117.4° | 119.9° |
| C22 | C23 | H23 | 121.3° | 120.1° |
| C24 | C23 | H23 | 121.3° | 120.0° |
| C23 | C24 | C25 | 122.5° | 119.9° |
| C24 | C25 | H25 | 120.3° | 120.0° |
| H26 | C26 | H26A | 111.3° | 109.8° |
| C28 | C27 | H27 | 107.8° | 109.7° |
| C28 | C27 | H27A | 107.8° | 109.6° |
| C27 | C28 | H28 | 108.9° | 109.3° |
| C27 | C28 | H28A | 108.9° | 109.7° |
| H27 | C27 | H27A | 111.1° | 109.8° |
| H28 | C28 | H28A | 110.0° | 109.5° |
| C30 | C29 | C34 | 120.3° | 120.0° |
| C29 | C30 | C31 | 119.6° | 120.0° |
| C29 | C30 | H30 | 120.2° | 120.0° |
| C29 | C34 | C33 | 119.9° | 120.1° |
| C29 | C34 | H34 | 120.1° | 120.0° |
| C31 | C30 | H30 | 120.2° | 120.0° |
| C30 | C31 | C32 | 120.2° | 120.0° |
| C30 | C31 | H31 | 119.9° | 120.0° |
| C32 | C31 | H31 | 119.9° | 120.1° |
| C31 | C32 | C33 | 120.1° | 120.0° |
| C31 | C32 | H32 | 119.9° | 120.0° |
| C33 | C32 | H32 | 119.9° | 120.0° |
| C32 | C33 | C34 | 119.9° | 119.9° |
| C32 | C33 | H33 | 120.1° | 120.0° |
| C34 | C33 | H33 | 120.0° | 120.1° |
| C33 | C34 | H34 | 120.1° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C2 | C8 | C3 | 179.4° | 179.9° |
| C1 | C2 | C8 | N2 | 125.1° | 45.7° |
| C1 | C2 | C3 | C4 | 0.2° | 0.1° |
| C1 | C2 | C3 | H3 | 179.8° | 179.9° |
| C1 | C2 | C8 | O3 | 55.4° | 134.3° |
| C2 | C1 | C6 | C5 | 0.0° | 0.0° |
| C2 | C1 | C6 | C15 | 180.0° | 179.8° |
| C6 | C1 | C2 | C8 | 179.6° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.1° |
| C1 | C6 | C5 | C4 | 0.0° | 0.0° |
| C1 | C6 | C5 | C15 | 180.0° | 179.8° |
| C1 | C6 | C5 | H5 | 180.0° | 180.0° |
| C1 | C6 | C15 | H15 | 90.0° | 90.0° |
| C1 | C6 | C15 | H15A | 150.0° | 150.1° |
| C1 | C6 | C15 | H15B | 30.0° | 30.0° |
| H1 | C1 | C2 | C8 | 0.4° | 0.3° |
| H1 | C1 | C2 | C3 | 179.9° | 179.6° |
| H1 | C1 | C6 | C5 | 180.0° | 179.7° |
| H1 | C1 | C6 | C15 | 0.0° | 0.1° |
| F1 | C24 | C25 | C20 | 179.9° | 179.7° |
| F1 | C24 | C23 | C22 | 179.9° | 180.0° |
| F1 | C24 | C23 | C25 | 179.9° | 179.7° |
| F1 | C24 | C23 | H23 | 0.1° | 0.0° |
| F1 | C24 | C25 | H25 | 0.0° | 0.0° |
| C16 | N1 | C7 | HN1 | 180.0° | 179.9° |
| C16 | N1 | C7 | C4 | 172.0° | 180.0° |
| C16 | N1 | C7 | O4 | 8.0° | 0.1° |
| N1 | C16 | C17 | O5 | 175.5° | 65.1° |
| N1 | C16 | C19 | C17 | 121.6° | 120.0° |
| N1 | C16 | C19 | H16 | 120.4° | 120.0° |
| N1 | C16 | C17 | H16 | 120.3° | 120.0° |
| N1 | C16 | C17 | C18 | 63.7° | 175.0° |
| N1 | C16 | C17 | H17 | 54.0° | 55.0° |
| N1 | C16 | C19 | C20 | 52.0° | 65.0° |
| N1 | C16 | C19 | H19 | 68.0° | 55.0° |
| N1 | C16 | C19 | H19A | 172.0° | 175.0° |
| N1 | C7 | C4 | C3 | 31.1° | 180.0° |
| N1 | C7 | C4 | O4 | 180.0° | 180.0° |
| N1 | C7 | C4 | C5 | 148.9° | 0.0° |
| C7 | N1 | C16 | C19 | 126.0° | 85.0° |
| C7 | N1 | C16 | C17 | 111.0° | 155.0° |
| C7 | N1 | C16 | H16 | 7.2° | 35.1° |
| HN1 | N1 | C7 | C4 | 8.0° | 0.1° |
| HN1 | N1 | C7 | O4 | 172.0° | 180.0° |
| HN1 | N1 | C16 | C19 | 54.0° | 94.9° |
| HN1 | N1 | C16 | C17 | 69.0° | 25.1° |
| HN1 | N1 | C16 | H16 | 172.8° | 145.0° |
| O1 | S1 | C29 | N3 | 113.3° | 113.6° |
| O1 | S1 | C29 | O2 | 133.6° | 132.9° |
| O1 | S1 | N3 | O2 | 127.0° | 132.9° |
| O1 | S1 | N3 | C26 | 49.8° | 23.8° |
| O1 | S1 | N3 | C27 | 175.3° | 156.4° |
| O1 | S1 | C29 | C30 | 16.7° | 156.7° |
| O1 | S1 | C29 | C34 | 163.6° | 23.5° |
| C29 | S1 | N3 | O2 | 116.2° | 113.5° |
| C29 | S1 | N3 | C26 | 67.0° | 89.8° |
| C29 | S1 | N3 | C27 | 67.9° | 90.0° |
| S1 | C29 | C30 | C34 | 179.8° | 179.8° |
| S1 | C29 | C30 | C31 | 179.8° | 180.0° |
| S1 | C29 | C30 | H30 | 0.2° | 0.0° |
| S1 | C29 | C34 | C33 | 179.7° | 179.7° |
| S1 | C29 | C34 | H34 | 0.3° | 0.1° |
| S1 | N3 | C26 | C27 | 136.4° | 179.8° |
| S1 | N3 | C26 | C18 | 178.5° | 128.8° |
| S1 | N3 | C26 | H26 | 61.5° | 111.5° |
| S1 | N3 | C26 | H26A | 58.5° | 9.1° |
| S1 | N3 | C27 | C28 | 179.6° | 128.8° |
| S1 | N3 | C27 | H27 | 59.6° | 9.1° |
| S1 | N3 | C27 | H27A | 60.4° | 111.5° |
| N3 | S1 | C29 | C30 | 96.6° | 89.7° |
| N3 | S1 | C29 | C34 | 83.1° | 90.0° |
| O2 | S1 | N3 | C26 | 176.8° | 156.7° |
| O2 | S1 | N3 | C27 | 48.4° | 23.5° |
| O2 | S1 | C29 | C30 | 150.3° | 23.8° |
| O2 | S1 | C29 | C34 | 29.9° | 156.4° |
| C2 | C8 | N2 | C10 | 17.6° | 6.0° |
| C2 | C8 | N2 | C9 | 163.2° | 174.1° |
| C2 | C8 | N2 | O3 | 179.5° | 179.9° |
| C8 | C2 | C3 | C4 | 179.6° | 180.0° |
| C8 | C2 | C3 | H3 | 0.3° | 0.1° |
| C3 | C2 | C8 | N2 | 55.4° | 134.3° |
| C2 | C3 | C4 | H3 | 180.0° | 179.8° |
| C3 | C2 | C8 | O3 | 124.0° | 45.6° |
| C2 | C3 | C4 | C7 | 179.8° | 179.9° |
| C2 | C3 | C4 | C5 | 0.2° | 0.1° |
| F2 | C22 | C21 | C20 | 180.0° | 180.0° |
| F2 | C22 | C21 | C23 | 179.9° | 180.0° |
| F2 | C22 | C21 | H21 | 0.0° | 0.0° |
| F2 | C22 | C23 | C24 | 179.9° | 180.0° |
| F2 | C22 | C23 | H23 | 0.1° | 0.0° |
| C10 | N2 | C9 | C8 | 179.3° | 180.0° |
| C10 | N2 | C8 | O3 | 162.9° | 174.1° |
| C10 | N2 | C9 | C13 | 65.8° | 90.0° |
| C10 | N2 | C9 | H9 | 54.2° | 30.0° |
| C10 | N2 | C9 | H9A | 174.2° | 150.0° |
| N2 | C10 | C11 | H10 | 120.0° | 120.0° |
| N2 | C10 | C11 | H10A | 120.0° | 120.0° |
| N2 | C10 | H10 | H10A | 118.5° | 120.0° |
| N2 | C10 | C11 | C12 | 65.9° | 174.5° |
| N2 | C10 | C11 | H11 | 54.1° | 54.5° |
| N2 | C10 | C11 | H11A | 174.2° | 65.4° |
| C9 | N2 | C8 | O3 | 16.3° | 5.9° |
| N2 | C9 | C13 | H9 | 120.0° | 120.0° |
| N2 | C9 | C13 | H9A | 120.0° | 120.1° |
| N2 | C9 | H9 | H9A | 118.3° | 120.0° |
| C9 | N2 | C10 | C11 | 70.2° | 81.9° |
| C9 | N2 | C10 | H10 | 49.8° | 38.1° |
| C9 | N2 | C10 | H10A | 169.7° | 158.1° |
| N2 | C9 | C13 | C14 | 60.9° | 180.0° |
| N2 | C9 | C13 | H13 | 59.0° | 60.0° |
| N2 | C9 | C13 | H13A | 179.0° | 59.9° |
| C8 | N2 | C9 | C13 | 114.9° | 90.0° |
| C8 | N2 | C9 | H9 | 125.1° | 150.0° |
| C8 | N2 | C9 | H9A | 5.1° | 30.0° |
| C8 | N2 | C10 | C11 | 108.9° | 98.1° |
| C8 | N2 | C10 | H10 | 131.1° | 141.9° |
| C8 | N2 | C10 | H10A | 11.1° | 21.9° |
| C3 | C4 | C7 | C5 | 180.0° | 180.0° |
| C3 | C4 | C7 | O4 | 148.9° | 0.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.0° |
| C3 | C4 | C5 | H5 | 179.9° | 180.0° |
| H3 | C3 | C4 | C7 | 0.2° | 0.1° |
| H3 | C3 | C4 | C5 | 179.8° | 179.9° |
| N3 | C26 | C18 | N4 | 50.7° | 53.9° |
| N3 | C26 | C18 | C17 | 171.2° | 173.8° |
| N3 | C26 | C18 | H26 | 120.0° | 119.7° |
| N3 | C26 | C18 | H26A | 120.0° | 119.7° |
| N3 | C26 | C18 | H18 | 70.0° | 66.2° |
| N3 | C26 | H26 | H26A | 117.6° | 120.5° |
| C26 | N3 | C27 | C28 | 44.6° | 50.9° |
| C26 | N3 | C27 | H27 | 164.6° | 170.7° |
| C26 | N3 | C27 | H27A | 75.4° | 68.7° |
| N3 | C27 | C28 | N4 | 50.2° | 53.8° |
| C27 | N3 | C26 | C18 | 45.1° | 51.0° |
| C27 | N3 | C26 | H26 | 74.9° | 68.8° |
| C27 | N3 | C26 | H26A | 165.1° | 170.7° |
| N3 | C27 | C28 | H27 | 120.0° | 119.7° |
| N3 | C27 | C28 | H27A | 120.0° | 119.7° |
| N3 | C27 | H27 | H27A | 117.9° | 120.5° |
| N3 | C27 | C28 | H28 | 170.3° | 173.7° |
| N3 | C27 | C28 | H28A | 69.7° | 66.3° |
| C7 | C4 | C5 | C6 | 180.0° | 180.0° |
| C7 | C4 | C5 | H5 | 0.0° | 0.0° |
| C5 | C4 | C7 | O4 | 31.1° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C15 | 180.0° | 179.8° |
| C18 | N4 | C28 | HN4 | 120.0° | 124.4° |
| N4 | C18 | C17 | O5 | 63.6° | 180.0° |
| N4 | C18 | C17 | C16 | 174.6° | 60.0° |
| N4 | C18 | C17 | C26 | 121.6° | 119.8° |
| N4 | C18 | C17 | H18 | 120.8° | 120.0° |
| N4 | C18 | C17 | H17 | 58.0° | 60.1° |
| N4 | C18 | C26 | H18 | 120.7° | 120.1° |
| N4 | C18 | C26 | H26 | 69.3° | 65.8° |
| N4 | C18 | C26 | H26A | 170.7° | 173.6° |
| C18 | N4 | C28 | C27 | 56.6° | 63.3° |
| C18 | N4 | C28 | H28 | 176.6° | 177.0° |
| C18 | N4 | C28 | H28A | 63.4° | 56.9° |
| C28 | N4 | C18 | C17 | 179.2° | 177.0° |
| C28 | N4 | C18 | C26 | 56.0° | 63.3° |
| C28 | N4 | C18 | H18 | 61.8° | 56.9° |
| N4 | C28 | C27 | H28 | 120.0° | 119.9° |
| N4 | C28 | C27 | H28A | 120.0° | 120.1° |
| N4 | C28 | C27 | H27 | 170.2° | 173.5° |
| N4 | C28 | C27 | H27A | 69.7° | 65.9° |
| N4 | C28 | H28 | H28A | 119.3° | 120.1° |
| HN4 | N4 | C18 | C17 | 59.2° | 58.9° |
| HN4 | N4 | C18 | C26 | 64.0° | 60.9° |
| HN4 | N4 | C18 | H18 | 178.2° | 178.9° |
| HN4 | N4 | C28 | C27 | 63.4° | 61.1° |
| HN4 | N4 | C28 | H28 | 56.6° | 58.7° |
| HN4 | N4 | C28 | H28A | 176.6° | 178.7° |
| C5 | C6 | C15 | H15 | 90.0° | 90.2° |
| C5 | C6 | C15 | H15A | 30.0° | 29.7° |
| C5 | C6 | C15 | H15B | 150.0° | 149.7° |
| H5 | C5 | C6 | C15 | 0.0° | 0.3° |
| O5 | C17 | C16 | C19 | 54.5° | 55.0° |
| O5 | C17 | C16 | C18 | 120.8° | 119.9° |
| O5 | C17 | C16 | H17 | 121.5° | 120.0° |
| O5 | C17 | C16 | H16 | 64.2° | 175.0° |
| O5 | C17 | C18 | H17 | 121.6° | 120.0° |
| O5 | C17 | C18 | C26 | 58.0° | 60.3° |
| O5 | C17 | C18 | H18 | 175.7° | 59.9° |
| HO5 | O5 | C17 | C16 | 180.0° | 60.0° |
| HO5 | O5 | C17 | C18 | 54.8° | 60.0° |
| HO5 | O5 | C17 | H17 | 63.2° | 180.0° |
| C6 | C15 | H15 | H15A | 120.0° | 120.0° |
| C6 | C15 | H15 | H15B | 120.0° | 120.0° |
| C6 | C15 | H15A | H15B | 120.0° | 120.0° |
| C13 | C9 | H9 | H9A | 118.2° | 120.0° |
| C9 | C13 | C14 | H13 | 120.0° | 120.0° |
| C9 | C13 | C14 | H13A | 120.0° | 120.1° |
| C9 | C13 | H13 | H13A | 118.2° | 120.0° |
| C9 | C13 | C14 | H14 | 180.0° | 60.1° |
| C9 | C13 | C14 | H14A | 60.0° | 60.0° |
| C9 | C13 | C14 | H14B | 60.0° | 180.0° |
| H9 | C9 | C13 | C14 | 179.1° | 60.0° |
| H9 | C9 | C13 | H13 | 60.9° | 180.0° |
| H9 | C9 | C13 | H13A | 59.1° | 60.0° |
| H9A | C9 | C13 | C14 | 59.1° | 59.9° |
| H9A | C9 | C13 | H13 | 179.1° | 60.0° |
| H9A | C9 | C13 | H13A | 60.9° | 180.0° |
| C11 | C10 | H10 | H10A | 118.5° | 120.0° |
| C10 | C11 | C12 | H11 | 120.0° | 120.1° |
| C10 | C11 | C12 | H11A | 120.0° | 120.0° |
| C10 | C11 | H11 | H11A | 118.6° | 120.0° |
| C10 | C11 | C12 | H12 | 180.0° | 180.0° |
| C10 | C11 | C12 | H12A | 60.0° | 60.0° |
| C10 | C11 | C12 | H12B | 60.0° | 60.0° |
| H10 | C10 | C11 | C12 | 174.1° | 65.4° |
| H10 | C10 | C11 | H11 | 65.9° | 174.6° |
| H10 | C10 | C11 | H11A | 54.2° | 54.6° |
| H10A | C10 | C11 | C12 | 54.1° | 54.6° |
| H10A | C10 | C11 | H11 | 174.1° | 65.5° |
| H10A | C10 | C11 | H11A | 65.8° | 174.6° |
| C12 | C11 | H11 | H11A | 118.6° | 120.0° |
| C11 | C12 | H12 | H12A | 120.0° | 120.0° |
| C11 | C12 | H12 | H12B | 120.0° | 120.0° |
| C11 | C12 | H12A | H12B | 120.0° | 120.0° |
| H11 | C11 | C12 | H12 | 60.0° | 60.0° |
| H11 | C11 | C12 | H12A | 180.0° | 179.9° |
| H11 | C11 | C12 | H12B | 60.0° | 60.1° |
| H11A | C11 | C12 | H12 | 60.0° | 60.0° |
| H11A | C11 | C12 | H12A | 60.0° | 60.0° |
| H11A | C11 | C12 | H12B | 180.0° | 180.0° |
| H12 | C12 | H12A | H12B | 120.0° | 120.1° |
| C14 | C13 | H13 | H13A | 118.3° | 120.0° |
| C13 | C14 | H14 | H14A | 120.0° | 120.0° |
| C13 | C14 | H14 | H14B | 120.0° | 119.9° |
| C13 | C14 | H14A | H14B | 120.0° | 120.0° |
| H13 | C13 | C14 | H14 | 60.0° | 179.9° |
| H13 | C13 | C14 | H14A | 180.0° | 60.0° |
| H13 | C13 | C14 | H14B | 60.0° | 60.0° |
| H13A | C13 | C14 | H14 | 60.0° | 60.0° |
| H13A | C13 | C14 | H14A | 60.0° | 180.0° |
| H13A | C13 | C14 | H14B | 180.0° | 59.9° |
| H14 | C14 | H14A | H14B | 120.0° | 120.0° |
| H15 | C15 | H15A | H15B | 120.1° | 120.0° |
| C19 | C16 | C17 | H16 | 118.7° | 120.0° |
| C19 | C16 | C17 | C18 | 175.4° | 65.0° |
| C19 | C16 | C17 | H17 | 67.0° | 175.0° |
| C16 | C19 | C20 | H19 | 120.0° | 120.0° |
| C16 | C19 | C20 | H19A | 120.0° | 120.1° |
| C16 | C19 | H19 | H19A | 118.3° | 120.1° |
| C16 | C19 | C20 | C21 | 54.2° | 90.0° |
| C16 | C19 | C20 | C25 | 125.6° | 90.3° |
| C16 | C17 | C18 | H17 | 116.6° | 120.0° |
| C16 | C17 | C18 | C26 | 63.9° | 179.8° |
| C16 | C17 | C18 | H18 | 53.8° | 60.0° |
| C17 | C16 | C19 | C20 | 173.5° | 175.0° |
| C17 | C16 | C19 | H19 | 53.5° | 65.1° |
| C17 | C16 | C19 | H19A | 66.4° | 55.0° |
| H16 | C16 | C17 | C18 | 56.7° | 55.0° |
| H16 | C16 | C17 | H17 | 174.3° | 65.0° |
| H16 | C16 | C19 | C20 | 68.4° | 55.0° |
| H16 | C16 | C19 | H19 | 171.6° | 175.0° |
| H16 | C16 | C19 | H19A | 51.6° | 65.0° |
| C17 | C18 | C26 | H18 | 118.8° | 120.1° |
| C17 | C18 | C26 | H26 | 51.2° | 54.0° |
| C17 | C18 | C26 | H26A | 68.8° | 66.5° |
| H17 | C17 | C18 | C26 | 179.6° | 59.7° |
| H17 | C17 | C18 | H18 | 62.8° | 179.9° |
| C18 | C26 | H26 | H26A | 117.6° | 120.4° |
| H18 | C18 | C26 | H26 | 170.0° | 174.1° |
| H18 | C18 | C26 | H26A | 50.0° | 53.6° |
| C20 | C19 | H19 | H19A | 118.3° | 120.0° |
| C19 | C20 | C21 | C25 | 179.8° | 179.7° |
| C19 | C20 | C21 | C22 | 179.8° | 180.0° |
| C19 | C20 | C21 | H21 | 0.2° | 0.0° |
| C19 | C20 | C25 | C24 | 179.9° | 179.7° |
| C19 | C20 | C25 | H25 | 0.1° | 0.0° |
| H19 | C19 | C20 | C21 | 174.2° | 30.0° |
| H19 | C19 | C20 | C25 | 5.6° | 149.7° |
| H19A | C19 | C20 | C21 | 65.8° | 150.0° |
| H19A | C19 | C20 | C25 | 114.4° | 29.7° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C21 | C20 | C25 | C24 | 0.2° | 0.6° |
| C21 | C20 | C25 | H25 | 179.9° | 179.7° |
| C25 | C20 | C21 | C22 | 0.0° | 0.3° |
| C25 | C20 | C21 | H21 | 180.0° | 179.7° |
| C20 | C25 | C24 | C23 | 0.1° | 0.6° |
| C20 | C25 | C24 | H25 | 180.0° | 179.7° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C21 | C22 | C23 | H23 | 179.9° | 180.0° |
| H21 | C21 | C22 | C23 | 179.9° | 180.0° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.0° | 0.3° |
| C23 | C24 | C25 | H25 | 179.9° | 179.7° |
| H23 | C23 | C24 | C25 | 180.0° | 179.8° |
| C28 | C27 | H27 | H27A | 117.9° | 120.5° |
| C27 | C28 | H28 | H28A | 119.3° | 120.1° |
| H27 | C27 | C28 | H28 | 69.7° | 66.6° |
| H27 | C27 | C28 | H28A | 50.3° | 53.4° |
| H27A | C27 | C28 | H28 | 50.3° | 54.0° |
| H27A | C27 | C28 | H28A | 170.3° | 174.0° |
| C29 | C30 | C31 | H30 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.0° | 0.0° |
| C29 | C30 | C31 | H31 | 179.9° | 179.9° |
| C30 | C29 | C34 | C33 | 0.0° | 0.5° |
| C30 | C29 | C34 | H34 | 180.0° | 179.7° |
| C34 | C29 | C30 | C31 | 0.0° | 0.3° |
| C34 | C29 | C30 | H30 | 180.0° | 179.7° |
| C29 | C34 | C33 | C32 | 0.0° | 0.5° |
| C29 | C34 | C33 | H34 | 180.0° | 179.8° |
| C29 | C34 | C33 | H33 | 180.0° | 179.7° |
| C30 | C31 | C32 | H31 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.0° | 0.0° |
| C30 | C31 | C32 | H32 | 180.0° | 179.9° |
| H30 | C30 | C31 | C32 | 180.0° | 180.0° |
| H30 | C30 | C31 | H31 | 0.0° | 0.1° |
| C31 | C32 | C33 | H32 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.0° | 0.2° |
| C31 | C32 | C33 | H33 | 180.0° | 180.0° |
| H31 | C31 | C32 | C33 | 180.0° | 180.0° |
| H31 | C31 | C32 | H32 | 0.0° | 0.0° |
| C32 | C33 | C34 | H33 | 180.0° | 179.8° |
| C32 | C33 | C34 | H34 | 179.9° | 179.7° |
| H32 | C32 | C33 | C34 | 180.0° | 179.8° |
| H32 | C32 | C33 | H33 | 0.0° | 0.0° |
| H33 | C33 | C34 | H34 | 0.0° | 0.1° |
