OP9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O44 | C23 | doub | 1.26Å | 1.18Å | |
| N39 | C23 | sing | 1.31Å | 1.41Å | |
| N39 | C18 | sing | 1.40Å | 1.44Å | |
| C23 | C32 | sing | 1.48Å | 1.52Å | |
| N36 | C18 | doub | 1.31Å | 1.33Å | Aromatic |
| N36 | C8 | sing | 1.32Å | 1.44Å | Aromatic |
| C18 | C14 | sing | 1.44Å | 1.32Å | Aromatic |
| C8 | C11 | doub | 1.34Å | 1.47Å | Aromatic |
| C32 | C24 | sing | 1.57Å | 1.34Å | |
| C32 | C14 | sing | 1.46Å | 1.56Å | |
| C32 | C25 | sing | 1.55Å | 1.63Å | |
| C24 | C12 | sing | 1.52Å | 1.30Å | |
| C14 | C5 | doub | 1.37Å | 1.27Å | Aromatic |
| C5 | C11 | sing | 1.33Å | 1.34Å | Aromatic |
| C11 | C19 | sing | 1.53Å | 1.53Å | |
| C25 | C13 | sing | 1.54Å | 1.74Å | |
| C12 | C2 | doub | 1.35Å | 1.28Å | Aromatic |
| C12 | C13 | sing | 1.43Å | 1.36Å | Aromatic |
| C2 | C1 | sing | 1.45Å | 1.29Å | Aromatic |
| C19 | C20 | doub | 1.35Å | 1.32Å | |
| C13 | C4 | doub | 1.33Å | 1.47Å | Aromatic |
| C1 | C10 | doub | 1.41Å | 1.39Å | Aromatic |
| C20 | C26 | sing | 1.47Å | 1.53Å | |
| C4 | C10 | sing | 1.43Å | 1.49Å | Aromatic |
| C10 | C21 | sing | 1.43Å | 1.52Å | |
| C26 | O45 | sing | 1.44Å | 1.40Å | |
| C21 | N40 | sing | 1.31Å | 1.46Å | |
| C21 | O42 | doub | 1.22Å | 1.18Å | |
| O45 | C29 | sing | 1.45Å | 1.40Å | |
| C29 | C30 | sing | 1.58Å | 1.53Å | |
| N40 | C31 | sing | 1.52Å | 1.45Å | |
| O43 | C22 | doub | 1.20Å | 1.18Å | |
| C31 | C35 | sing | 1.48Å | 1.54Å | |
| C31 | C22 | sing | 1.47Å | 1.53Å | |
| C30 | O46 | sing | 1.43Å | 1.41Å | |
| C35 | C15 | sing | 1.51Å | 1.55Å | |
| C22 | N41 | sing | 1.41Å | 1.46Å | |
| O46 | C28 | sing | 1.41Å | 1.40Å | |
| C15 | C3 | doub | 1.36Å | 1.39Å | Aromatic |
| C15 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| N41 | C27 | sing | 1.44Å | 1.46Å | |
| N41 | C34 | sing | 1.47Å | 1.44Å | |
| C3 | C9 | sing | 1.41Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.59Å | 1.53Å | |
| C6 | C16 | doub | 1.36Å | 1.39Å | Aromatic |
| C9 | C7 | doub | 1.38Å | 1.44Å | Aromatic |
| C9 | C17 | sing | 1.47Å | 1.42Å | Aromatic |
| C7 | N37 | sing | 1.34Å | 1.31Å | Aromatic |
| C16 | C17 | sing | 1.41Å | 1.37Å | Aromatic |
| C16 | C33 | sing | 1.51Å | 1.52Å | |
| C17 | N38 | doub | 1.32Å | 1.29Å | Aromatic |
| N37 | N38 | sing | 1.40Å | 1.30Å | Aromatic |
| C4 | H1 | sing | 1.07Å | 1.08Å | |
| C5 | H2 | sing | 1.16Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.06Å | 1.08Å | |
| C20 | H6 | sing | 1.15Å | 1.08Å | |
| C24 | H7 | sing | 1.07Å | 1.10Å | |
| C24 | H8 | sing | 1.13Å | 1.10Å | |
| C26 | H9 | sing | 1.07Å | 1.10Å | |
| C26 | H10 | sing | 1.04Å | 1.10Å | |
| C28 | H11 | sing | 1.17Å | 1.10Å | |
| C28 | H12 | sing | 1.10Å | 1.10Å | |
| C1 | H13 | sing | 0.99Å | 1.08Å | |
| C19 | H14 | sing | 1.01Å | 1.08Å | |
| C2 | H15 | sing | 1.05Å | 1.08Å | |
| C25 | H16 | sing | 1.08Å | 1.10Å | |
| C25 | H17 | sing | 1.08Å | 1.10Å | |
| C27 | H18 | sing | 1.12Å | 1.10Å | |
| C27 | H19 | sing | 1.02Å | 1.10Å | |
| C29 | H20 | sing | 1.00Å | 1.10Å | |
| C29 | H21 | sing | 1.08Å | 1.10Å | |
| C3 | H22 | sing | 1.08Å | 1.08Å | |
| C30 | H23 | sing | 1.04Å | 1.10Å | |
| C30 | H24 | sing | 1.15Å | 1.10Å | |
| C31 | H25 | sing | 1.12Å | 1.10Å | |
| C33 | H26 | sing | 1.09Å | 1.10Å | |
| C33 | H27 | sing | 1.09Å | 1.10Å | |
| C33 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| C34 | H31 | sing | 1.09Å | 1.10Å | |
| C35 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| N37 | H34 | sing | 0.97Å | 1.00Å | |
| N39 | H35 | sing | 1.07Å | 1.00Å | |
| N40 | H36 | sing | 1.00Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O44 | C23 | N39 | 125.1° | 128.0° |
| O44 | C23 | C32 | 126.9° | 128.5° |
| C23 | N39 | C18 | 108.2° | 116.0° |
| N39 | C23 | C32 | 107.8° | 103.5° |
| C23 | N39 | H35 | 125.9° | 122.6° |
| N39 | C18 | N36 | 114.9° | 131.9° |
| N39 | C18 | C14 | 113.6° | 106.3° |
| C18 | N39 | H35 | 125.9° | 121.4° |
| C23 | C32 | C24 | 124.7° | 108.6° |
| C23 | C32 | C14 | 103.1° | 109.0° |
| C23 | C32 | C25 | 102.2° | 113.1° |
| C18 | N36 | C8 | 112.5° | 120.5° |
| N36 | C18 | C14 | 131.5° | 121.6° |
| N36 | C8 | C11 | 118.6° | 120.1° |
| N36 | C8 | H5 | 120.7° | 119.0° |
| C18 | C14 | C32 | 107.2° | 104.5° |
| C18 | C14 | C5 | 113.3° | 114.0° |
| C8 | C11 | C5 | 114.2° | 120.9° |
| C8 | C11 | C19 | 120.8° | 118.2° |
| C11 | C8 | H5 | 120.7° | 120.6° |
| C24 | C32 | C14 | 118.6° | 112.2° |
| C24 | C32 | C25 | 98.0° | 104.5° |
| C32 | C24 | C12 | 119.0° | 107.3° |
| C32 | C24 | H7 | 107.0° | 112.5° |
| C32 | C24 | H8 | 107.0° | 108.5° |
| C14 | C32 | C25 | 107.8° | 109.4° |
| C32 | C14 | C5 | 139.5° | 141.4° |
| C32 | C25 | C13 | 92.5° | 107.6° |
| C32 | C25 | H16 | 113.5° | 111.6° |
| C32 | C25 | H17 | 113.5° | 110.6° |
| C24 | C12 | C2 | 120.2° | 132.2° |
| C24 | C12 | C13 | 107.3° | 110.7° |
| C12 | C24 | H7 | 107.0° | 106.8° |
| C12 | C24 | H8 | 107.0° | 107.5° |
| C14 | C5 | C11 | 129.8° | 122.0° |
| C14 | C5 | H2 | 115.1° | 112.9° |
| C5 | C11 | C19 | 125.0° | 120.8° |
| C11 | C5 | H2 | 115.1° | 124.8° |
| C11 | C19 | C20 | 121.0° | 122.0° |
| C11 | C19 | H14 | 119.5° | 121.5° |
| C25 | C13 | C12 | 105.5° | 109.1° |
| C25 | C13 | C4 | 137.4° | 129.3° |
| C13 | C25 | H16 | 113.6° | 109.7° |
| C13 | C25 | H17 | 113.5° | 108.9° |
| C2 | C12 | C13 | 132.5° | 117.0° |
| C12 | C2 | C1 | 111.3° | 124.9° |
| C12 | C2 | H15 | 124.4° | 117.9° |
| C12 | C13 | C4 | 117.0° | 121.4° |
| C2 | C1 | C10 | 130.1° | 114.9° |
| C2 | C1 | H13 | 114.9° | 122.5° |
| C1 | C2 | H15 | 124.4° | 117.1° |
| C19 | C20 | C26 | 119.7° | 121.8° |
| C19 | C20 | H6 | 120.2° | 115.1° |
| C20 | C19 | H14 | 119.5° | 116.3° |
| C13 | C4 | C10 | 112.0° | 121.0° |
| C13 | C4 | H1 | 124.0° | 124.9° |
| C1 | C10 | C4 | 117.2° | 120.0° |
| C1 | C10 | C21 | 122.6° | 117.9° |
| C10 | C1 | H13 | 115.0° | 122.5° |
| C20 | C26 | O45 | 110.7° | 105.7° |
| C26 | C20 | H6 | 120.1° | 123.1° |
| C20 | C26 | H9 | 109.2° | 106.7° |
| C20 | C26 | H10 | 109.1° | 110.4° |
| C4 | C10 | C21 | 120.1° | 121.6° |
| C10 | C4 | H1 | 124.0° | 113.8° |
| C10 | C21 | N40 | 119.7° | 121.4° |
| C10 | C21 | O42 | 119.7° | 119.0° |
| C26 | O45 | C29 | 113.5° | 112.3° |
| O45 | C26 | H9 | 109.2° | 107.3° |
| O45 | C26 | H10 | 109.1° | 111.0° |
| N40 | C21 | O42 | 120.5° | 119.5° |
| C21 | N40 | C31 | 120.0° | 130.3° |
| C21 | N40 | H36 | 120.0° | 115.7° |
| O45 | C29 | C30 | 110.2° | 109.0° |
| O45 | C29 | H20 | 109.3° | 112.8° |
| O45 | C29 | H21 | 109.3° | 110.4° |
| C29 | C30 | O46 | 109.3° | 111.0° |
| C30 | C29 | H20 | 109.3° | 106.7° |
| C30 | C29 | H21 | 109.3° | 107.2° |
| C29 | C30 | H23 | 109.5° | 110.5° |
| C29 | C30 | H24 | 109.5° | 105.0° |
| N40 | C31 | C35 | 110.1° | 111.8° |
| N40 | C31 | C22 | 101.2° | 107.0° |
| N40 | C31 | H25 | 112.2° | 105.6° |
| C31 | N40 | H36 | 120.0° | 114.0° |
| O43 | C22 | C31 | 118.2° | 119.0° |
| O43 | C22 | N41 | 118.7° | 116.4° |
| C35 | C31 | C22 | 111.1° | 115.5° |
| C31 | C35 | C15 | 112.6° | 109.5° |
| C35 | C31 | H25 | 110.9° | 108.3° |
| C31 | C35 | H32 | 108.7° | 109.5° |
| C31 | C35 | H33 | 108.7° | 109.5° |
| C31 | C22 | N41 | 123.0° | 124.6° |
| C22 | C31 | H25 | 111.0° | 108.1° |
| C30 | O46 | C28 | 114.4° | 114.0° |
| O46 | C30 | H23 | 109.5° | 108.5° |
| O46 | C30 | H24 | 109.5° | 109.0° |
| C35 | C15 | C3 | 120.7° | 119.1° |
| C35 | C15 | C6 | 119.8° | 119.1° |
| C15 | C35 | H32 | 108.7° | 109.5° |
| C15 | C35 | H33 | 108.7° | 109.5° |
| C22 | N41 | C27 | 119.7° | 112.6° |
| C22 | N41 | C34 | 120.8° | 120.1° |
| O46 | C28 | C27 | 109.5° | 112.6° |
| O46 | C28 | H11 | 109.5° | 106.8° |
| O46 | C28 | H12 | 109.5° | 107.5° |
| C3 | C15 | C6 | 119.5° | 121.8° |
| C15 | C3 | C9 | 120.0° | 119.5° |
| C15 | C3 | H22 | 120.0° | 120.3° |
| C15 | C6 | C16 | 121.5° | 121.8° |
| C15 | C6 | H3 | 119.3° | 119.1° |
| C27 | N41 | C34 | 119.4° | 126.6° |
| N41 | C27 | C28 | 109.9° | 106.3° |
| N41 | C27 | H18 | 109.4° | 113.9° |
| N41 | C27 | H19 | 109.4° | 114.5° |
| N41 | C34 | H29 | 109.5° | 109.4° |
| N41 | C34 | H30 | 109.5° | 109.5° |
| N41 | C34 | H31 | 109.4° | 109.4° |
| C3 | C9 | C7 | 137.2° | 134.8° |
| C3 | C9 | C17 | 118.7° | 118.8° |
| C9 | C3 | H22 | 120.0° | 120.2° |
| C27 | C28 | H11 | 109.5° | 108.0° |
| C27 | C28 | H12 | 109.4° | 112.6° |
| C28 | C27 | H18 | 109.4° | 104.7° |
| C28 | C27 | H19 | 109.4° | 106.0° |
| C6 | C16 | C17 | 118.1° | 119.6° |
| C6 | C16 | C33 | 122.1° | 120.2° |
| C16 | C6 | H3 | 119.2° | 119.1° |
| C7 | C9 | C17 | 104.2° | 106.4° |
| C9 | C7 | N37 | 107.6° | 107.9° |
| C9 | C7 | H4 | 126.2° | 126.0° |
| C9 | C17 | C16 | 122.1° | 118.5° |
| C9 | C17 | N38 | 104.8° | 106.8° |
| C7 | N37 | N38 | 107.8° | 110.0° |
| N37 | C7 | H4 | 126.2° | 126.1° |
| C7 | N37 | H34 | 126.1° | 125.0° |
| C17 | C16 | C33 | 119.8° | 120.2° |
| C16 | C17 | N38 | 133.0° | 134.7° |
| C16 | C33 | H26 | 109.5° | 109.5° |
| C16 | C33 | H27 | 109.5° | 109.4° |
| C16 | C33 | H28 | 109.4° | 109.5° |
| C17 | N38 | N37 | 115.6° | 108.9° |
| N38 | N37 | H34 | 126.1° | 125.0° |
| H7 | C24 | H8 | 109.5° | 113.9° |
| H9 | C26 | H10 | 109.5° | 115.2° |
| H11 | C28 | H12 | 109.5° | 109.1° |
| H16 | C25 | H17 | 109.5° | 108.4° |
| H18 | C27 | H19 | 109.5° | 110.4° |
| H20 | C29 | H21 | 109.5° | 110.6° |
| H23 | C30 | H24 | 109.4° | 112.9° |
| H26 | C33 | H27 | 109.5° | 109.5° |
| H26 | C33 | H28 | 109.5° | 109.5° |
| H27 | C33 | H28 | 109.5° | 109.5° |
| H29 | C34 | H30 | 109.4° | 109.5° |
| H29 | C34 | H31 | 109.5° | 109.5° |
| H30 | C34 | H31 | 109.5° | 109.5° |
| H32 | C35 | H33 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O44 | C23 | N39 | C32 | 175.8° | 178.9° |
| O44 | C23 | N39 | C18 | 178.2° | 170.4° |
| O44 | C23 | C32 | C24 | 40.0° | 67.2° |
| O44 | C23 | C32 | C14 | 179.3° | 170.2° |
| O44 | C23 | C32 | C25 | 68.9° | 48.3° |
| O44 | C23 | N39 | H35 | 1.8° | 9.1° |
| C23 | N39 | C18 | H35 | 180.0° | 179.5° |
| C23 | N39 | C18 | N36 | 179.3° | 179.3° |
| C23 | N39 | C18 | C14 | 0.0° | 5.0° |
| N39 | C23 | C32 | C24 | 135.7° | 113.9° |
| N39 | C23 | C32 | C14 | 3.6° | 8.6° |
| N39 | C23 | C32 | C25 | 115.5° | 130.5° |
| C18 | N39 | C23 | C32 | 2.5° | 8.4° |
| N39 | C18 | N36 | C14 | 179.2° | 173.6° |
| N39 | C18 | N36 | C8 | 179.2° | 174.2° |
| N39 | C18 | C14 | C32 | 2.3° | 1.0° |
| N39 | C18 | C14 | C5 | 179.8° | 177.0° |
| C23 | C32 | C14 | C18 | 3.6° | 5.9° |
| C23 | C32 | C24 | C14 | 133.6° | 120.5° |
| C23 | C32 | C24 | C25 | 110.9° | 121.0° |
| C23 | C32 | C14 | C25 | 107.7° | 124.1° |
| C23 | C32 | C24 | C12 | 156.0° | 126.7° |
| C23 | C32 | C14 | C5 | 180.0° | 171.3° |
| C23 | C32 | C25 | C13 | 162.6° | 125.9° |
| C23 | C32 | C24 | H7 | 82.6° | 9.4° |
| C23 | C32 | C24 | H8 | 34.6° | 117.5° |
| C23 | C32 | C25 | H16 | 45.5° | 113.8° |
| C23 | C32 | C25 | H17 | 80.3° | 7.0° |
| C32 | C23 | N39 | H35 | 177.6° | 172.0° |
| C18 | N36 | C8 | C11 | 0.4° | 8.2° |
| N36 | C18 | C14 | C32 | 178.4° | 174.0° |
| N36 | C18 | C14 | C5 | 0.9° | 8.0° |
| C18 | N36 | C8 | H5 | 179.6° | 177.5° |
| N36 | C18 | N39 | H35 | 0.7° | 1.2° |
| C8 | N36 | C18 | C14 | 0.0° | 12.2° |
| N36 | C8 | C11 | H5 | 180.0° | 174.2° |
| N36 | C8 | C11 | C5 | 0.1° | 0.2° |
| N36 | C8 | C11 | C19 | 179.5° | 177.3° |
| C18 | C14 | C32 | C24 | 138.8° | 114.4° |
| C18 | C14 | C32 | C5 | 176.5° | 177.1° |
| C18 | C14 | C32 | C25 | 111.2° | 130.0° |
| C18 | C14 | C5 | C11 | 1.7° | 0.1° |
| C18 | C14 | C5 | H2 | 178.3° | 174.6° |
| C14 | C18 | N39 | H35 | 180.0° | 175.4° |
| C8 | C11 | C5 | C14 | 1.3° | 3.7° |
| C8 | C11 | C5 | C19 | 179.4° | 177.0° |
| C8 | C11 | C19 | C20 | 120.0° | 168.7° |
| C8 | C11 | C5 | H2 | 178.7° | 177.6° |
| C8 | C11 | C19 | H14 | 60.1° | 6.3° |
| C24 | C32 | C14 | C25 | 110.0° | 115.6° |
| C32 | C24 | C12 | H7 | 121.4° | 120.9° |
| C32 | C24 | C12 | H8 | 121.3° | 116.5° |
| C24 | C32 | C14 | C5 | 37.7° | 68.4° |
| C24 | C32 | C25 | C13 | 34.4° | 7.9° |
| C32 | C24 | C12 | C2 | 148.7° | 178.3° |
| C32 | C24 | C12 | C13 | 29.8° | 1.2° |
| C32 | C24 | H7 | H8 | 115.7° | 124.0° |
| C24 | C32 | C25 | H16 | 82.6° | 128.3° |
| C24 | C32 | C25 | H17 | 151.5° | 110.9° |
| C14 | C32 | C24 | C12 | 70.4° | 112.8° |
| C32 | C14 | C5 | C11 | 178.0° | 177.0° |
| C14 | C32 | C25 | C13 | 89.1° | 112.5° |
| C32 | C14 | C5 | H2 | 2.0° | 2.4° |
| C14 | C32 | C24 | H7 | 51.0° | 130.0° |
| C14 | C32 | C24 | H8 | 168.3° | 3.1° |
| C14 | C32 | C25 | H16 | 153.8° | 7.9° |
| C14 | C32 | C25 | H17 | 27.9° | 128.7° |
| C25 | C32 | C24 | C12 | 45.0° | 5.7° |
| C25 | C32 | C14 | C5 | 72.3° | 47.1° |
| C32 | C25 | C13 | H16 | 117.0° | 121.6° |
| C32 | C25 | C13 | H17 | 117.0° | 119.9° |
| C32 | C25 | C13 | C12 | 22.7° | 7.6° |
| C32 | C25 | C13 | C4 | 157.5° | 167.9° |
| C25 | C32 | C24 | H7 | 166.4° | 111.6° |
| C25 | C32 | C24 | H8 | 76.3° | 121.5° |
| C32 | C25 | H16 | H17 | 128.0° | 122.0° |
| C24 | C12 | C13 | C25 | 1.3° | 4.0° |
| C24 | C12 | C2 | C13 | 178.0° | 177.0° |
| C24 | C12 | C2 | C1 | 178.7° | 178.1° |
| C24 | C12 | C13 | C4 | 178.9° | 171.9° |
| C12 | C24 | H7 | H8 | 115.7° | 118.5° |
| C24 | C12 | C2 | H15 | 1.3° | 6.4° |
| C14 | C5 | C11 | H2 | 180.0° | 174.0° |
| C14 | C5 | C11 | C19 | 179.3° | 173.3° |
| C5 | C11 | C19 | C20 | 60.7° | 8.4° |
| C5 | C11 | C8 | H5 | 179.9° | 174.4° |
| C5 | C11 | C19 | H14 | 119.3° | 176.6° |
| C11 | C19 | C20 | H14 | 180.0° | 175.2° |
| C11 | C19 | C20 | C26 | 179.8° | 179.3° |
| C19 | C11 | C5 | H2 | 0.7° | 0.7° |
| C19 | C11 | C8 | H5 | 0.5° | 8.5° |
| C11 | C19 | C20 | H6 | 0.2° | 3.6° |
| C25 | C13 | C12 | C2 | 179.5° | 173.6° |
| C25 | C13 | C12 | C4 | 179.8° | 175.9° |
| C25 | C13 | C4 | C10 | 179.2° | 175.2° |
| C25 | C13 | C4 | H1 | 0.8° | 1.4° |
| C13 | C25 | H16 | H17 | 128.0° | 118.8° |
| C12 | C2 | C1 | H15 | 180.0° | 175.6° |
| C2 | C12 | C13 | C4 | 0.7° | 10.5° |
| C12 | C2 | C1 | C10 | 0.8° | 1.0° |
| C2 | C12 | C24 | H7 | 27.3° | 57.4° |
| C2 | C12 | C24 | H8 | 89.9° | 65.2° |
| C12 | C2 | C1 | H13 | 179.1° | 179.4° |
| C13 | C12 | C2 | C1 | 0.6° | 5.0° |
| C12 | C13 | C4 | C10 | 0.5° | 9.8° |
| C12 | C13 | C4 | H1 | 179.5° | 176.4° |
| C13 | C12 | C24 | H7 | 151.1° | 119.7° |
| C13 | C12 | C24 | H8 | 91.6° | 117.7° |
| C13 | C12 | C2 | H15 | 179.4° | 170.6° |
| C12 | C13 | C25 | H16 | 94.3° | 129.1° |
| C12 | C13 | C25 | H17 | 139.8° | 112.3° |
| C2 | C1 | C10 | H13 | 180.0° | 178.4° |
| C2 | C1 | C10 | C4 | 2.0° | 2.0° |
| C2 | C1 | C10 | C21 | 177.7° | 170.4° |
| C19 | C20 | C26 | H6 | 180.0° | 176.9° |
| C19 | C20 | C26 | O45 | 137.9° | 131.0° |
| C19 | C20 | C26 | H9 | 101.9° | 17.0° |
| C19 | C20 | C26 | H10 | 17.7° | 108.9° |
| C13 | C4 | C10 | C1 | 1.6° | 3.3° |
| C13 | C4 | C10 | H1 | 180.0° | 174.5° |
| C13 | C4 | C10 | C21 | 177.5° | 175.4° |
| C4 | C13 | C25 | H16 | 85.4° | 46.3° |
| C4 | C13 | C25 | H17 | 40.5° | 72.2° |
| C1 | C10 | C4 | C21 | 175.9° | 172.1° |
| C1 | C10 | C21 | N40 | 3.9° | 151.5° |
| C1 | C10 | C21 | O42 | 179.9° | 32.4° |
| C1 | C10 | C4 | H1 | 178.4° | 177.8° |
| C10 | C1 | C2 | H15 | 179.2° | 176.6° |
| C20 | C26 | O45 | H9 | 120.2° | 113.6° |
| C20 | C26 | O45 | H10 | 120.2° | 119.7° |
| C20 | C26 | O45 | C29 | 109.4° | 133.7° |
| C20 | C26 | H9 | H10 | 119.4° | 122.9° |
| C26 | C20 | C19 | H14 | 0.2° | 4.1° |
| C4 | C10 | C21 | N40 | 171.7° | 20.7° |
| C4 | C10 | C21 | O42 | 4.5° | 155.3° |
| C4 | C10 | C1 | H13 | 178.0° | 179.6° |
| C10 | C21 | N40 | O42 | 176.2° | 176.1° |
| C10 | C21 | N40 | C31 | 176.4° | 171.7° |
| C21 | C10 | C4 | H1 | 2.5° | 10.1° |
| C21 | C10 | C1 | H13 | 2.2° | 8.0° |
| C10 | C21 | N40 | H36 | 3.6° | 7.7° |
| C26 | O45 | C29 | C30 | 152.1° | 70.5° |
| O45 | C26 | C20 | H6 | 42.2° | 52.2° |
| O45 | C26 | H9 | H10 | 119.4° | 124.2° |
| C26 | O45 | C29 | H20 | 32.0° | 47.8° |
| C26 | O45 | C29 | H21 | 87.9° | 172.1° |
| C21 | N40 | C31 | H36 | 180.0° | 179.4° |
| C21 | N40 | C31 | C35 | 145.2° | 7.4° |
| C21 | N40 | C31 | C22 | 97.2° | 134.8° |
| C21 | N40 | C31 | H25 | 21.1° | 110.1° |
| O42 | C21 | N40 | C31 | 0.2° | 12.2° |
| O42 | C21 | N40 | H36 | 179.8° | 168.4° |
| O45 | C29 | C30 | H20 | 120.1° | 122.0° |
| O45 | C29 | C30 | H21 | 120.1° | 119.4° |
| O45 | C29 | C30 | O46 | 53.3° | 118.0° |
| C29 | O45 | C26 | H9 | 130.3° | 112.7° |
| C29 | O45 | C26 | H10 | 10.7° | 14.0° |
| O45 | C29 | H20 | H21 | 119.7° | 124.1° |
| O45 | C29 | C30 | H23 | 66.7° | 121.7° |
| O45 | C29 | C30 | H24 | 173.3° | 0.3° |
| C29 | C30 | O46 | H23 | 120.0° | 121.6° |
| C29 | C30 | O46 | H24 | 120.0° | 115.2° |
| C29 | C30 | O46 | C28 | 163.6° | 165.0° |
| C30 | C29 | H20 | H21 | 119.7° | 116.3° |
| C29 | C30 | H23 | H24 | 120.0° | 117.3° |
| N40 | C31 | C22 | O43 | 41.3° | 126.5° |
| N40 | C31 | C35 | C22 | 111.3° | 122.7° |
| N40 | C31 | C35 | H25 | 124.8° | 115.9° |
| N40 | C31 | C22 | H25 | 119.3° | 113.3° |
| N40 | C31 | C35 | C15 | 158.5° | 171.8° |
| N40 | C31 | C22 | N41 | 139.3° | 54.4° |
| N40 | C31 | C35 | H32 | 38.0° | 51.8° |
| N40 | C31 | C35 | H33 | 81.1° | 68.2° |
| O43 | C22 | C31 | C35 | 75.6° | 108.2° |
| O43 | C22 | C31 | N41 | 179.5° | 179.1° |
| O43 | C22 | N41 | C27 | 0.2° | 10.0° |
| O43 | C22 | N41 | C34 | 179.9° | 160.8° |
| O43 | C22 | C31 | H25 | 160.5° | 13.2° |
| C35 | C31 | C22 | H25 | 123.9° | 121.4° |
| C31 | C35 | C15 | H32 | 120.4° | 120.0° |
| C31 | C35 | C15 | H33 | 120.5° | 120.1° |
| C35 | C31 | C22 | N41 | 103.9° | 70.9° |
| C31 | C35 | C15 | C3 | 82.1° | 94.7° |
| C31 | C35 | C15 | C6 | 99.2° | 85.2° |
| C31 | C35 | H32 | H33 | 118.6° | 120.0° |
| C35 | C31 | N40 | H36 | 34.8° | 172.0° |
| C22 | C31 | C35 | C15 | 47.2° | 65.5° |
| C31 | C22 | N41 | C27 | 179.3° | 170.9° |
| C31 | C22 | N41 | C34 | 0.4° | 18.4° |
| C22 | C31 | C35 | H32 | 73.2° | 174.5° |
| C22 | C31 | C35 | H33 | 167.7° | 54.6° |
| C22 | C31 | N40 | H36 | 82.8° | 44.6° |
| C30 | O46 | C28 | C27 | 67.8° | 159.5° |
| C30 | O46 | C28 | H11 | 172.2° | 41.1° |
| C30 | O46 | C28 | H12 | 52.2° | 75.8° |
| O46 | C30 | C29 | H20 | 173.4° | 120.0° |
| O46 | C30 | C29 | H21 | 66.7° | 1.5° |
| O46 | C30 | H23 | H24 | 120.1° | 120.9° |
| C35 | C15 | C3 | C6 | 178.7° | 179.9° |
| C35 | C15 | C3 | C9 | 179.8° | 180.0° |
| C35 | C15 | C6 | C16 | 179.8° | 180.0° |
| C35 | C15 | C6 | H3 | 0.2° | 0.3° |
| C35 | C15 | C3 | H22 | 0.2° | 0.0° |
| C15 | C35 | C31 | H25 | 76.7° | 55.9° |
| C15 | C35 | H32 | H33 | 118.6° | 119.9° |
| C22 | N41 | C27 | C34 | 179.7° | 170.1° |
| C22 | N41 | C27 | C28 | 117.8° | 156.1° |
| C22 | N41 | C27 | H18 | 2.3° | 41.2° |
| C22 | N41 | C27 | H19 | 122.2° | 87.2° |
| N41 | C22 | C31 | H25 | 20.0° | 167.7° |
| C22 | N41 | C34 | H29 | 180.0° | 5.5° |
| C22 | N41 | C34 | H30 | 60.0° | 114.5° |
| C22 | N41 | C34 | H31 | 60.0° | 125.4° |
| O46 | C28 | C27 | N41 | 91.4° | 154.3° |
| O46 | C28 | C27 | H11 | 120.0° | 117.7° |
| O46 | C28 | C27 | H12 | 120.0° | 121.7° |
| O46 | C28 | H11 | H12 | 120.0° | 115.9° |
| O46 | C28 | C27 | H18 | 28.6° | 33.4° |
| O46 | C28 | C27 | H19 | 148.5° | 83.4° |
| C28 | O46 | C30 | H23 | 76.4° | 73.3° |
| C28 | O46 | C30 | H24 | 43.6° | 49.9° |
| C15 | C3 | C9 | H22 | 180.0° | 180.0° |
| C3 | C15 | C6 | C16 | 1.1° | 0.0° |
| C15 | C3 | C9 | C7 | 179.4° | 180.0° |
| C15 | C3 | C9 | C17 | 1.2° | 0.3° |
| C3 | C15 | C6 | H3 | 178.8° | 179.7° |
| C3 | C15 | C35 | H32 | 38.3° | 145.2° |
| C3 | C15 | C35 | H33 | 157.4° | 25.3° |
| C6 | C15 | C3 | C9 | 1.6° | 0.1° |
| C15 | C6 | C16 | H3 | 180.0° | 179.7° |
| C15 | C6 | C16 | C17 | 0.3° | 0.3° |
| C15 | C6 | C16 | C33 | 179.8° | 179.7° |
| C6 | C15 | C3 | H22 | 178.4° | 180.0° |
| C6 | C15 | C35 | H32 | 140.4° | 34.8° |
| C6 | C15 | C35 | H33 | 21.3° | 154.7° |
| N41 | C27 | C28 | H18 | 120.0° | 121.0° |
| N41 | C27 | C28 | H19 | 120.1° | 122.3° |
| N41 | C27 | C28 | H11 | 28.6° | 36.7° |
| N41 | C27 | C28 | H12 | 148.6° | 84.0° |
| N41 | C27 | H18 | H19 | 119.8° | 130.5° |
| C27 | N41 | C34 | H29 | 0.3° | 174.9° |
| C27 | N41 | C34 | H30 | 119.7° | 54.8° |
| C27 | N41 | C34 | H31 | 120.3° | 65.2° |
| C34 | N41 | C27 | C28 | 62.5° | 33.9° |
| C34 | N41 | C27 | H18 | 177.4° | 148.7° |
| C34 | N41 | C27 | H19 | 57.5° | 82.8° |
| N41 | C34 | H29 | H30 | 120.0° | 120.0° |
| N41 | C34 | H29 | H31 | 120.0° | 119.9° |
| N41 | C34 | H30 | H31 | 120.0° | 119.9° |
| C3 | C9 | C7 | C17 | 179.5° | 179.6° |
| C3 | C9 | C7 | N37 | 179.4° | 179.9° |
| C3 | C9 | C17 | C16 | 0.3° | 0.6° |
| C3 | C9 | C17 | N38 | 179.6° | 179.9° |
| C3 | C9 | C7 | H4 | 0.6° | 0.1° |
| C27 | C28 | H11 | H12 | 120.0° | 122.8° |
| C28 | C27 | H18 | H19 | 119.8° | 113.7° |
| C6 | C16 | C17 | C9 | 0.1° | 0.6° |
| C6 | C16 | C17 | C33 | 179.9° | 179.9° |
| C6 | C16 | C17 | N38 | 180.0° | 179.9° |
| C6 | C16 | C33 | H26 | 90.0° | 90.0° |
| C6 | C16 | C33 | H27 | 149.9° | 150.0° |
| C6 | C16 | C33 | H28 | 29.9° | 30.0° |
| C9 | C7 | N37 | H4 | 180.0° | 179.9° |
| C7 | C9 | C17 | C16 | 179.9° | 179.7° |
| C7 | C9 | C17 | N38 | 0.1° | 0.2° |
| C9 | C7 | N37 | N38 | 0.1° | 0.3° |
| C7 | C9 | C3 | H22 | 0.6° | 0.1° |
| C9 | C7 | N37 | H34 | 179.9° | 180.0° |
| C17 | C9 | C7 | N37 | 0.1° | 0.3° |
| C9 | C17 | C16 | N38 | 179.8° | 179.3° |
| C9 | C17 | C16 | C33 | 179.8° | 179.5° |
| C9 | C17 | N38 | N37 | 0.0° | 0.0° |
| C17 | C9 | C7 | H4 | 179.9° | 179.8° |
| C17 | C9 | C3 | H22 | 178.9° | 179.7° |
| C7 | N37 | N38 | C17 | 0.1° | 0.2° |
| C7 | N37 | N38 | H34 | 180.0° | 179.7° |
| C16 | C17 | N38 | N37 | 179.9° | 179.4° |
| C17 | C16 | C6 | H3 | 179.7° | 180.0° |
| C17 | C16 | C33 | H26 | 90.1° | 90.0° |
| C17 | C16 | C33 | H27 | 30.0° | 30.0° |
| C17 | C16 | C33 | H28 | 150.0° | 150.0° |
| C33 | C16 | C17 | N38 | 0.1° | 0.1° |
| C33 | C16 | C6 | H3 | 0.2° | 0.0° |
| C16 | C33 | H26 | H27 | 120.0° | 120.0° |
| C16 | C33 | H26 | H28 | 120.0° | 120.0° |
| C16 | C33 | H27 | H28 | 120.0° | 120.0° |
| C17 | N38 | N37 | H34 | 179.9° | 179.9° |
| N38 | N37 | C7 | H4 | 179.9° | 179.7° |
| H4 | C7 | N37 | H34 | 0.1° | 0.0° |
| H6 | C20 | C26 | H9 | 78.1° | 166.2° |
| H6 | C20 | C26 | H10 | 162.3° | 68.0° |
| H6 | C20 | C19 | H14 | 179.8° | 178.8° |
| H11 | C28 | C27 | H18 | 148.6° | 84.3° |
| H11 | C28 | C27 | H19 | 91.5° | 158.9° |
| H12 | C28 | C27 | H18 | 91.4° | 155.1° |
| H12 | C28 | C27 | H19 | 28.5° | 38.3° |
| H13 | C1 | C2 | H15 | 0.9° | 5.0° |
| H20 | C29 | C30 | H23 | 53.4° | 0.4° |
| H20 | C29 | C30 | H24 | 66.6° | 122.4° |
| H21 | C29 | C30 | H23 | 173.3° | 118.9° |
| H21 | C29 | C30 | H24 | 53.3° | 119.1° |
| H25 | C31 | C35 | H32 | 162.8° | 64.2° |
| H25 | C31 | C35 | H33 | 43.7° | 175.9° |
| H25 | C31 | N40 | H36 | 158.9° | 70.4° |
| H26 | C33 | H27 | H28 | 120.0° | 120.1° |
| H29 | C34 | H30 | H31 | 120.0° | 120.1° |
