D68
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C28 | N2 | sing | 1.47Å | 1.48Å | |
| C28 | C27 | sing | 1.53Å | 1.52Å | |
| O1 | C5 | doub | 1.21Å | 1.21Å | |
| O2 | C7 | doub | 1.21Å | 1.25Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| N2 | C7 | sing | 1.35Å | 1.35Å | |
| N2 | C8 | sing | 1.47Å | 1.48Å | |
| C27 | C10 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.51Å | 1.50Å | |
| C4 | C2 | sing | 1.53Å | 1.53Å | |
| C5 | N1 | sing | 1.34Å | 1.42Å | |
| C7 | C6 | sing | 1.51Å | 1.53Å | |
| O5 | C26 | doub | 1.21Å | 1.23Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C30 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C10 | N3 | sing | 1.47Å | 1.48Å | |
| N1 | C6 | sing | 1.47Å | 1.48Å | |
| N1 | C29 | sing | 1.34Å | 1.41Å | |
| C26 | N3 | sing | 1.35Å | 1.39Å | |
| C26 | C25 | sing | 1.50Å | 1.51Å | |
| N3 | N4 | sing | 1.40Å | 1.39Å | |
| C29 | C30 | sing | 1.51Å | 1.50Å | |
| C29 | O6 | doub | 1.21Å | 1.22Å | |
| C25 | C24 | sing | 1.52Å | 1.53Å | |
| C25 | C20 | sing | 1.53Å | 1.55Å | |
| C24 | C23 | sing | 1.50Å | 1.50Å | |
| N4 | C11 | doub | 1.30Å | 1.29Å | |
| C23 | C22 | doub | 1.29Å | 1.33Å | |
| F3 | C18 | sing | 1.40Å | 1.32Å | |
| C11 | C20 | sing | 1.52Å | 1.52Å | |
| C11 | C12 | sing | 1.47Å | 1.49Å | |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C22 | C21 | sing | 1.50Å | 1.49Å | |
| F4 | C18 | sing | 1.40Å | 1.34Å | |
| C18 | O4 | sing | 1.43Å | 1.35Å | |
| C19 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C19 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| O4 | C17 | sing | 1.36Å | 1.38Å | |
| C17 | C15 | doub | 1.39Å | 1.41Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | O3 | sing | 1.36Å | 1.37Å | |
| O3 | C16 | sing | 1.43Å | 1.34Å | |
| C16 | F2 | sing | 1.40Å | 1.36Å | |
| C16 | F1 | sing | 1.40Å | 1.37Å | |
| C25 | H1 | sing | 1.09Å | 1.10Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C13 | H18 | sing | 1.08Å | 1.08Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.08Å | 1.08Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C30 | H33 | sing | 1.09Å | 1.10Å | |
| C30 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C28 | C27 | 110.1° | 109.0° |
| C28 | N2 | C7 | 121.6° | 120.7° |
| C28 | N2 | C8 | 112.5° | 118.7° |
| N2 | C28 | H31 | 109.3° | 109.6° |
| N2 | C28 | H32 | 109.3° | 109.6° |
| C28 | C27 | C10 | 110.7° | 109.4° |
| C28 | C27 | H29 | 109.2° | 109.4° |
| C28 | C27 | H30 | 109.2° | 109.6° |
| C27 | C28 | H31 | 109.3° | 109.5° |
| C27 | C28 | H32 | 109.3° | 109.5° |
| O1 | C5 | C4 | 120.9° | 119.3° |
| O1 | C5 | N1 | 121.2° | 119.4° |
| O2 | C7 | N2 | 123.4° | 120.0° |
| O2 | C7 | C6 | 119.6° | 120.0° |
| C3 | C2 | C4 | 109.7° | 109.6° |
| C3 | C2 | C1 | 109.8° | 109.6° |
| C3 | C2 | C30 | 109.7° | 109.7° |
| C2 | C3 | H11 | 109.5° | 109.4° |
| C2 | C3 | H12 | 109.5° | 109.4° |
| C2 | C3 | H13 | 109.5° | 109.4° |
| C7 | N2 | C8 | 125.8° | 120.6° |
| N2 | C7 | C6 | 116.9° | 120.0° |
| N2 | C8 | C9 | 110.8° | 108.8° |
| N2 | C8 | H2 | 109.1° | 109.6° |
| N2 | C8 | H3 | 109.1° | 109.5° |
| C27 | C10 | C9 | 112.1° | 109.5° |
| C27 | C10 | N3 | 109.2° | 109.5° |
| C27 | C10 | H6 | 107.1° | 109.5° |
| C10 | C27 | H29 | 109.2° | 109.5° |
| C10 | C27 | H30 | 109.2° | 109.5° |
| C5 | C4 | C2 | 114.5° | 109.1° |
| C4 | C5 | N1 | 117.8° | 121.3° |
| C5 | C4 | H9 | 108.2° | 109.5° |
| C5 | C4 | H10 | 108.2° | 109.5° |
| C4 | C2 | C1 | 110.0° | 109.6° |
| C4 | C2 | C30 | 107.2° | 108.5° |
| C2 | C4 | H9 | 108.2° | 109.5° |
| C2 | C4 | H10 | 108.2° | 109.5° |
| C5 | N1 | C6 | 117.4° | 118.7° |
| C5 | N1 | C29 | 124.6° | 122.6° |
| C7 | C6 | N1 | 111.4° | 109.5° |
| C7 | C6 | H7 | 109.0° | 109.5° |
| C7 | C6 | H8 | 109.0° | 109.5° |
| O5 | C26 | N3 | 120.5° | 121.0° |
| O5 | C26 | C25 | 122.7° | 121.0° |
| C1 | C2 | C30 | 110.5° | 109.8° |
| C2 | C1 | H14 | 109.5° | 109.5° |
| C2 | C1 | H15 | 109.5° | 109.5° |
| C2 | C1 | H16 | 109.4° | 109.5° |
| C2 | C30 | C29 | 112.1° | 109.2° |
| C2 | C30 | H33 | 108.8° | 109.5° |
| C2 | C30 | H34 | 108.8° | 109.5° |
| C8 | C9 | C10 | 111.6° | 109.4° |
| C9 | C8 | H2 | 109.1° | 109.7° |
| C9 | C8 | H3 | 109.1° | 109.6° |
| C8 | C9 | H4 | 108.9° | 109.5° |
| C8 | C9 | H5 | 108.9° | 109.5° |
| C9 | C10 | N3 | 113.2° | 109.4° |
| C10 | C9 | H4 | 108.9° | 109.5° |
| C10 | C9 | H5 | 108.9° | 109.5° |
| C9 | C10 | H6 | 107.2° | 109.4° |
| C10 | N3 | C26 | 122.4° | 120.1° |
| C10 | N3 | N4 | 114.2° | 120.1° |
| N3 | C10 | H6 | 107.8° | 109.5° |
| C6 | N1 | C29 | 117.8° | 118.7° |
| N1 | C6 | H7 | 109.0° | 109.4° |
| N1 | C6 | H8 | 109.0° | 109.4° |
| N1 | C29 | C30 | 114.7° | 121.3° |
| N1 | C29 | O6 | 122.1° | 119.3° |
| N3 | C26 | C25 | 116.6° | 118.0° |
| C26 | N3 | N4 | 123.4° | 119.8° |
| C26 | C25 | C24 | 116.1° | 112.1° |
| C26 | C25 | C20 | 108.0° | 108.6° |
| C26 | C25 | H1 | 108.3° | 108.0° |
| N3 | N4 | C11 | 118.3° | 121.3° |
| C30 | C29 | O6 | 122.8° | 119.3° |
| C29 | C30 | H33 | 108.8° | 109.6° |
| C29 | C30 | H34 | 108.8° | 109.5° |
| C24 | C25 | C20 | 108.4° | 110.7° |
| C25 | C24 | C23 | 112.0° | 111.3° |
| C24 | C25 | H1 | 108.0° | 108.7° |
| C25 | C24 | H19 | 108.8° | 109.1° |
| C25 | C24 | H20 | 108.8° | 109.2° |
| C25 | C20 | C11 | 108.2° | 106.9° |
| C25 | C20 | C21 | 112.2° | 108.6° |
| C20 | C25 | H1 | 107.8° | 108.7° |
| C25 | C20 | H27 | 109.2° | 111.1° |
| C24 | C23 | C22 | 123.2° | 123.6° |
| C23 | C24 | H19 | 108.8° | 109.1° |
| C23 | C24 | H20 | 108.8° | 109.1° |
| C24 | C23 | H21 | 118.4° | 118.1° |
| N4 | C11 | C20 | 122.3° | 119.2° |
| N4 | C11 | C12 | 117.3° | 120.4° |
| C23 | C22 | C21 | 123.4° | 124.4° |
| C22 | C23 | H21 | 118.4° | 118.2° |
| C23 | C22 | H24 | 118.3° | 117.8° |
| F3 | C18 | F4 | 103.2° | 109.5° |
| F3 | C18 | O4 | 111.1° | 109.5° |
| F3 | C18 | H22 | 111.8° | 109.5° |
| C20 | C11 | C12 | 120.2° | 120.4° |
| C11 | C20 | C21 | 108.2° | 107.2° |
| C11 | C20 | H27 | 109.6° | 111.1° |
| C11 | C12 | C19 | 116.7° | 120.1° |
| C11 | C12 | C13 | 123.6° | 120.1° |
| C20 | C21 | C22 | 113.3° | 111.3° |
| C20 | C21 | H25 | 108.5° | 109.0° |
| C20 | C21 | H26 | 108.5° | 109.1° |
| C21 | C20 | H27 | 109.4° | 111.7° |
| C21 | C22 | H24 | 118.3° | 117.8° |
| C22 | C21 | H25 | 108.5° | 109.1° |
| C22 | C21 | H26 | 108.5° | 109.2° |
| F4 | C18 | O4 | 107.5° | 109.4° |
| F4 | C18 | H22 | 111.4° | 109.5° |
| C18 | O4 | C17 | 129.1° | 117.0° |
| O4 | C18 | H22 | 111.3° | 109.5° |
| C12 | C19 | C17 | 120.7° | 119.9° |
| C19 | C12 | C13 | 119.4° | 119.8° |
| C12 | C19 | H28 | 119.7° | 120.1° |
| C19 | C17 | O4 | 125.5° | 120.0° |
| C19 | C17 | C15 | 119.1° | 119.9° |
| C17 | C19 | H28 | 119.7° | 120.0° |
| C12 | C13 | C14 | 120.3° | 120.0° |
| C12 | C13 | H18 | 119.8° | 120.0° |
| O4 | C17 | C15 | 115.1° | 120.0° |
| C17 | C15 | C14 | 120.0° | 120.2° |
| C17 | C15 | O3 | 112.3° | 119.9° |
| C13 | C14 | C15 | 120.3° | 120.2° |
| C13 | C14 | H17 | 119.8° | 119.9° |
| C14 | C13 | H18 | 119.9° | 120.0° |
| C14 | C15 | O3 | 127.7° | 119.9° |
| C15 | C14 | H17 | 119.8° | 119.9° |
| C15 | O3 | C16 | 122.3° | 117.0° |
| O3 | C16 | F2 | 109.2° | 109.5° |
| O3 | C16 | F1 | 108.3° | 109.5° |
| O3 | C16 | H23 | 111.0° | 109.5° |
| F2 | C16 | F1 | 107.1° | 109.4° |
| F2 | C16 | H23 | 110.6° | 109.5° |
| F1 | C16 | H23 | 110.6° | 109.5° |
| H2 | C8 | H3 | 109.5° | 109.7° |
| H4 | C9 | H5 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.5° | 109.5° |
| H9 | C4 | H10 | 109.5° | 109.6° |
| H11 | C3 | H12 | 109.5° | 109.5° |
| H11 | C3 | H13 | 109.4° | 109.5° |
| H12 | C3 | H13 | 109.5° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H16 | 109.5° | 109.4° |
| H15 | C1 | H16 | 109.5° | 109.5° |
| H19 | C24 | H20 | 109.5° | 109.0° |
| H25 | C21 | H26 | 109.5° | 109.1° |
| H29 | C27 | H30 | 109.4° | 109.5° |
| H31 | C28 | H32 | 109.4° | 109.6° |
| H33 | C30 | H34 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C28 | C27 | H31 | 120.1° | 119.9° |
| N2 | C28 | C27 | H32 | 120.1° | 119.9° |
| C28 | N2 | C7 | O2 | 1.2° | 179.7° |
| C28 | N2 | C7 | C8 | 177.3° | 179.7° |
| N2 | C28 | C27 | C10 | 56.3° | 54.4° |
| C28 | N2 | C7 | C6 | 178.4° | 0.3° |
| C28 | N2 | C8 | C9 | 58.2° | 53.3° |
| C28 | N2 | C8 | H2 | 178.4° | 173.2° |
| C28 | N2 | C8 | H3 | 62.0° | 66.4° |
| N2 | C28 | C27 | H29 | 176.5° | 65.5° |
| N2 | C28 | C27 | H30 | 63.9° | 174.5° |
| N2 | C28 | H31 | H32 | 119.7° | 120.3° |
| C27 | C28 | N2 | C7 | 117.4° | 126.4° |
| C27 | C28 | N2 | C8 | 60.2° | 53.3° |
| C28 | C27 | C10 | H29 | 120.2° | 119.8° |
| C28 | C27 | C10 | H30 | 120.2° | 120.1° |
| C28 | C27 | C10 | C9 | 52.4° | 61.2° |
| C28 | C27 | C10 | N3 | 178.6° | 178.8° |
| C28 | C27 | C10 | H6 | 64.9° | 58.8° |
| C28 | C27 | H29 | H30 | 119.5° | 120.2° |
| C27 | C28 | H31 | H32 | 119.7° | 120.1° |
| O1 | C5 | C4 | N1 | 176.5° | 179.7° |
| O1 | C5 | C4 | C2 | 153.1° | 150.6° |
| O1 | C5 | N1 | C6 | 2.7° | 0.8° |
| O1 | C5 | N1 | C29 | 171.4° | 179.2° |
| O1 | C5 | C4 | H9 | 32.4° | 89.5° |
| O1 | C5 | C4 | H10 | 86.1° | 30.7° |
| O2 | C7 | N2 | C6 | 177.2° | 180.0° |
| O2 | C7 | N2 | C8 | 176.1° | 0.0° |
| O2 | C7 | C6 | N1 | 8.1° | 0.0° |
| O2 | C7 | C6 | H7 | 128.4° | 120.0° |
| O2 | C7 | C6 | H8 | 112.2° | 120.0° |
| C3 | C2 | C4 | C5 | 69.4° | 175.3° |
| C3 | C2 | C4 | C1 | 120.9° | 120.4° |
| C3 | C2 | C4 | C30 | 119.0° | 119.7° |
| C3 | C2 | C1 | C30 | 121.1° | 120.5° |
| C3 | C2 | C30 | C29 | 58.4° | 175.3° |
| C3 | C2 | C4 | H9 | 51.4° | 55.5° |
| C3 | C2 | C4 | H10 | 169.9° | 64.8° |
| C2 | C3 | H11 | H12 | 120.0° | 120.0° |
| C2 | C3 | H11 | H13 | 120.0° | 119.9° |
| C2 | C3 | H12 | H13 | 120.0° | 119.9° |
| C3 | C2 | C1 | H14 | 180.0° | 179.7° |
| C3 | C2 | C1 | H15 | 60.0° | 59.6° |
| C3 | C2 | C1 | H16 | 60.0° | 60.3° |
| C3 | C2 | C30 | H33 | 61.9° | 55.4° |
| C3 | C2 | C30 | H34 | 178.8° | 64.7° |
| C7 | N2 | C8 | C9 | 119.3° | 126.4° |
| N2 | C7 | C6 | N1 | 174.6° | 180.0° |
| C7 | N2 | C8 | H2 | 0.9° | 6.6° |
| C7 | N2 | C8 | H3 | 120.5° | 113.8° |
| N2 | C7 | C6 | H7 | 54.3° | 60.0° |
| N2 | C7 | C6 | H8 | 65.1° | 60.0° |
| C7 | N2 | C28 | H31 | 122.5° | 113.8° |
| C7 | N2 | C28 | H32 | 2.7° | 6.6° |
| C8 | N2 | C7 | C6 | 1.1° | 180.0° |
| N2 | C8 | C9 | H2 | 120.2° | 119.8° |
| N2 | C8 | C9 | H3 | 120.2° | 119.7° |
| N2 | C8 | C9 | C10 | 52.6° | 54.6° |
| N2 | C8 | H2 | H3 | 119.4° | 120.3° |
| N2 | C8 | C9 | H4 | 67.7° | 65.4° |
| N2 | C8 | C9 | H5 | 172.9° | 174.6° |
| C8 | N2 | C28 | H31 | 59.9° | 66.5° |
| C8 | N2 | C28 | H32 | 179.7° | 173.2° |
| C27 | C10 | C9 | C8 | 50.6° | 61.3° |
| C27 | C10 | C9 | N3 | 124.0° | 120.0° |
| C27 | C10 | C9 | H6 | 117.3° | 120.0° |
| C27 | C10 | N3 | H6 | 116.0° | 120.0° |
| C27 | C10 | N3 | C26 | 115.8° | 119.9° |
| C27 | C10 | N3 | N4 | 62.7° | 60.0° |
| C27 | C10 | C9 | H4 | 69.7° | 58.6° |
| C27 | C10 | C9 | H5 | 170.9° | 178.7° |
| C10 | C27 | H29 | H30 | 119.4° | 120.0° |
| C10 | C27 | C28 | H31 | 63.8° | 65.4° |
| C10 | C27 | C28 | H32 | 176.4° | 174.3° |
| C5 | C4 | C2 | H9 | 120.7° | 119.9° |
| C5 | C4 | C2 | H10 | 120.8° | 119.9° |
| C5 | C4 | C2 | C1 | 169.7° | 64.3° |
| C5 | C4 | C2 | C30 | 49.6° | 55.6° |
| C4 | C5 | N1 | C6 | 179.2° | 179.4° |
| C4 | C5 | N1 | C29 | 5.1° | 0.6° |
| C5 | C4 | H9 | H10 | 117.7° | 120.2° |
| C2 | C4 | C5 | N1 | 23.3° | 29.1° |
| C4 | C2 | C1 | C30 | 118.1° | 119.1° |
| C4 | C2 | C30 | C29 | 60.6° | 55.6° |
| C2 | C4 | H9 | H10 | 117.7° | 120.2° |
| C4 | C2 | C3 | H11 | 180.0° | 60.0° |
| C4 | C2 | C3 | H12 | 60.0° | 180.0° |
| C4 | C2 | C3 | H13 | 60.0° | 60.0° |
| C4 | C2 | C1 | H14 | 59.2° | 60.0° |
| C4 | C2 | C1 | H15 | 179.2° | 180.0° |
| C4 | C2 | C1 | H16 | 60.8° | 60.0° |
| C4 | C2 | C30 | H33 | 179.1° | 64.3° |
| C4 | C2 | C30 | H34 | 59.8° | 175.5° |
| C5 | N1 | C6 | C7 | 92.9° | 90.0° |
| C5 | N1 | C6 | C29 | 174.5° | 180.0° |
| C5 | N1 | C29 | C30 | 15.7° | 0.6° |
| C5 | N1 | C29 | O6 | 157.7° | 179.5° |
| C5 | N1 | C6 | H7 | 27.4° | 30.0° |
| C5 | N1 | C6 | H8 | 146.8° | 150.0° |
| N1 | C5 | C4 | H9 | 144.1° | 90.8° |
| N1 | C5 | C4 | H10 | 97.4° | 149.0° |
| C7 | C6 | N1 | H7 | 120.3° | 120.0° |
| C7 | C6 | N1 | H8 | 120.3° | 120.0° |
| C7 | C6 | N1 | C29 | 81.6° | 90.0° |
| C7 | C6 | H7 | H8 | 119.1° | 120.0° |
| O5 | C26 | N3 | C10 | 6.3° | 3.9° |
| O5 | C26 | N3 | C25 | 176.5° | 180.0° |
| O5 | C26 | N3 | N4 | 175.3° | 176.1° |
| O5 | C26 | C25 | C24 | 17.1° | 21.0° |
| O5 | C26 | C25 | C20 | 139.0° | 143.7° |
| O5 | C26 | C25 | H1 | 104.5° | 98.7° |
| C1 | C2 | C30 | C29 | 179.6° | 64.2° |
| C1 | C2 | C4 | H9 | 69.5° | 175.8° |
| C1 | C2 | C4 | H10 | 49.0° | 55.6° |
| C1 | C2 | C3 | H11 | 59.0° | 60.4° |
| C1 | C2 | C3 | H12 | 179.0° | 59.7° |
| C1 | C2 | C3 | H13 | 61.0° | 179.6° |
| C2 | C1 | H14 | H15 | 120.0° | 120.0° |
| C2 | C1 | H14 | H16 | 120.0° | 120.0° |
| C2 | C1 | H15 | H16 | 120.0° | 120.0° |
| C1 | C2 | C30 | H33 | 59.3° | 175.9° |
| C1 | C2 | C30 | H34 | 60.0° | 55.7° |
| C2 | C30 | C29 | N1 | 44.4° | 29.1° |
| C2 | C30 | C29 | H33 | 120.4° | 119.9° |
| C2 | C30 | C29 | H34 | 120.4° | 119.9° |
| C2 | C30 | C29 | O6 | 129.0° | 150.9° |
| C30 | C2 | C4 | H9 | 170.4° | 64.3° |
| C30 | C2 | C4 | H10 | 71.1° | 175.5° |
| C30 | C2 | C3 | H11 | 62.6° | 179.0° |
| C30 | C2 | C3 | H12 | 57.5° | 60.9° |
| C30 | C2 | C3 | H13 | 177.4° | 59.0° |
| C30 | C2 | C1 | H14 | 58.9° | 59.1° |
| C30 | C2 | C1 | H15 | 61.1° | 60.9° |
| C30 | C2 | C1 | H16 | 178.9° | 179.1° |
| C2 | C30 | H33 | H34 | 118.8° | 120.1° |
| C8 | C9 | C10 | H4 | 120.3° | 120.0° |
| C8 | C9 | C10 | H5 | 120.3° | 120.0° |
| C8 | C9 | C10 | N3 | 174.6° | 178.6° |
| C9 | C8 | H2 | H3 | 119.4° | 120.4° |
| C8 | C9 | H4 | H5 | 119.0° | 120.1° |
| C8 | C9 | C10 | H6 | 66.6° | 58.7° |
| C9 | C10 | N3 | H6 | 118.4° | 119.9° |
| C9 | C10 | N3 | C26 | 118.6° | 120.0° |
| C9 | C10 | N3 | N4 | 62.8° | 60.0° |
| C10 | C9 | C8 | H2 | 172.8° | 174.4° |
| C10 | C9 | C8 | H3 | 67.6° | 65.1° |
| C10 | C9 | H4 | H5 | 119.0° | 120.0° |
| C9 | C10 | C27 | H29 | 172.6° | 58.6° |
| C9 | C10 | C27 | H30 | 67.8° | 178.6° |
| C10 | N3 | C26 | N4 | 178.4° | 180.0° |
| C10 | N3 | C26 | C25 | 177.2° | 176.1° |
| C10 | N3 | N4 | C11 | 161.7° | 155.0° |
| N3 | C10 | C9 | H4 | 54.3° | 61.4° |
| N3 | C10 | C9 | H5 | 65.0° | 58.6° |
| N3 | C10 | C27 | H29 | 61.1° | 61.4° |
| N3 | C10 | C27 | H30 | 58.4° | 58.6° |
| C6 | N1 | C29 | C30 | 170.2° | 179.4° |
| C6 | N1 | C29 | O6 | 16.3° | 0.5° |
| N1 | C6 | H7 | H8 | 119.1° | 119.9° |
| N1 | C29 | C30 | O6 | 173.4° | 180.0° |
| C29 | N1 | C6 | H7 | 158.2° | 150.0° |
| C29 | N1 | C6 | H8 | 38.7° | 30.0° |
| N1 | C29 | C30 | H33 | 164.8° | 90.8° |
| N1 | C29 | C30 | H34 | 76.0° | 149.0° |
| N3 | C26 | C25 | C24 | 159.3° | 159.0° |
| N3 | C26 | C25 | C20 | 37.4° | 36.3° |
| C26 | N3 | N4 | C11 | 19.8° | 25.0° |
| N3 | C26 | C25 | H1 | 79.1° | 81.4° |
| C26 | N3 | C10 | H6 | 0.2° | 0.1° |
| C25 | C26 | N3 | N4 | 1.2° | 3.9° |
| C26 | C25 | C24 | C20 | 121.7° | 121.4° |
| C26 | C25 | C24 | H1 | 121.8° | 119.3° |
| C26 | C25 | C20 | H1 | 116.8° | 117.2° |
| C26 | C25 | C24 | C23 | 71.4° | 75.4° |
| C26 | C25 | C20 | C11 | 52.2° | 54.9° |
| C26 | C25 | C20 | C21 | 67.1° | 60.5° |
| C26 | C25 | C24 | H19 | 49.0° | 45.0° |
| C26 | C25 | C24 | H20 | 168.2° | 164.1° |
| C26 | C25 | C20 | H27 | 171.4° | 176.3° |
| N3 | N4 | C11 | C20 | 0.7° | 0.5° |
| N3 | N4 | C11 | C12 | 175.8° | 179.5° |
| N4 | N3 | C10 | H6 | 178.7° | 180.0° |
| C29 | C30 | H33 | H34 | 118.8° | 120.2° |
| O6 | C29 | C30 | H33 | 8.6° | 89.2° |
| O6 | C29 | C30 | H34 | 110.6° | 31.0° |
| C24 | C25 | C20 | H1 | 116.6° | 119.3° |
| C25 | C24 | C23 | H19 | 120.4° | 120.5° |
| C25 | C24 | C23 | H20 | 120.4° | 120.5° |
| C25 | C24 | C23 | C22 | 22.3° | 15.3° |
| C24 | C25 | C20 | C11 | 178.7° | 178.3° |
| C24 | C25 | C20 | C21 | 59.4° | 62.9° |
| C25 | C24 | H19 | H20 | 118.8° | 119.2° |
| C25 | C24 | C23 | H21 | 157.7° | 164.7° |
| C24 | C25 | C20 | H27 | 62.0° | 60.3° |
| C20 | C25 | C24 | C23 | 50.3° | 46.0° |
| C25 | C20 | C11 | N4 | 37.2° | 39.5° |
| C25 | C20 | C11 | C21 | 121.8° | 116.3° |
| C25 | C20 | C11 | H27 | 119.0° | 121.4° |
| C25 | C20 | C11 | C12 | 147.8° | 140.6° |
| C25 | C20 | C21 | H27 | 121.3° | 122.8° |
| C25 | C20 | C21 | C22 | 37.9° | 47.0° |
| C20 | C25 | C24 | H19 | 170.7° | 166.4° |
| C20 | C25 | C24 | H20 | 70.1° | 74.5° |
| C25 | C20 | C21 | H25 | 158.5° | 73.4° |
| C25 | C20 | C21 | H26 | 82.6° | 167.5° |
| C24 | C23 | C22 | H21 | 180.0° | 180.0° |
| C24 | C23 | C22 | C21 | 0.3° | 1.0° |
| C23 | C24 | C25 | H1 | 166.8° | 165.3° |
| C23 | C24 | H19 | H20 | 118.8° | 119.0° |
| C24 | C23 | C22 | H24 | 179.7° | 179.0° |
| N4 | C11 | C20 | C12 | 175.0° | 179.9° |
| N4 | C11 | C20 | C21 | 84.6° | 76.8° |
| N4 | C11 | C12 | C19 | 1.7° | 0.0° |
| N4 | C11 | C12 | C13 | 172.7° | 179.9° |
| N4 | C11 | C20 | H27 | 156.2° | 160.9° |
| C23 | C22 | C21 | C20 | 7.7° | 17.7° |
| C23 | C22 | C21 | H24 | 180.0° | 180.0° |
| C22 | C23 | C24 | H19 | 142.7° | 135.8° |
| C22 | C23 | C24 | H20 | 98.1° | 105.2° |
| C23 | C22 | C21 | H25 | 128.3° | 102.6° |
| C23 | C22 | C21 | H26 | 112.8° | 138.2° |
| F3 | C18 | F4 | O4 | 117.6° | 120.0° |
| F3 | C18 | F4 | H22 | 120.2° | 120.0° |
| F3 | C18 | O4 | H22 | 125.4° | 120.0° |
| F3 | C18 | O4 | C17 | 33.4° | 60.0° |
| C11 | C20 | C21 | H27 | 119.3° | 121.9° |
| C11 | C20 | C21 | C22 | 157.2° | 162.3° |
| C20 | C11 | C12 | C19 | 177.0° | 180.0° |
| C20 | C11 | C12 | C13 | 2.5° | 0.0° |
| C11 | C20 | C25 | H1 | 64.7° | 62.3° |
| C11 | C20 | C21 | H25 | 82.2° | 41.9° |
| C11 | C20 | C21 | H26 | 36.7° | 77.2° |
| C12 | C11 | C20 | C21 | 90.4° | 103.1° |
| C11 | C12 | C19 | C13 | 174.7° | 180.0° |
| C11 | C12 | C19 | C17 | 178.8° | 179.8° |
| C11 | C12 | C13 | C14 | 177.7° | 180.0° |
| C11 | C12 | C13 | H18 | 2.3° | 0.0° |
| C12 | C11 | C20 | H27 | 28.8° | 19.2° |
| C11 | C12 | C19 | H28 | 1.2° | 0.0° |
| C20 | C21 | C22 | H25 | 120.6° | 120.3° |
| C20 | C21 | C22 | H26 | 120.6° | 120.5° |
| C21 | C20 | C25 | H1 | 176.0° | 177.7° |
| C20 | C21 | C22 | H24 | 172.3° | 162.3° |
| C20 | C21 | H25 | H26 | 118.3° | 119.1° |
| C21 | C22 | C23 | H21 | 179.7° | 179.0° |
| C22 | C21 | H25 | H26 | 118.3° | 119.2° |
| C22 | C21 | C20 | H27 | 83.4° | 75.8° |
| F4 | C18 | O4 | H22 | 122.3° | 120.0° |
| F4 | C18 | O4 | C17 | 145.8° | 60.0° |
| C18 | O4 | C17 | C19 | 54.5° | 0.0° |
| C18 | O4 | C17 | C15 | 132.1° | 180.0° |
| C12 | C19 | C17 | H28 | 180.0° | 179.8° |
| C12 | C19 | C17 | O4 | 179.5° | 179.8° |
| C12 | C19 | C17 | C15 | 6.4° | 0.2° |
| C19 | C12 | C13 | C14 | 3.3° | 0.1° |
| C19 | C12 | C13 | H18 | 176.6° | 180.0° |
| C17 | C19 | C12 | C13 | 6.5° | 0.2° |
| C19 | C17 | O4 | C15 | 173.4° | 180.0° |
| C19 | C17 | C15 | C14 | 3.2° | 0.0° |
| C19 | C17 | C15 | O3 | 178.6° | 180.0° |
| C12 | C13 | C14 | H18 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 0.2° | 0.3° |
| C12 | C13 | C14 | H17 | 179.8° | 180.0° |
| C13 | C12 | C19 | H28 | 173.5° | 180.0° |
| O4 | C17 | C15 | C14 | 177.0° | 180.0° |
| O4 | C17 | C15 | O3 | 4.8° | 0.0° |
| C17 | O4 | C18 | H22 | 91.9° | 180.0° |
| O4 | C17 | C19 | H28 | 0.5° | 0.1° |
| C17 | C15 | C14 | C13 | 0.1° | 0.2° |
| C17 | C15 | C14 | O3 | 177.8° | 180.0° |
| C17 | C15 | O3 | C16 | 161.0° | 180.0° |
| C17 | C15 | C14 | H17 | 179.9° | 180.0° |
| C15 | C17 | C19 | H28 | 173.6° | 180.0° |
| C13 | C14 | C15 | H17 | 180.0° | 179.8° |
| C13 | C14 | C15 | O3 | 178.0° | 179.8° |
| C14 | C15 | O3 | C16 | 21.0° | 0.0° |
| C15 | C14 | C13 | H18 | 179.8° | 179.7° |
| C15 | O3 | C16 | F2 | 67.2° | 60.0° |
| C15 | O3 | C16 | F1 | 49.1° | 60.0° |
| O3 | C15 | C14 | H17 | 2.0° | 0.0° |
| C15 | O3 | C16 | H23 | 170.7° | 180.0° |
| O3 | C16 | F2 | F1 | 117.1° | 120.0° |
| O3 | C16 | F2 | H23 | 122.4° | 120.0° |
| O3 | C16 | F1 | H23 | 121.8° | 120.0° |
| F2 | C16 | F1 | H23 | 120.6° | 120.0° |
| H1 | C25 | C24 | H19 | 72.8° | 74.3° |
| H1 | C25 | C24 | H20 | 46.4° | 44.8° |
| H1 | C25 | C20 | H27 | 54.6° | 59.1° |
| H2 | C8 | C9 | H4 | 52.5° | 54.4° |
| H2 | C8 | C9 | H5 | 66.9° | 65.6° |
| H3 | C8 | C9 | H4 | 172.1° | 174.9° |
| H3 | C8 | C9 | H5 | 52.7° | 54.9° |
| H4 | C9 | C10 | H6 | 173.0° | 178.6° |
| H5 | C9 | C10 | H6 | 53.7° | 61.3° |
| H6 | C10 | C27 | H29 | 55.3° | 178.6° |
| H6 | C10 | C27 | H30 | 174.9° | 61.4° |
| H11 | C3 | H12 | H13 | 120.0° | 120.1° |
| H14 | C1 | H15 | H16 | 120.0° | 120.0° |
| H17 | C14 | C13 | H18 | 0.2° | 0.0° |
| H19 | C24 | C23 | H21 | 37.3° | 44.2° |
| H20 | C24 | C23 | H21 | 81.9° | 74.8° |
| H21 | C23 | C22 | H24 | 0.3° | 0.9° |
| H24 | C22 | C21 | H25 | 51.7° | 77.3° |
| H24 | C22 | C21 | H26 | 67.2° | 41.8° |
| H25 | C21 | C20 | H27 | 37.1° | 163.8° |
| H26 | C21 | C20 | H27 | 156.0° | 44.7° |
| H29 | C27 | C28 | H31 | 56.4° | 174.7° |
| H29 | C27 | C28 | H32 | 63.4° | 54.4° |
| H30 | C27 | C28 | H31 | 176.0° | 54.6° |
| H30 | C27 | C28 | H32 | 56.2° | 65.6° |
