9A2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F42 | C38 | sing | 1.40Å | 1.32Å | |
| F41 | C38 | sing | 1.40Å | 1.32Å | |
| C38 | C37 | sing | 1.53Å | 1.49Å | |
| C38 | F40 | sing | 1.40Å | 1.33Å | |
| C37 | C36 | sing | 1.53Å | 1.50Å | |
| C36 | C35 | sing | 1.53Å | 1.51Å | |
| C35 | N34 | sing | 1.46Å | 1.45Å | |
| N34 | C2 | sing | 1.35Å | 1.35Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | N3 | sing | 1.47Å | 1.46Å | |
| C5 | C6 | sing | 1.50Å | 1.53Å | |
| C2 | N3 | sing | 1.35Å | 1.34Å | |
| C2 | O1 | doub | 1.22Å | 1.23Å | |
| N3 | C17 | sing | 1.46Å | 1.48Å | |
| C6 | O33 | doub | 1.21Å | 1.22Å | |
| C6 | N7 | sing | 1.34Å | 1.35Å | |
| C17 | N7 | sing | 1.46Å | 1.46Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| N7 | C8 | sing | 1.47Å | 1.49Å | |
| C18 | N19 | sing | 1.46Å | 1.48Å | |
| C28 | C29 | doub | 1.36Å | 1.39Å | Aromatic |
| C28 | C27 | sing | 1.41Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.39Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.40Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.36Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.54Å | |
| C27 | C22 | sing | 1.42Å | 1.41Å | Aromatic |
| C30 | C21 | doub | 1.36Å | 1.41Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.56Å | |
| C8 | C31 | sing | 1.50Å | 1.49Å | |
| C25 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| N19 | C31 | sing | 1.33Å | 1.35Å | |
| N19 | C20 | sing | 1.46Å | 1.48Å | |
| C22 | C21 | sing | 1.41Å | 1.41Å | Aromatic |
| C22 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| C21 | C20 | sing | 1.51Å | 1.49Å | |
| C9 | C46 | sing | 1.53Å | 1.55Å | |
| C24 | C23 | sing | 1.36Å | 1.39Å | Aromatic |
| C31 | O32 | doub | 1.21Å | 1.23Å | |
| C20 | C51 | sing | 1.53Å | 1.52Å | |
| 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 | |
| C37 | H6 | sing | 1.09Å | 1.10Å | |
| C37 | H7 | sing | 1.09Å | 1.10Å | |
| C36 | H8 | sing | 1.09Å | 1.10Å | |
| C36 | H9 | sing | 1.09Å | 1.10Å | |
| C35 | H10 | sing | 1.09Å | 1.10Å | |
| C35 | H11 | sing | 1.09Å | 1.10Å | |
| N34 | H12 | sing | 0.97Å | 1.00Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C5 | H14 | sing | 1.09Å | 1.10Å | |
| C5 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C8 | H18 | sing | 1.09Å | 1.10Å | |
| C46 | H19 | sing | 1.09Å | 1.10Å | |
| C46 | H20 | sing | 1.09Å | 1.10Å | |
| C46 | H21 | sing | 1.09Å | 1.10Å | |
| C11 | H22 | sing | 1.09Å | 1.10Å | |
| C11 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C51 | H26 | sing | 1.09Å | 1.10Å | |
| C51 | H27 | sing | 1.09Å | 1.10Å | |
| C51 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.08Å | 1.08Å | |
| C29 | H30 | sing | 1.08Å | 1.08Å | |
| C28 | H31 | sing | 1.08Å | 1.08Å | |
| C26 | H32 | sing | 1.08Å | 1.08Å | |
| C25 | H33 | sing | 1.08Å | 1.08Å | |
| C24 | H34 | sing | 1.08Å | 1.08Å | |
| C23 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F42 | C38 | F41 | 109.2° | 109.4° |
| F42 | C38 | C37 | 109.0° | 109.5° |
| F42 | C38 | F40 | 111.9° | 109.5° |
| F41 | C38 | C37 | 106.5° | 109.5° |
| F41 | C38 | F40 | 111.1° | 109.5° |
| C37 | C38 | F40 | 109.0° | 109.5° |
| C38 | C37 | C36 | 111.6° | 109.5° |
| C38 | C37 | H6 | 108.9° | 109.4° |
| C38 | C37 | H7 | 109.0° | 109.4° |
| C37 | C36 | C35 | 108.5° | 109.5° |
| C36 | C37 | H6 | 109.0° | 109.6° |
| C36 | C37 | H7 | 109.0° | 109.5° |
| C37 | C36 | H8 | 109.7° | 109.5° |
| C37 | C36 | H9 | 109.7° | 109.5° |
| C36 | C35 | N34 | 109.7° | 109.5° |
| C35 | C36 | H8 | 109.7° | 109.5° |
| C35 | C36 | H9 | 109.7° | 109.5° |
| C36 | C35 | H10 | 109.4° | 109.4° |
| C36 | C35 | H11 | 109.4° | 109.5° |
| C35 | N34 | C2 | 123.6° | 120.0° |
| N34 | C35 | H10 | 109.4° | 109.5° |
| N34 | C35 | H11 | 109.4° | 109.5° |
| C35 | N34 | H12 | 118.2° | 120.1° |
| N34 | C2 | N3 | 119.5° | 120.0° |
| N34 | C2 | O1 | 121.9° | 120.0° |
| C2 | N34 | H12 | 118.2° | 119.9° |
| C5 | C4 | N3 | 102.2° | 107.8° |
| C4 | C5 | C6 | 110.5° | 109.0° |
| C5 | C4 | H3 | 111.3° | 109.8° |
| C5 | C4 | H4 | 111.2° | 109.8° |
| C4 | C5 | H14 | 109.2° | 109.6° |
| C4 | C5 | H15 | 109.2° | 109.5° |
| C4 | N3 | C2 | 127.9° | 120.0° |
| C4 | N3 | C17 | 113.8° | 119.9° |
| N3 | C4 | H3 | 111.2° | 109.8° |
| N3 | C4 | H4 | 111.3° | 109.8° |
| C5 | C6 | O33 | 117.8° | 118.5° |
| C5 | C6 | N7 | 120.6° | 123.0° |
| C6 | C5 | H14 | 109.2° | 109.6° |
| C6 | C5 | H15 | 109.2° | 109.5° |
| N3 | C2 | O1 | 118.6° | 120.0° |
| C2 | N3 | C17 | 118.1° | 120.1° |
| N3 | C17 | N7 | 112.0° | 111.5° |
| N3 | C17 | C18 | 113.0° | 109.5° |
| N3 | C17 | H13 | 109.0° | 109.3° |
| O33 | C6 | N7 | 121.6° | 118.6° |
| C6 | N7 | C17 | 121.6° | 123.6° |
| C6 | N7 | C8 | 123.0° | 119.3° |
| N7 | C17 | C18 | 105.2° | 108.4° |
| C17 | N7 | C8 | 115.4° | 117.0° |
| N7 | C17 | H13 | 109.2° | 109.3° |
| C17 | C18 | N19 | 107.9° | 110.6° |
| C18 | C17 | H13 | 108.3° | 108.7° |
| C17 | C18 | H16 | 109.9° | 109.2° |
| C17 | C18 | H17 | 109.9° | 109.2° |
| N7 | C8 | C9 | 112.8° | 109.6° |
| N7 | C8 | C31 | 112.2° | 108.8° |
| N7 | C8 | H18 | 108.1° | 109.6° |
| C18 | N19 | C31 | 127.1° | 124.5° |
| C18 | N19 | C20 | 113.2° | 117.7° |
| N19 | C18 | H16 | 109.9° | 109.3° |
| N19 | C18 | H17 | 109.8° | 109.3° |
| C29 | C28 | C27 | 120.3° | 119.6° |
| C28 | C29 | C30 | 119.4° | 121.0° |
| C28 | C29 | H30 | 120.3° | 119.5° |
| C29 | C28 | H31 | 119.9° | 120.2° |
| C28 | C27 | C26 | 118.5° | 121.3° |
| C28 | C27 | C22 | 121.0° | 119.3° |
| C27 | C28 | H31 | 119.8° | 120.1° |
| C29 | C30 | C21 | 120.8° | 121.0° |
| C29 | C30 | H29 | 119.6° | 119.6° |
| C30 | C29 | H30 | 120.3° | 119.5° |
| C27 | C26 | C25 | 120.1° | 119.7° |
| C26 | C27 | C22 | 120.5° | 119.4° |
| C27 | C26 | H32 | 119.9° | 120.2° |
| C26 | C25 | C24 | 120.6° | 120.9° |
| C25 | C26 | H32 | 120.0° | 120.1° |
| C26 | C25 | H33 | 119.7° | 119.5° |
| C11 | C10 | C9 | 112.4° | 109.5° |
| C11 | C10 | H1 | 108.7° | 109.5° |
| C11 | C10 | H2 | 108.8° | 109.5° |
| C10 | C11 | H22 | 109.5° | 109.4° |
| C10 | C11 | H23 | 109.4° | 109.4° |
| C10 | C11 | H24 | 109.5° | 109.5° |
| C10 | C9 | C8 | 111.1° | 109.5° |
| C10 | C9 | C46 | 110.2° | 109.5° |
| C9 | C10 | H1 | 108.8° | 109.5° |
| C9 | C10 | H2 | 108.7° | 109.5° |
| C10 | C9 | H5 | 106.0° | 109.5° |
| C27 | C22 | C21 | 118.7° | 119.4° |
| C27 | C22 | C23 | 118.2° | 119.3° |
| C30 | C21 | C22 | 119.7° | 119.6° |
| C30 | C21 | C20 | 121.0° | 120.2° |
| C21 | C30 | H29 | 119.6° | 119.4° |
| C9 | C8 | C31 | 108.2° | 109.6° |
| C8 | C9 | C46 | 117.2° | 109.5° |
| C8 | C9 | H5 | 105.7° | 109.4° |
| C9 | C8 | H18 | 107.3° | 109.5° |
| C8 | C31 | N19 | 118.2° | 123.1° |
| C8 | C31 | O32 | 117.0° | 118.4° |
| C31 | C8 | H18 | 108.1° | 109.7° |
| C25 | C24 | C23 | 119.8° | 121.0° |
| C24 | C25 | H33 | 119.7° | 119.5° |
| C25 | C24 | H34 | 120.1° | 119.5° |
| C31 | N19 | C20 | 119.7° | 117.8° |
| N19 | C31 | O32 | 124.8° | 118.5° |
| N19 | C20 | C21 | 113.2° | 109.4° |
| N19 | C20 | C51 | 108.7° | 109.5° |
| N19 | C20 | H25 | 106.9° | 109.5° |
| C21 | C22 | C23 | 123.1° | 121.3° |
| C22 | C21 | C20 | 119.3° | 120.2° |
| C22 | C23 | C24 | 120.8° | 119.7° |
| C22 | C23 | H35 | 119.6° | 120.2° |
| C21 | C20 | C51 | 114.3° | 109.5° |
| C21 | C20 | H25 | 106.7° | 109.4° |
| C46 | C9 | H5 | 105.8° | 109.4° |
| C9 | C46 | H19 | 109.5° | 109.5° |
| C9 | C46 | H20 | 109.5° | 109.5° |
| C9 | C46 | H21 | 109.5° | 109.4° |
| C23 | C24 | H34 | 120.1° | 119.5° |
| C24 | C23 | H35 | 119.6° | 120.1° |
| C51 | C20 | H25 | 106.4° | 109.5° |
| C20 | C51 | H26 | 109.5° | 109.5° |
| C20 | C51 | H27 | 109.4° | 109.5° |
| C20 | C51 | H28 | 109.4° | 109.4° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H3 | C4 | H4 | 109.4° | 109.8° |
| H6 | C37 | H7 | 109.4° | 109.5° |
| H8 | C36 | H9 | 109.4° | 109.4° |
| H10 | C35 | H11 | 109.5° | 109.5° |
| H14 | C5 | H15 | 109.5° | 109.6° |
| H16 | C18 | H17 | 109.5° | 109.2° |
| H19 | C46 | H20 | 109.4° | 109.5° |
| H19 | C46 | H21 | 109.5° | 109.5° |
| H20 | C46 | H21 | 109.5° | 109.5° |
| H22 | C11 | H23 | 109.5° | 109.5° |
| H22 | C11 | H24 | 109.5° | 109.5° |
| H23 | C11 | H24 | 109.5° | 109.5° |
| H26 | C51 | H27 | 109.5° | 109.5° |
| H26 | C51 | H28 | 109.5° | 109.4° |
| H27 | C51 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F42 | C38 | F41 | C37 | 117.5° | 120.0° |
| F42 | C38 | F41 | F40 | 123.9° | 120.0° |
| F42 | C38 | C37 | F40 | 122.4° | 120.0° |
| F42 | C38 | C37 | C36 | 56.8° | 60.0° |
| F42 | C38 | C37 | H6 | 63.5° | 179.9° |
| F42 | C38 | C37 | H7 | 177.2° | 60.0° |
| F41 | C38 | C37 | F40 | 119.9° | 120.0° |
| F41 | C38 | C37 | C36 | 174.5° | 180.0° |
| F41 | C38 | C37 | H6 | 54.2° | 59.9° |
| F41 | C38 | C37 | H7 | 65.1° | 60.0° |
| C38 | C37 | C36 | H6 | 120.3° | 120.0° |
| C38 | C37 | C36 | H7 | 120.3° | 119.9° |
| C38 | C37 | C36 | C35 | 178.5° | 180.0° |
| C38 | C37 | H6 | H7 | 119.0° | 119.9° |
| C38 | C37 | C36 | H8 | 58.7° | 60.0° |
| C38 | C37 | C36 | H9 | 61.6° | 60.0° |
| F40 | C38 | C37 | C36 | 65.6° | 60.0° |
| F40 | C38 | C37 | H6 | 174.1° | 60.1° |
| F40 | C38 | C37 | H7 | 54.8° | 180.0° |
| C37 | C36 | C35 | H8 | 119.9° | 120.0° |
| C37 | C36 | C35 | H9 | 119.9° | 120.0° |
| C37 | C36 | C35 | N34 | 169.2° | 179.9° |
| C36 | C37 | H6 | H7 | 119.1° | 120.1° |
| C37 | C36 | H8 | H9 | 120.5° | 120.0° |
| C37 | C36 | C35 | H10 | 70.8° | 60.0° |
| C37 | C36 | C35 | H11 | 49.2° | 60.0° |
| C36 | C35 | N34 | H10 | 120.0° | 119.9° |
| C36 | C35 | N34 | H11 | 120.0° | 120.0° |
| C36 | C35 | N34 | C2 | 65.6° | 180.0° |
| C35 | C36 | C37 | H6 | 61.2° | 60.0° |
| C35 | C36 | C37 | H7 | 58.2° | 60.0° |
| C35 | C36 | H8 | H9 | 120.4° | 120.0° |
| C36 | C35 | H10 | H11 | 119.9° | 120.0° |
| C36 | C35 | N34 | H12 | 114.3° | 0.1° |
| C35 | N34 | C2 | H12 | 180.0° | 180.0° |
| C35 | N34 | C2 | N3 | 174.3° | 175.1° |
| C35 | N34 | C2 | O1 | 5.6° | 5.0° |
| N34 | C35 | C36 | H8 | 49.3° | 60.0° |
| N34 | C35 | C36 | H9 | 71.0° | 59.9° |
| N34 | C35 | H10 | H11 | 119.9° | 120.0° |
| N34 | C2 | N3 | C4 | 19.6° | 174.8° |
| N34 | C2 | N3 | O1 | 179.9° | 179.9° |
| N34 | C2 | N3 | C17 | 154.7° | 5.2° |
| C2 | N34 | C35 | H10 | 174.3° | 60.0° |
| C2 | N34 | C35 | H11 | 54.4° | 60.0° |
| C5 | C4 | N3 | H3 | 118.9° | 119.6° |
| C5 | C4 | N3 | H4 | 118.8° | 119.6° |
| C4 | C5 | C6 | H14 | 120.2° | 119.9° |
| C4 | C5 | C6 | H15 | 120.2° | 119.8° |
| C5 | C4 | N3 | C2 | 104.4° | 123.3° |
| C5 | C4 | N3 | C17 | 70.1° | 56.6° |
| C4 | C5 | C6 | O33 | 149.6° | 151.4° |
| C4 | C5 | C6 | N7 | 29.4° | 28.5° |
| C5 | C4 | H3 | H4 | 123.4° | 120.8° |
| C4 | C5 | H14 | H15 | 119.5° | 120.2° |
| N3 | C4 | C5 | C6 | 57.7° | 50.8° |
| C4 | N3 | C2 | C17 | 174.3° | 180.0° |
| C4 | N3 | C2 | O1 | 160.3° | 5.2° |
| C4 | N3 | C17 | N7 | 48.0° | 31.1° |
| C4 | N3 | C17 | C18 | 70.5° | 88.9° |
| N3 | C4 | H3 | H4 | 123.4° | 120.8° |
| C4 | N3 | C17 | H13 | 169.0° | 152.1° |
| N3 | C4 | C5 | H14 | 177.9° | 170.7° |
| N3 | C4 | C5 | H15 | 62.5° | 69.0° |
| C5 | C6 | O33 | N7 | 179.0° | 179.9° |
| C5 | C6 | N7 | C17 | 5.3° | 3.2° |
| C5 | C6 | N7 | C8 | 177.5° | 176.6° |
| C6 | C5 | C4 | H3 | 176.5° | 68.8° |
| C6 | C5 | C4 | H4 | 61.2° | 170.4° |
| C6 | C5 | H14 | H15 | 119.5° | 120.2° |
| C2 | N3 | C17 | N7 | 127.1° | 148.9° |
| C2 | N3 | C17 | C18 | 114.4° | 91.1° |
| C2 | N3 | C4 | H3 | 14.5° | 117.1° |
| C2 | N3 | C4 | H4 | 136.8° | 3.7° |
| N3 | C2 | N34 | H12 | 5.6° | 4.9° |
| C2 | N3 | C17 | H13 | 6.1° | 27.9° |
| O1 | C2 | N3 | C17 | 25.4° | 174.9° |
| O1 | C2 | N34 | H12 | 174.4° | 175.0° |
| N3 | C17 | N7 | C6 | 12.6° | 2.3° |
| N3 | C17 | N7 | C18 | 123.1° | 120.6° |
| N3 | C17 | N7 | H13 | 120.8° | 121.0° |
| N3 | C17 | C18 | H13 | 120.8° | 119.4° |
| N3 | C17 | N7 | C8 | 170.0° | 177.4° |
| N3 | C17 | C18 | N19 | 177.2° | 168.8° |
| C17 | N3 | C4 | H3 | 171.0° | 62.9° |
| C17 | N3 | C4 | H4 | 48.7° | 176.2° |
| N3 | C17 | C18 | H16 | 63.0° | 70.9° |
| N3 | C17 | C18 | H17 | 57.5° | 48.5° |
| O33 | C6 | N7 | C17 | 173.7° | 176.7° |
| O33 | C6 | N7 | C8 | 3.4° | 3.5° |
| O33 | C6 | C5 | H14 | 29.5° | 31.5° |
| O33 | C6 | C5 | H15 | 90.2° | 88.8° |
| C6 | N7 | C17 | C8 | 177.4° | 179.8° |
| C6 | N7 | C17 | C18 | 110.4° | 118.3° |
| C6 | N7 | C8 | C9 | 100.5° | 103.1° |
| C6 | N7 | C8 | C31 | 137.0° | 137.1° |
| C6 | N7 | C17 | H13 | 133.5° | 123.3° |
| N7 | C6 | C5 | H14 | 149.6° | 148.4° |
| N7 | C6 | C5 | H15 | 90.7° | 91.3° |
| C6 | N7 | C8 | H18 | 17.9° | 17.1° |
| N7 | C17 | C18 | H13 | 116.7° | 118.7° |
| N7 | C17 | C18 | N19 | 54.7° | 46.9° |
| C17 | N7 | C8 | C9 | 82.2° | 76.7° |
| C17 | N7 | C8 | C31 | 40.3° | 43.1° |
| N7 | C17 | C18 | H16 | 174.5° | 167.2° |
| N7 | C17 | C18 | H17 | 65.0° | 73.4° |
| C17 | N7 | C8 | H18 | 159.4° | 163.1° |
| C18 | C17 | N7 | C8 | 67.0° | 61.9° |
| C17 | C18 | N19 | H16 | 119.8° | 120.3° |
| C17 | C18 | N19 | H17 | 119.8° | 120.3° |
| C17 | C18 | N19 | C31 | 24.1° | 21.6° |
| C17 | C18 | N19 | C20 | 155.5° | 158.4° |
| C17 | C18 | H16 | H17 | 120.7° | 119.4° |
| N7 | C8 | C9 | C10 | 49.3° | 177.7° |
| N7 | C8 | C9 | C31 | 124.7° | 119.3° |
| N7 | C8 | C9 | H18 | 119.0° | 120.3° |
| N7 | C8 | C31 | H18 | 119.1° | 119.9° |
| N7 | C8 | C31 | N19 | 3.5° | 12.9° |
| N7 | C8 | C9 | C46 | 78.7° | 62.2° |
| N7 | C8 | C31 | O32 | 179.0° | 167.1° |
| N7 | C8 | C9 | H5 | 163.8° | 57.8° |
| C8 | N7 | C17 | H13 | 49.1° | 56.5° |
| C18 | N19 | C31 | C8 | 2.8° | 4.2° |
| C18 | N19 | C31 | C20 | 179.6° | 180.0° |
| C18 | N19 | C20 | C21 | 39.5° | 114.8° |
| C18 | N19 | C31 | O32 | 174.6° | 175.8° |
| C18 | N19 | C20 | C51 | 88.7° | 5.3° |
| N19 | C18 | C17 | H13 | 62.0° | 71.9° |
| N19 | C18 | H16 | H17 | 120.7° | 119.5° |
| C18 | N19 | C20 | H25 | 156.8° | 125.3° |
| C29 | C28 | C27 | H31 | 180.0° | 180.0° |
| C28 | C29 | C30 | H30 | 180.0° | 180.0° |
| C29 | C28 | C27 | C26 | 179.4° | 180.0° |
| C29 | C28 | C27 | C22 | 0.6° | 0.3° |
| C28 | C29 | C30 | C21 | 0.1° | 0.0° |
| C28 | C29 | C30 | H29 | 179.9° | 180.0° |
| C27 | C28 | C29 | C30 | 0.3° | 0.0° |
| C28 | C27 | C26 | C22 | 178.8° | 179.7° |
| C28 | C27 | C26 | C25 | 178.8° | 180.0° |
| C28 | C27 | C22 | C21 | 0.4° | 0.6° |
| C28 | C27 | C22 | C23 | 179.9° | 180.0° |
| C27 | C28 | C29 | H30 | 179.7° | 180.0° |
| C28 | C27 | C26 | H32 | 1.2° | 0.1° |
| C29 | C30 | C21 | H29 | 180.0° | 180.0° |
| C29 | C30 | C21 | C22 | 0.3° | 0.3° |
| C29 | C30 | C21 | C20 | 179.8° | 180.0° |
| C30 | C29 | C28 | H31 | 179.7° | 180.0° |
| C27 | C26 | C25 | H32 | 180.0° | 179.9° |
| C27 | C26 | C25 | C24 | 1.6° | 0.0° |
| C26 | C27 | C22 | C21 | 179.2° | 179.8° |
| C26 | C27 | C22 | C23 | 1.1° | 0.3° |
| C26 | C27 | C28 | H31 | 0.6° | 0.1° |
| C27 | C26 | C25 | H33 | 178.5° | 180.0° |
| C25 | C26 | C27 | C22 | 0.0° | 0.3° |
| C26 | C25 | C24 | H33 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 2.0° | 0.3° |
| C26 | C25 | C24 | H34 | 178.0° | 180.0° |
| C11 | C10 | C9 | H1 | 120.4° | 120.0° |
| C11 | C10 | C9 | H2 | 120.5° | 120.0° |
| C11 | C10 | C9 | C8 | 174.1° | 175.5° |
| C11 | C10 | C9 | C46 | 54.3° | 64.4° |
| C11 | C10 | H1 | H2 | 118.7° | 120.0° |
| C11 | C10 | C9 | H5 | 59.7° | 55.5° |
| C10 | C11 | H22 | H23 | 120.0° | 119.9° |
| C10 | C11 | H22 | H24 | 120.0° | 120.0° |
| C10 | C11 | H23 | H24 | 120.0° | 120.0° |
| C10 | C9 | C8 | C46 | 128.0° | 120.1° |
| C10 | C9 | C8 | H5 | 114.5° | 120.0° |
| C10 | C9 | C8 | C31 | 174.0° | 58.4° |
| C10 | C9 | C46 | H5 | 114.1° | 120.0° |
| C9 | C10 | H1 | H2 | 118.6° | 120.0° |
| C10 | C9 | C8 | H18 | 69.7° | 62.0° |
| C10 | C9 | C46 | H19 | 180.0° | 180.0° |
| C10 | C9 | C46 | H20 | 60.0° | 60.0° |
| C10 | C9 | C46 | H21 | 60.0° | 60.1° |
| C9 | C10 | C11 | H22 | 180.0° | 180.0° |
| C9 | C10 | C11 | H23 | 60.0° | 60.0° |
| C9 | C10 | C11 | H24 | 60.0° | 60.0° |
| C27 | C22 | C21 | C30 | 0.0° | 0.5° |
| C27 | C22 | C21 | C23 | 179.7° | 179.4° |
| C27 | C22 | C21 | C20 | 180.0° | 179.7° |
| C27 | C22 | C23 | C24 | 0.7° | 0.0° |
| C22 | C27 | C28 | H31 | 179.4° | 179.7° |
| C22 | C27 | C26 | H32 | 180.0° | 179.7° |
| C27 | C22 | C23 | H35 | 179.3° | 179.9° |
| C30 | C21 | C20 | N19 | 106.3° | 24.9° |
| C30 | C21 | C22 | C20 | 180.0° | 179.8° |
| C30 | C21 | C22 | C23 | 179.7° | 180.0° |
| C30 | C21 | C20 | C51 | 19.0° | 95.2° |
| C30 | C21 | C20 | H25 | 136.3° | 144.9° |
| C21 | C30 | C29 | H30 | 179.9° | 180.0° |
| C9 | C8 | C31 | H18 | 115.8° | 120.3° |
| C9 | C8 | C31 | N19 | 121.6° | 106.9° |
| C8 | C9 | C46 | H5 | 117.5° | 120.0° |
| C9 | C8 | C31 | O32 | 56.0° | 73.1° |
| C8 | C9 | C10 | H1 | 65.5° | 55.5° |
| C8 | C9 | C10 | H2 | 53.6° | 64.5° |
| C8 | C9 | C46 | H19 | 51.6° | 59.9° |
| C8 | C9 | C46 | H20 | 171.6° | 180.0° |
| C8 | C9 | C46 | H21 | 68.4° | 60.0° |
| C8 | C31 | N19 | O32 | 177.4° | 180.0° |
| C8 | C31 | N19 | C20 | 177.5° | 175.7° |
| C31 | C8 | C9 | C46 | 46.0° | 178.5° |
| C31 | C8 | C9 | H5 | 71.5° | 61.5° |
| C25 | C24 | C23 | C22 | 0.9° | 0.3° |
| C25 | C24 | C23 | H34 | 180.0° | 179.7° |
| C24 | C25 | C26 | H32 | 178.4° | 180.0° |
| C25 | C24 | C23 | H35 | 179.1° | 179.8° |
| C31 | N19 | C20 | C21 | 140.8° | 65.3° |
| C31 | N19 | C20 | C51 | 91.0° | 174.7° |
| C31 | N19 | C18 | H16 | 143.9° | 141.9° |
| C31 | N19 | C18 | H17 | 95.6° | 98.7° |
| N19 | C31 | C8 | H18 | 122.6° | 132.8° |
| C31 | N19 | C20 | H25 | 23.5° | 54.6° |
| N19 | C20 | C21 | C22 | 73.6° | 154.9° |
| N19 | C20 | C21 | C51 | 125.3° | 120.1° |
| N19 | C20 | C21 | H25 | 117.4° | 120.0° |
| C20 | N19 | C31 | O32 | 5.1° | 4.3° |
| N19 | C20 | C51 | H25 | 114.9° | 120.1° |
| C20 | N19 | C18 | H16 | 35.8° | 38.1° |
| C20 | N19 | C18 | H17 | 84.7° | 81.3° |
| N19 | C20 | C51 | H26 | 180.0° | 59.9° |
| N19 | C20 | C51 | H27 | 60.0° | 180.0° |
| N19 | C20 | C51 | H28 | 60.0° | 60.0° |
| C21 | C22 | C23 | C24 | 179.6° | 179.5° |
| C22 | C21 | C20 | C51 | 161.1° | 85.1° |
| C22 | C21 | C20 | H25 | 43.7° | 34.9° |
| C22 | C21 | C30 | H29 | 179.7° | 179.7° |
| C21 | C22 | C23 | H35 | 0.3° | 0.5° |
| C23 | C22 | C21 | C20 | 0.3° | 0.2° |
| C22 | C23 | C24 | H35 | 180.0° | 179.9° |
| C22 | C23 | C24 | H34 | 179.2° | 180.0° |
| C21 | C20 | C51 | H25 | 117.5° | 119.9° |
| C21 | C20 | C51 | H26 | 52.4° | 60.1° |
| C21 | C20 | C51 | H27 | 172.4° | 60.0° |
| C21 | C20 | C51 | H28 | 67.6° | 180.0° |
| C20 | C21 | C30 | H29 | 0.2° | 0.0° |
| C46 | C9 | C10 | H1 | 66.1° | 175.5° |
| C46 | C9 | C10 | H2 | 174.8° | 55.5° |
| C46 | C9 | C8 | H18 | 162.4° | 58.1° |
| C9 | C46 | H19 | H20 | 120.0° | 120.0° |
| C9 | C46 | H19 | H21 | 120.0° | 119.9° |
| C9 | C46 | H20 | H21 | 120.0° | 120.0° |
| C23 | C24 | C25 | H33 | 178.0° | 179.7° |
| O32 | C31 | C8 | H18 | 59.8° | 47.2° |
| C20 | C51 | H26 | H27 | 120.0° | 120.1° |
| C20 | C51 | H26 | H28 | 120.0° | 119.9° |
| C20 | C51 | H27 | H28 | 119.9° | 120.0° |
| H1 | C10 | C9 | H5 | 179.8° | 64.5° |
| H1 | C10 | C11 | H22 | 59.5° | 60.0° |
| H1 | C10 | C11 | H23 | 60.4° | 180.0° |
| H1 | C10 | C11 | H24 | 179.5° | 60.0° |
| H2 | C10 | C9 | H5 | 60.7° | 175.5° |
| H2 | C10 | C11 | H22 | 59.6° | 60.0° |
| H2 | C10 | C11 | H23 | 179.6° | 60.0° |
| H2 | C10 | C11 | H24 | 60.4° | 180.0° |
| H3 | C4 | C5 | H14 | 63.3° | 51.1° |
| H3 | C4 | C5 | H15 | 56.3° | 171.4° |
| H4 | C4 | C5 | H14 | 59.0° | 69.7° |
| H4 | C4 | C5 | H15 | 178.7° | 50.6° |
| H5 | C9 | C8 | H18 | 44.8° | 178.0° |
| H5 | C9 | C46 | H19 | 65.8° | 60.0° |
| H5 | C9 | C46 | H20 | 54.1° | 60.0° |
| H5 | C9 | C46 | H21 | 174.1° | 180.0° |
| H6 | C37 | C36 | H8 | 179.0° | 180.0° |
| H6 | C37 | C36 | H9 | 58.7° | 60.0° |
| H7 | C37 | C36 | H8 | 61.6° | 60.0° |
| H7 | C37 | C36 | H9 | 178.1° | 179.9° |
| H8 | C36 | C35 | H10 | 169.3° | 180.0° |
| H8 | C36 | C35 | H11 | 70.7° | 60.0° |
| H9 | C36 | C35 | H10 | 49.0° | 60.0° |
| H9 | C36 | C35 | H11 | 169.0° | 180.0° |
| H10 | C35 | N34 | H12 | 5.7° | 120.0° |
| H11 | C35 | N34 | H12 | 125.7° | 120.0° |
| H13 | C17 | C18 | H16 | 57.8° | 48.4° |
| H13 | C17 | C18 | H17 | 178.3° | 167.8° |
| H19 | C46 | H20 | H21 | 120.0° | 120.0° |
| H22 | C11 | H23 | H24 | 120.0° | 120.1° |
| H25 | C20 | C51 | H26 | 65.1° | 180.0° |
| H25 | C20 | C51 | H27 | 54.9° | 59.9° |
| H25 | C20 | C51 | H28 | 174.8° | 60.1° |
| H26 | C51 | H27 | H28 | 120.0° | 120.0° |
| H29 | C30 | C29 | H30 | 0.1° | 0.0° |
| H30 | C29 | C28 | H31 | 0.3° | 0.0° |
| H32 | C26 | C25 | H33 | 1.6° | 0.0° |
| H33 | C25 | C24 | H34 | 2.0° | 0.0° |
| H34 | C24 | C23 | H35 | 0.9° | 0.1° |
