9DF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C25 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.36Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.36Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.53Å | 1.51Å | |
| C26 | C27 | doub | 1.41Å | 1.39Å | Aromatic |
| C23 | C22 | doub | 1.41Å | 1.39Å | Aromatic |
| O32 | C31 | doub | 1.21Å | 1.22Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C27 | C22 | sing | 1.42Å | 1.40Å | Aromatic |
| C27 | C28 | sing | 1.41Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.41Å | 1.39Å | Aromatic |
| C9 | C46 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.55Å | |
| C31 | C8 | sing | 1.50Å | 1.51Å | |
| C31 | N19 | sing | 1.33Å | 1.35Å | |
| C28 | C29 | doub | 1.36Å | 1.39Å | Aromatic |
| C8 | N7 | sing | 1.48Å | 1.46Å | |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| C21 | C30 | doub | 1.36Å | 1.39Å | Aromatic |
| C20 | N19 | sing | 1.46Å | 1.46Å | |
| N19 | C18 | sing | 1.46Å | 1.47Å | |
| C29 | C30 | sing | 1.39Å | 1.39Å | Aromatic |
| N7 | C17 | sing | 1.46Å | 1.45Å | |
| N7 | C6 | sing | 1.34Å | 1.34Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C17 | N3 | sing | 1.46Å | 1.45Å | |
| O33 | C6 | doub | 1.21Å | 1.22Å | |
| O1 | C2 | doub | 1.22Å | 1.22Å | |
| C6 | C5 | sing | 1.50Å | 1.52Å | |
| N3 | C2 | sing | 1.35Å | 1.33Å | |
| N3 | C4 | sing | 1.47Å | 1.45Å | |
| C2 | N34 | sing | 1.35Å | 1.33Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| N34 | C35 | sing | 1.46Å | 1.45Å | |
| C37 | C36 | sing | 1.53Å | 1.51Å | |
| C37 | C38 | sing | 1.53Å | 1.51Å | |
| F41 | C38 | sing | 1.40Å | 1.32Å | |
| C35 | C36 | sing | 1.53Å | 1.51Å | |
| C38 | F42 | sing | 1.40Å | 1.32Å | |
| C38 | F40 | sing | 1.40Å | 1.32Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C26 | H20 | sing | 1.08Å | 1.08Å | |
| C28 | H21 | sing | 1.08Å | 1.08Å | |
| C29 | H22 | sing | 1.08Å | 1.08Å | |
| C30 | H23 | sing | 1.08Å | 1.08Å | |
| C35 | H24 | sing | 1.09Å | 1.10Å | |
| C35 | H25 | sing | 1.09Å | 1.10Å | |
| C36 | H26 | sing | 1.09Å | 1.10Å | |
| C36 | H27 | sing | 1.09Å | 1.10Å | |
| C37 | H28 | sing | 1.09Å | 1.10Å | |
| C37 | H29 | sing | 1.09Å | 1.10Å | |
| C46 | H30 | sing | 1.09Å | 1.10Å | |
| C46 | H31 | sing | 1.09Å | 1.10Å | |
| C46 | H32 | sing | 1.09Å | 1.10Å | |
| N34 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C25 | C26 | 120.1° | 121.0° |
| C25 | C24 | C23 | 120.2° | 121.0° |
| C25 | C24 | H18 | 119.9° | 119.5° |
| C24 | C25 | H19 | 119.9° | 119.5° |
| C25 | C26 | C27 | 119.6° | 119.6° |
| C26 | C25 | H19 | 119.9° | 119.5° |
| C25 | C26 | H20 | 120.2° | 120.2° |
| C24 | C23 | C22 | 119.9° | 119.6° |
| C24 | C23 | H17 | 120.0° | 120.2° |
| C23 | C24 | H18 | 119.9° | 119.5° |
| C11 | C10 | C9 | 111.2° | 109.5° |
| C11 | C10 | H1 | 109.0° | 109.5° |
| C11 | C10 | H2 | 109.0° | 109.4° |
| C10 | C11 | H9 | 109.5° | 109.5° |
| C10 | C11 | H10 | 109.5° | 109.5° |
| C10 | C11 | H11 | 109.4° | 109.4° |
| C26 | C27 | C22 | 120.4° | 119.4° |
| C26 | C27 | C28 | 119.6° | 121.3° |
| C27 | C26 | H20 | 120.2° | 120.2° |
| C23 | C22 | C27 | 119.8° | 119.3° |
| C23 | C22 | C21 | 120.2° | 121.3° |
| C22 | C23 | H17 | 120.0° | 120.2° |
| O32 | C31 | C8 | 119.0° | 118.4° |
| O32 | C31 | N19 | 122.0° | 118.4° |
| C10 | C9 | C46 | 109.1° | 109.5° |
| C10 | C9 | C8 | 116.6° | 109.5° |
| C9 | C10 | H1 | 109.0° | 109.5° |
| C9 | C10 | H2 | 109.0° | 109.5° |
| C10 | C9 | H5 | 105.6° | 109.5° |
| C22 | C27 | C28 | 120.0° | 119.3° |
| C27 | C22 | C21 | 120.0° | 119.4° |
| C27 | C28 | C29 | 120.0° | 119.7° |
| C27 | C28 | H21 | 120.0° | 120.1° |
| C22 | C21 | C20 | 121.1° | 120.2° |
| C22 | C21 | C30 | 119.6° | 119.6° |
| C46 | C9 | C8 | 113.4° | 109.4° |
| C46 | C9 | H5 | 105.7° | 109.5° |
| C9 | C46 | H30 | 109.5° | 109.5° |
| C9 | C46 | H31 | 109.5° | 109.4° |
| C9 | C46 | H32 | 109.5° | 109.5° |
| C9 | C8 | C31 | 113.1° | 109.6° |
| C9 | C8 | N7 | 110.6° | 109.5° |
| C8 | C9 | H5 | 105.5° | 109.5° |
| C9 | C8 | H8 | 107.3° | 109.6° |
| C8 | C31 | N19 | 119.0° | 123.2° |
| C31 | C8 | N7 | 109.4° | 108.8° |
| C31 | C8 | H8 | 107.8° | 109.7° |
| C31 | N19 | C20 | 119.6° | 117.8° |
| C31 | N19 | C18 | 126.0° | 124.5° |
| C28 | C29 | C30 | 119.9° | 121.0° |
| C29 | C28 | H21 | 120.0° | 120.2° |
| C28 | C29 | H22 | 120.0° | 119.5° |
| C8 | N7 | C17 | 116.2° | 117.0° |
| C8 | N7 | C6 | 120.9° | 119.3° |
| N7 | C8 | H8 | 108.5° | 109.6° |
| C20 | C21 | C30 | 119.3° | 120.2° |
| C21 | C20 | N19 | 115.7° | 109.5° |
| C21 | C20 | H15 | 107.9° | 109.5° |
| C21 | C20 | H16 | 107.9° | 109.5° |
| C21 | C30 | C29 | 120.4° | 121.0° |
| C21 | C30 | H23 | 119.8° | 119.5° |
| C20 | N19 | C18 | 114.2° | 117.8° |
| N19 | C20 | H15 | 107.9° | 109.5° |
| N19 | C20 | H16 | 107.9° | 109.4° |
| N19 | C18 | C17 | 108.3° | 110.6° |
| N19 | C18 | H13 | 109.8° | 109.2° |
| N19 | C18 | H14 | 109.7° | 109.2° |
| C30 | C29 | H22 | 120.1° | 119.5° |
| C29 | C30 | H23 | 119.8° | 119.5° |
| C17 | N7 | C6 | 122.8° | 123.6° |
| N7 | C17 | C18 | 103.5° | 108.4° |
| N7 | C17 | N3 | 108.5° | 111.4° |
| N7 | C17 | H12 | 111.8° | 108.8° |
| N7 | C6 | O33 | 121.5° | 118.6° |
| N7 | C6 | C5 | 120.1° | 122.9° |
| C18 | C17 | N3 | 110.1° | 109.5° |
| C18 | C17 | H12 | 110.7° | 109.3° |
| C17 | C18 | H13 | 109.8° | 109.3° |
| C17 | C18 | H14 | 109.8° | 109.3° |
| C17 | N3 | C2 | 120.7° | 120.0° |
| C17 | N3 | C4 | 111.1° | 119.9° |
| N3 | C17 | H12 | 111.9° | 109.3° |
| O33 | C6 | C5 | 118.4° | 118.5° |
| O1 | C2 | N3 | 121.1° | 120.0° |
| O1 | C2 | N34 | 121.6° | 120.0° |
| C6 | C5 | C4 | 111.6° | 109.0° |
| C6 | C5 | H6 | 108.9° | 109.5° |
| C6 | C5 | H7 | 108.9° | 109.5° |
| C2 | N3 | C4 | 128.2° | 120.1° |
| N3 | C2 | N34 | 117.3° | 120.0° |
| N3 | C4 | C5 | 103.6° | 107.8° |
| N3 | C4 | H3 | 110.9° | 109.8° |
| N3 | C4 | H4 | 110.9° | 109.8° |
| C2 | N34 | C35 | 123.6° | 120.0° |
| C2 | N34 | H33 | 118.2° | 120.0° |
| C5 | C4 | H3 | 110.9° | 109.8° |
| C5 | C4 | H4 | 110.9° | 109.8° |
| C4 | C5 | H6 | 108.9° | 109.6° |
| C4 | C5 | H7 | 108.9° | 109.6° |
| N34 | C35 | C36 | 111.4° | 109.5° |
| N34 | C35 | H24 | 109.0° | 109.5° |
| N34 | C35 | H25 | 109.0° | 109.5° |
| C35 | N34 | H33 | 118.2° | 120.0° |
| C36 | C37 | C38 | 108.5° | 109.5° |
| C37 | C36 | C35 | 110.6° | 109.5° |
| C37 | C36 | H26 | 109.2° | 109.4° |
| C37 | C36 | H27 | 109.2° | 109.4° |
| C36 | C37 | H28 | 109.7° | 109.5° |
| C36 | C37 | H29 | 109.7° | 109.5° |
| C37 | C38 | F41 | 109.3° | 109.5° |
| C37 | C38 | F42 | 109.2° | 109.5° |
| C37 | C38 | F40 | 110.0° | 109.5° |
| C38 | C37 | H28 | 109.7° | 109.5° |
| C38 | C37 | H29 | 109.7° | 109.5° |
| F41 | C38 | F42 | 109.1° | 109.5° |
| F41 | C38 | F40 | 109.1° | 109.5° |
| C36 | C35 | H24 | 109.0° | 109.5° |
| C36 | C35 | H25 | 109.0° | 109.4° |
| C35 | C36 | H26 | 109.2° | 109.5° |
| C35 | C36 | H27 | 109.2° | 109.5° |
| F42 | C38 | F40 | 110.1° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H3 | C4 | H4 | 109.4° | 109.8° |
| H6 | C5 | H7 | 109.5° | 109.6° |
| H9 | C11 | H10 | 109.5° | 109.5° |
| H9 | C11 | H11 | 109.5° | 109.4° |
| H10 | C11 | H11 | 109.4° | 109.5° |
| H13 | C18 | H14 | 109.5° | 109.3° |
| H15 | C20 | H16 | 109.5° | 109.4° |
| H24 | C35 | H25 | 109.5° | 109.5° |
| H26 | C36 | H27 | 109.4° | 109.5° |
| H28 | C37 | H29 | 109.5° | 109.4° |
| H30 | C46 | H31 | 109.5° | 109.5° |
| H30 | C46 | H32 | 109.5° | 109.5° |
| H31 | C46 | H32 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C25 | C26 | H19 | 180.0° | 180.0° |
| C25 | C24 | C23 | H18 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.0° | 0.0° |
| C25 | C24 | C23 | C22 | 0.0° | 0.0° |
| C25 | C24 | C23 | H17 | 180.0° | 180.0° |
| C24 | C25 | C26 | H20 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 0.1° | 0.0° |
| C25 | C26 | C27 | H20 | 180.0° | 179.9° |
| C25 | C26 | C27 | C22 | 0.1° | 0.0° |
| C25 | C26 | C27 | C28 | 180.0° | 179.9° |
| C26 | C25 | C24 | H18 | 179.9° | 180.0° |
| C24 | C23 | C22 | H17 | 180.0° | 179.9° |
| C24 | C23 | C22 | C27 | 0.2° | 0.0° |
| C24 | C23 | C22 | C21 | 179.4° | 180.0° |
| C23 | C24 | C25 | H19 | 179.9° | 180.0° |
| C11 | C10 | C9 | H1 | 120.3° | 120.1° |
| C11 | C10 | C9 | H2 | 120.2° | 119.9° |
| C11 | C10 | C9 | C46 | 83.7° | 65.0° |
| C11 | C10 | C9 | C8 | 146.2° | 175.0° |
| C11 | C10 | H1 | H2 | 119.2° | 120.0° |
| C11 | C10 | C9 | H5 | 29.5° | 55.0° |
| C10 | C11 | H9 | H10 | 120.0° | 120.1° |
| C10 | C11 | H9 | H11 | 120.0° | 119.9° |
| C10 | C11 | H10 | H11 | 119.9° | 120.0° |
| C26 | C27 | C22 | C23 | 0.3° | 0.0° |
| C26 | C27 | C22 | C28 | 179.9° | 180.0° |
| C26 | C27 | C22 | C21 | 179.5° | 180.0° |
| C26 | C27 | C28 | C29 | 179.8° | 180.0° |
| C27 | C26 | C25 | H19 | 180.0° | 180.0° |
| C26 | C27 | C28 | H21 | 0.2° | 0.0° |
| C23 | C22 | C27 | C21 | 179.2° | 180.0° |
| C23 | C22 | C27 | C28 | 179.9° | 180.0° |
| C23 | C22 | C21 | C20 | 1.4° | 0.0° |
| C23 | C22 | C21 | C30 | 179.3° | 179.7° |
| C22 | C23 | C24 | H18 | 180.0° | 180.0° |
| O32 | C31 | C8 | C9 | 58.0° | 73.2° |
| O32 | C31 | C8 | N19 | 179.7° | 180.0° |
| O32 | C31 | C8 | N7 | 178.3° | 167.1° |
| O32 | C31 | N19 | C20 | 13.0° | 4.3° |
| O32 | C31 | N19 | C18 | 171.1° | 175.7° |
| O32 | C31 | C8 | H8 | 60.5° | 47.2° |
| C10 | C9 | C46 | C8 | 131.8° | 120.0° |
| C10 | C9 | C46 | H5 | 113.2° | 120.0° |
| C10 | C9 | C8 | H5 | 116.8° | 120.1° |
| C10 | C9 | C8 | C31 | 43.4° | 173.7° |
| C10 | C9 | C8 | N7 | 79.7° | 54.5° |
| C9 | C10 | H1 | H2 | 119.2° | 120.0° |
| C10 | C9 | C8 | H8 | 162.2° | 65.8° |
| C9 | C10 | C11 | H9 | 180.0° | 180.0° |
| C9 | C10 | C11 | H10 | 60.0° | 59.9° |
| C9 | C10 | C11 | H11 | 60.0° | 60.0° |
| C10 | C9 | C46 | H30 | 180.0° | 63.9° |
| C10 | C9 | C46 | H31 | 60.0° | 56.0° |
| C10 | C9 | C46 | H32 | 60.0° | 176.1° |
| C22 | C27 | C28 | C29 | 0.1° | 0.0° |
| C27 | C22 | C21 | C20 | 179.4° | 180.0° |
| C27 | C22 | C21 | C30 | 1.5° | 0.2° |
| C27 | C22 | C23 | H17 | 179.8° | 180.0° |
| C22 | C27 | C26 | H20 | 179.8° | 180.0° |
| C22 | C27 | C28 | H21 | 180.0° | 180.0° |
| C28 | C27 | C22 | C21 | 0.7° | 0.0° |
| C27 | C28 | C29 | H21 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.2° |
| C28 | C27 | C26 | H20 | 0.0° | 0.0° |
| C27 | C28 | C29 | H22 | 180.0° | 180.0° |
| C22 | C21 | C20 | C30 | 177.9° | 179.8° |
| C22 | C21 | C20 | N19 | 85.0° | 86.4° |
| C22 | C21 | C30 | C29 | 1.7° | 0.5° |
| C22 | C21 | C20 | H15 | 35.9° | 153.6° |
| C22 | C21 | C20 | H16 | 154.0° | 33.6° |
| C21 | C22 | C23 | H17 | 0.6° | 0.1° |
| C22 | C21 | C30 | H23 | 178.3° | 179.7° |
| C46 | C9 | C8 | H5 | 115.1° | 120.0° |
| C46 | C9 | C8 | C31 | 171.5° | 66.3° |
| C46 | C9 | C8 | N7 | 48.4° | 174.5° |
| C46 | C9 | C10 | H1 | 156.0° | 55.0° |
| C46 | C9 | C10 | H2 | 36.5° | 175.0° |
| C46 | C9 | C8 | H8 | 69.8° | 54.2° |
| C9 | C46 | H30 | H31 | 120.0° | 120.0° |
| C9 | C46 | H30 | H32 | 120.0° | 120.0° |
| C9 | C46 | H31 | H32 | 120.0° | 120.0° |
| C9 | C8 | C31 | N7 | 123.8° | 119.7° |
| C9 | C8 | C31 | H8 | 118.5° | 120.4° |
| C9 | C8 | C31 | N19 | 122.4° | 106.8° |
| C9 | C8 | N7 | H8 | 117.5° | 120.3° |
| C9 | C8 | N7 | C17 | 81.3° | 76.7° |
| C9 | C8 | N7 | C6 | 101.3° | 103.6° |
| C8 | C9 | C10 | H1 | 25.9° | 64.9° |
| C8 | C9 | C10 | H2 | 93.5° | 55.1° |
| C8 | C9 | C46 | H30 | 48.2° | 56.1° |
| C8 | C9 | C46 | H31 | 71.8° | 176.0° |
| C8 | C9 | C46 | H32 | 168.2° | 63.9° |
| C31 | C8 | N7 | H8 | 117.3° | 120.0° |
| C8 | C31 | N19 | C20 | 166.7° | 175.8° |
| C8 | C31 | N19 | C18 | 9.2° | 4.3° |
| C31 | C8 | N7 | C17 | 43.9° | 43.1° |
| C31 | C8 | N7 | C6 | 133.5° | 136.7° |
| C31 | C8 | C9 | H5 | 73.4° | 53.7° |
| N19 | C31 | C8 | N7 | 1.4° | 12.9° |
| C31 | N19 | C20 | C21 | 122.4° | 89.6° |
| C31 | N19 | C20 | C18 | 176.4° | 180.0° |
| C31 | N19 | C18 | C17 | 19.0° | 21.6° |
| N19 | C31 | C8 | H8 | 119.1° | 132.8° |
| C31 | N19 | C18 | H13 | 100.8° | 141.9° |
| C31 | N19 | C18 | H14 | 138.8° | 98.7° |
| C31 | N19 | C20 | H15 | 1.5° | 30.4° |
| C31 | N19 | C20 | H16 | 116.7° | 150.3° |
| C28 | C29 | C30 | C21 | 0.9° | 0.5° |
| C28 | C29 | C30 | H22 | 180.0° | 179.8° |
| C28 | C29 | C30 | H23 | 179.1° | 179.7° |
| C8 | N7 | C17 | C6 | 177.4° | 179.8° |
| C8 | N7 | C17 | C18 | 71.7° | 61.9° |
| C8 | N7 | C17 | N3 | 171.4° | 177.6° |
| C8 | N7 | C6 | O33 | 14.8° | 3.1° |
| C8 | N7 | C6 | C5 | 164.2° | 176.8° |
| N7 | C8 | C9 | H5 | 163.5° | 65.6° |
| C8 | N7 | C17 | H12 | 47.5° | 56.9° |
| C21 | C20 | N19 | H15 | 120.9° | 120.0° |
| C21 | C20 | N19 | H16 | 120.9° | 120.0° |
| C21 | C20 | N19 | C18 | 61.2° | 90.4° |
| C20 | C21 | C30 | C29 | 179.6° | 179.8° |
| C21 | C20 | H15 | H16 | 117.1° | 120.0° |
| C20 | C21 | C30 | H23 | 0.4° | 0.1° |
| C30 | C21 | C20 | N19 | 97.1° | 93.8° |
| C21 | C30 | C29 | H23 | 180.0° | 179.8° |
| C30 | C21 | C20 | H15 | 142.0° | 26.2° |
| C30 | C21 | C20 | H16 | 23.8° | 146.2° |
| C21 | C30 | C29 | H22 | 179.1° | 179.7° |
| C20 | N19 | C18 | C17 | 164.9° | 158.4° |
| C20 | N19 | C18 | H13 | 75.3° | 38.1° |
| C20 | N19 | C18 | H14 | 45.1° | 81.3° |
| N19 | C20 | H15 | H16 | 117.2° | 119.9° |
| N19 | C18 | C17 | N7 | 53.9° | 46.9° |
| N19 | C18 | C17 | H13 | 119.8° | 120.3° |
| N19 | C18 | C17 | H14 | 119.8° | 120.2° |
| N19 | C18 | C17 | N3 | 169.7° | 168.6° |
| N19 | C18 | C17 | H12 | 66.0° | 71.6° |
| N19 | C18 | H13 | H14 | 120.5° | 119.4° |
| C18 | N19 | C20 | H15 | 177.9° | 149.6° |
| C18 | N19 | C20 | H16 | 59.7° | 29.7° |
| C30 | C29 | C28 | H21 | 179.9° | 179.8° |
| N7 | C17 | C18 | N3 | 115.8° | 121.8° |
| N7 | C17 | C18 | H12 | 119.9° | 118.5° |
| N7 | C17 | N3 | H12 | 123.9° | 120.3° |
| C17 | N7 | C6 | O33 | 168.0° | 176.6° |
| C17 | N7 | C6 | C5 | 13.0° | 3.5° |
| N7 | C17 | N3 | C2 | 120.4° | 148.6° |
| N7 | C17 | N3 | C4 | 57.6° | 31.4° |
| C17 | N7 | C8 | H8 | 161.2° | 163.1° |
| N7 | C17 | C18 | H13 | 65.9° | 167.1° |
| N7 | C17 | C18 | H14 | 173.7° | 73.4° |
| C6 | N7 | C17 | C18 | 105.7° | 117.9° |
| C6 | N7 | C17 | N3 | 11.3° | 2.7° |
| N7 | C6 | O33 | C5 | 179.1° | 179.9° |
| N7 | C6 | C5 | C4 | 6.1° | 28.6° |
| N7 | C6 | C5 | H6 | 114.2° | 148.4° |
| N7 | C6 | C5 | H7 | 126.4° | 91.3° |
| C6 | N7 | C8 | H8 | 16.2° | 16.7° |
| C6 | N7 | C17 | H12 | 135.2° | 123.3° |
| C18 | C17 | N3 | H12 | 123.6° | 119.7° |
| C18 | C17 | N3 | C2 | 127.0° | 91.5° |
| C18 | C17 | N3 | C4 | 55.0° | 88.5° |
| C17 | C18 | H13 | H14 | 120.6° | 119.5° |
| C17 | N3 | C2 | O1 | 14.8° | 175.1° |
| C17 | N3 | C2 | C4 | 177.6° | 180.0° |
| C17 | N3 | C2 | N34 | 164.6° | 4.9° |
| C17 | N3 | C4 | C5 | 75.4° | 56.8° |
| C17 | N3 | C4 | H3 | 43.7° | 62.8° |
| C17 | N3 | C4 | H4 | 165.6° | 176.4° |
| N3 | C17 | C18 | H13 | 49.9° | 71.1° |
| N3 | C17 | C18 | H14 | 70.5° | 48.4° |
| O33 | C6 | C5 | C4 | 173.0° | 151.5° |
| O33 | C6 | C5 | H6 | 66.7° | 31.7° |
| O33 | C6 | C5 | H7 | 52.7° | 88.6° |
| O1 | C2 | N3 | N34 | 179.4° | 179.9° |
| O1 | C2 | N3 | C4 | 167.5° | 5.0° |
| O1 | C2 | N34 | C35 | 0.5° | 5.2° |
| O1 | C2 | N34 | H33 | 179.5° | 174.8° |
| C6 | C5 | C4 | N3 | 46.1° | 50.8° |
| C6 | C5 | C4 | H6 | 120.3° | 119.8° |
| C6 | C5 | C4 | H7 | 120.3° | 119.9° |
| C6 | C5 | C4 | H3 | 72.9° | 68.8° |
| C6 | C5 | C4 | H4 | 165.2° | 170.4° |
| C6 | C5 | H6 | H7 | 119.0° | 120.2° |
| C2 | N3 | C4 | C5 | 102.5° | 123.2° |
| N3 | C2 | N34 | C35 | 179.9° | 174.8° |
| C2 | N3 | C4 | H3 | 138.5° | 117.2° |
| C2 | N3 | C4 | H4 | 16.6° | 3.6° |
| C2 | N3 | C17 | H12 | 3.5° | 28.2° |
| N3 | C2 | N34 | H33 | 0.1° | 5.2° |
| C4 | N3 | C2 | N34 | 13.0° | 175.1° |
| N3 | C4 | C5 | H3 | 119.1° | 119.6° |
| N3 | C4 | C5 | H4 | 119.1° | 119.6° |
| N3 | C4 | H3 | H4 | 122.7° | 120.8° |
| N3 | C4 | C5 | H6 | 74.2° | 170.6° |
| N3 | C4 | C5 | H7 | 166.5° | 69.1° |
| C4 | N3 | C17 | H12 | 178.5° | 151.8° |
| C2 | N34 | C35 | H33 | 180.0° | 180.0° |
| C2 | N34 | C35 | C36 | 70.8° | 180.0° |
| C2 | N34 | C35 | H24 | 49.5° | 60.0° |
| C2 | N34 | C35 | H25 | 168.9° | 60.0° |
| C5 | C4 | H3 | H4 | 122.7° | 120.8° |
| C4 | C5 | H6 | H7 | 119.0° | 120.3° |
| N34 | C35 | C36 | C37 | 146.0° | 180.0° |
| N34 | C35 | C36 | H24 | 120.3° | 120.0° |
| N34 | C35 | C36 | H25 | 120.3° | 120.0° |
| N34 | C35 | H24 | H25 | 119.1° | 120.0° |
| N34 | C35 | C36 | H26 | 25.8° | 60.0° |
| N34 | C35 | C36 | H27 | 93.8° | 60.0° |
| C36 | C37 | C38 | H28 | 119.8° | 120.0° |
| C36 | C37 | C38 | H29 | 119.9° | 120.0° |
| C36 | C37 | C38 | F41 | 123.1° | 60.0° |
| C37 | C36 | C35 | H26 | 120.2° | 120.0° |
| C37 | C36 | C35 | H27 | 120.2° | 120.0° |
| C36 | C37 | C38 | F42 | 117.7° | 60.0° |
| C36 | C37 | C38 | F40 | 3.3° | 180.0° |
| C37 | C36 | C35 | H24 | 25.7° | 60.0° |
| C37 | C36 | C35 | H25 | 93.8° | 60.0° |
| C37 | C36 | H26 | H27 | 119.5° | 119.9° |
| C36 | C37 | H28 | H29 | 120.5° | 120.0° |
| C37 | C38 | F41 | F42 | 119.3° | 120.0° |
| C37 | C38 | F41 | F40 | 120.4° | 120.0° |
| C38 | C37 | C36 | C35 | 147.9° | 180.0° |
| C37 | C38 | F42 | F40 | 120.9° | 120.0° |
| C38 | C37 | C36 | H26 | 91.9° | 60.0° |
| C38 | C37 | C36 | H27 | 27.7° | 60.0° |
| C38 | C37 | H28 | H29 | 120.4° | 120.0° |
| F41 | C38 | F42 | F40 | 119.7° | 120.0° |
| F41 | C38 | C37 | H28 | 3.2° | 180.0° |
| F41 | C38 | C37 | H29 | 117.1° | 60.0° |
| C36 | C35 | H24 | H25 | 119.2° | 120.0° |
| C35 | C36 | H26 | H27 | 119.5° | 120.1° |
| C35 | C36 | C37 | H28 | 92.3° | 60.0° |
| C35 | C36 | C37 | H29 | 28.1° | 60.0° |
| C36 | C35 | N34 | H33 | 109.2° | 0.0° |
| F42 | C38 | C37 | H28 | 122.5° | 60.0° |
| F42 | C38 | C37 | H29 | 2.2° | 180.0° |
| F40 | C38 | C37 | H28 | 116.6° | 60.0° |
| F40 | C38 | C37 | H29 | 123.1° | 60.0° |
| H1 | C10 | C9 | H5 | 90.8° | 175.0° |
| H1 | C10 | C11 | H9 | 59.7° | 59.9° |
| H1 | C10 | C11 | H10 | 60.3° | 180.0° |
| H1 | C10 | C11 | H11 | 179.7° | 60.0° |
| H2 | C10 | C9 | H5 | 149.7° | 65.0° |
| H2 | C10 | C11 | H9 | 59.7° | 60.1° |
| H2 | C10 | C11 | H10 | 179.8° | 60.0° |
| H2 | C10 | C11 | H11 | 60.3° | 180.0° |
| H3 | C4 | C5 | H6 | 166.8° | 51.0° |
| H3 | C4 | C5 | H7 | 47.4° | 171.3° |
| H4 | C4 | C5 | H6 | 44.9° | 69.8° |
| H4 | C4 | C5 | H7 | 74.4° | 50.5° |
| H5 | C9 | C8 | H8 | 45.3° | 174.2° |
| H5 | C9 | C46 | H30 | 66.9° | 176.0° |
| H5 | C9 | C46 | H31 | 173.1° | 64.0° |
| H5 | C9 | C46 | H32 | 53.2° | 56.0° |
| H9 | C11 | H10 | H11 | 120.0° | 120.0° |
| H12 | C17 | C18 | H13 | 174.2° | 48.6° |
| H12 | C17 | C18 | H14 | 53.8° | 168.2° |
| H17 | C23 | C24 | H18 | 0.0° | 0.0° |
| H18 | C24 | C25 | H19 | 0.1° | 0.0° |
| H19 | C25 | C26 | H20 | 0.0° | 0.0° |
| H21 | C28 | C29 | H22 | 0.1° | 0.0° |
| H22 | C29 | C30 | H23 | 0.9° | 0.1° |
| H24 | C35 | C36 | H26 | 94.5° | 60.0° |
| H24 | C35 | C36 | H27 | 145.9° | 180.0° |
| H24 | C35 | N34 | H33 | 130.5° | 120.0° |
| H25 | C35 | C36 | H26 | 146.1° | 180.0° |
| H25 | C35 | C36 | H27 | 26.5° | 60.0° |
| H25 | C35 | N34 | H33 | 11.1° | 120.0° |
| H26 | C36 | C37 | H28 | 27.9° | 180.0° |
| H26 | C36 | C37 | H29 | 148.2° | 60.0° |
| H27 | C36 | C37 | H28 | 147.5° | 60.0° |
| H27 | C36 | C37 | H29 | 92.1° | 180.0° |
| H30 | C46 | H31 | H32 | 120.0° | 120.0° |
