YOC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N2 | sing | 1.47Å | 1.49Å | |
| C1 | C4 | sing | 1.53Å | 1.57Å | |
| N2 | C3 | sing | 1.47Å | 1.48Å | |
| N2 | C10 | sing | 1.35Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.58Å | |
| C4 | C6 | sing | 1.53Å | 1.52Å | |
| C4 | C7 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | N9 | sing | 1.47Å | 1.47Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C8 | N9 | sing | 1.47Å | 1.49Å | |
| N9 | C21 | sing | 1.35Å | 1.43Å | |
| C10 | C11 | sing | 1.51Å | 1.53Å | |
| C10 | O12 | doub | 1.21Å | 1.22Å | |
| C11 | C13 | sing | 1.53Å | 1.55Å | |
| C11 | C15 | sing | 1.53Å | 1.54Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| C14 | C17 | sing | 1.51Å | 1.49Å | |
| C15 | C16 | sing | 1.51Å | 1.47Å | |
| C16 | C17 | doub | 1.36Å | 1.40Å | Aromatic |
| C16 | N20 | sing | 1.33Å | 1.41Å | Aromatic |
| C17 | N18 | sing | 1.34Å | 1.40Å | Aromatic |
| N18 | N19 | sing | 1.29Å | 1.38Å | Aromatic |
| N19 | N20 | doub | 1.29Å | 1.31Å | Aromatic |
| C21 | O22 | sing | 1.35Å | 1.42Å | |
| C21 | O24 | doub | 1.21Å | 1.23Å | |
| O22 | C23 | sing | 1.45Å | 1.45Å | |
| C23 | C25 | sing | 1.51Å | 1.54Å | |
| C25 | C26 | doub | 1.38Å | 1.42Å | Aromatic |
| C25 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.40Å | Aromatic |
| C26 | F31 | sing | 1.35Å | 1.33Å | |
| C27 | C28 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C32 | sing | 1.51Å | 1.54Å | |
| C29 | C30 | doub | 1.38Å | 1.41Å | Aromatic |
| C32 | F33 | sing | 1.40Å | 1.34Å | |
| C32 | F34 | sing | 1.40Å | 1.33Å | |
| C32 | F35 | sing | 1.40Å | 1.34Å | |
| C11 | H48 | sing | 1.09Å | 1.10Å | |
| C13 | H50 | sing | 1.09Å | 1.10Å | |
| C13 | H49 | sing | 1.09Å | 1.10Å | |
| C15 | H54 | sing | 1.09Å | 1.10Å | |
| C15 | H53 | sing | 1.09Å | 1.10Å | |
| C23 | H56 | sing | 1.09Å | 1.10Å | |
| C23 | H57 | sing | 1.09Å | 1.10Å | |
| C27 | H58 | sing | 1.08Å | 1.08Å | |
| C1 | H37 | sing | 1.09Å | 1.10Å | |
| C1 | H36 | sing | 1.09Å | 1.10Å | |
| C3 | H38 | sing | 1.09Å | 1.10Å | |
| C3 | H39 | sing | 1.09Å | 1.10Å | |
| C5 | H41 | sing | 1.09Å | 1.10Å | |
| C5 | H40 | sing | 1.09Å | 1.10Å | |
| C6 | H43 | sing | 1.09Å | 1.10Å | |
| C6 | H42 | sing | 1.09Å | 1.10Å | |
| C7 | H44 | sing | 1.09Å | 1.10Å | |
| C7 | H45 | sing | 1.09Å | 1.10Å | |
| C8 | H46 | sing | 1.09Å | 1.10Å | |
| C8 | H47 | sing | 1.09Å | 1.10Å | |
| C14 | H52 | sing | 1.09Å | 1.10Å | |
| C14 | H51 | sing | 1.09Å | 1.10Å | |
| N18 | H55 | sing | 0.97Å | 1.00Å | |
| C29 | H59 | sing | 1.08Å | 1.08Å | |
| C30 | H60 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C1 | C4 | 86.7° | 87.9° |
| C1 | N2 | C3 | 96.5° | 88.0° |
| C1 | N2 | C10 | 131.0° | 135.9° |
| N2 | C1 | H37 | 114.8° | 113.5° |
| N2 | C1 | H36 | 114.8° | 113.5° |
| C1 | C4 | C3 | 89.5° | 83.9° |
| C1 | C4 | C6 | 114.5° | 114.1° |
| C1 | C4 | C7 | 114.3° | 114.1° |
| C4 | C1 | H37 | 114.8° | 113.4° |
| C4 | C1 | H36 | 114.8° | 113.5° |
| C3 | N2 | C10 | 132.6° | 136.0° |
| N2 | C3 | C4 | 86.7° | 87.8° |
| N2 | C3 | H38 | 114.8° | 113.5° |
| N2 | C3 | H39 | 114.8° | 113.5° |
| N2 | C10 | C11 | 118.1° | 120.0° |
| N2 | C10 | O12 | 119.3° | 120.1° |
| C3 | C4 | C6 | 111.3° | 114.1° |
| C3 | C4 | C7 | 115.1° | 114.1° |
| C4 | C3 | H38 | 114.8° | 113.5° |
| C4 | C3 | H39 | 114.8° | 113.5° |
| C6 | C4 | C7 | 110.7° | 113.4° |
| C4 | C6 | C5 | 109.8° | 109.1° |
| C4 | C6 | H43 | 109.4° | 109.5° |
| C4 | C6 | H42 | 109.4° | 109.5° |
| C4 | C7 | C8 | 110.8° | 109.1° |
| C4 | C7 | H44 | 109.2° | 109.5° |
| C4 | C7 | H45 | 109.1° | 109.5° |
| C6 | C5 | N9 | 110.8° | 108.8° |
| C6 | C5 | H41 | 109.1° | 109.6° |
| C6 | C5 | H40 | 109.1° | 109.6° |
| C5 | C6 | H43 | 109.4° | 109.5° |
| C5 | C6 | H42 | 109.4° | 109.5° |
| C5 | N9 | C8 | 112.8° | 119.1° |
| C5 | N9 | C21 | 116.1° | 120.5° |
| N9 | C5 | H41 | 109.1° | 109.6° |
| N9 | C5 | H40 | 109.1° | 109.6° |
| C7 | C8 | N9 | 112.0° | 108.8° |
| C8 | C7 | H44 | 109.1° | 109.6° |
| C8 | C7 | H45 | 109.2° | 109.5° |
| C7 | C8 | H46 | 108.8° | 109.6° |
| C7 | C8 | H47 | 108.8° | 109.6° |
| C8 | N9 | C21 | 119.4° | 120.4° |
| N9 | C8 | H46 | 108.8° | 109.6° |
| N9 | C8 | H47 | 108.8° | 109.6° |
| N9 | C21 | O22 | 116.4° | 120.0° |
| N9 | C21 | O24 | 123.3° | 120.0° |
| C11 | C10 | O12 | 122.6° | 120.0° |
| C10 | C11 | C13 | 110.3° | 109.4° |
| C10 | C11 | C15 | 107.9° | 109.4° |
| C10 | C11 | H48 | 109.8° | 109.4° |
| C13 | C11 | C15 | 109.9° | 109.6° |
| C11 | C13 | C14 | 112.7° | 109.6° |
| C13 | C11 | H48 | 109.4° | 109.5° |
| C11 | C13 | H50 | 108.7° | 109.4° |
| C11 | C13 | H49 | 108.7° | 109.5° |
| C11 | C15 | C16 | 104.1° | 108.3° |
| C15 | C11 | H48 | 109.5° | 109.5° |
| C11 | C15 | H54 | 110.8° | 109.7° |
| C11 | C15 | H53 | 110.8° | 109.7° |
| C13 | C14 | C17 | 109.6° | 108.3° |
| C14 | C13 | H50 | 108.7° | 109.4° |
| C14 | C13 | H49 | 108.7° | 109.4° |
| C13 | C14 | H52 | 109.5° | 109.7° |
| C13 | C14 | H51 | 109.4° | 109.7° |
| C14 | C17 | C16 | 125.6° | 124.3° |
| C14 | C17 | N18 | 130.3° | 129.3° |
| C17 | C14 | H52 | 109.4° | 109.6° |
| C17 | C14 | H51 | 109.4° | 109.7° |
| C15 | C16 | C17 | 123.3° | 124.1° |
| C15 | C16 | N20 | 128.4° | 129.2° |
| C16 | C15 | H54 | 110.8° | 109.7° |
| C16 | C15 | H53 | 110.8° | 109.7° |
| C17 | C16 | N20 | 108.3° | 106.7° |
| C16 | C17 | N18 | 104.1° | 106.4° |
| C16 | N20 | N19 | 108.5° | 108.6° |
| C17 | N18 | N19 | 109.7° | 108.0° |
| C17 | N18 | H55 | 125.1° | 126.0° |
| N18 | N19 | N20 | 109.3° | 110.2° |
| N19 | N18 | H55 | 125.1° | 126.0° |
| O22 | C21 | O24 | 120.4° | 120.0° |
| C21 | O22 | C23 | 118.1° | 117.0° |
| O22 | C23 | C25 | 113.5° | 109.5° |
| O22 | C23 | H56 | 108.5° | 109.4° |
| O22 | C23 | H57 | 108.5° | 109.5° |
| C23 | C25 | C26 | 117.4° | 120.0° |
| C23 | C25 | C30 | 125.8° | 120.0° |
| C25 | C23 | H56 | 108.4° | 109.5° |
| C25 | C23 | H57 | 108.4° | 109.5° |
| C26 | C25 | C30 | 116.8° | 119.9° |
| C25 | C26 | C27 | 122.2° | 120.0° |
| C25 | C26 | F31 | 120.0° | 120.0° |
| C25 | C30 | C29 | 121.7° | 120.0° |
| C25 | C30 | H60 | 119.1° | 120.0° |
| C27 | C26 | F31 | 117.8° | 120.0° |
| C26 | C27 | C28 | 119.0° | 120.0° |
| C26 | C27 | H58 | 120.5° | 120.0° |
| C27 | C28 | C29 | 120.2° | 120.0° |
| C27 | C28 | C32 | 118.9° | 120.0° |
| C28 | C27 | H58 | 120.5° | 120.0° |
| C29 | C28 | C32 | 120.8° | 120.0° |
| C28 | C29 | C30 | 120.1° | 120.1° |
| C28 | C29 | H59 | 119.9° | 120.0° |
| C28 | C32 | F33 | 114.2° | 109.5° |
| C28 | C32 | F34 | 115.3° | 109.5° |
| C28 | C32 | F35 | 114.6° | 109.5° |
| C30 | C29 | H59 | 119.9° | 119.9° |
| C29 | C30 | H60 | 119.2° | 120.0° |
| F33 | C32 | F34 | 103.6° | 109.5° |
| F33 | C32 | F35 | 105.5° | 109.5° |
| F34 | C32 | F35 | 102.2° | 109.4° |
| H50 | C13 | H49 | 109.5° | 109.4° |
| H54 | C15 | H53 | 109.4° | 109.7° |
| H56 | C23 | H57 | 109.5° | 109.5° |
| H37 | C1 | H36 | 109.5° | 112.8° |
| H38 | C3 | H39 | 109.5° | 112.8° |
| H41 | C5 | H40 | 109.5° | 109.6° |
| H43 | C6 | H42 | 109.4° | 109.5° |
| H44 | C7 | H45 | 109.4° | 109.6° |
| H46 | C8 | H47 | 109.5° | 109.7° |
| H52 | C14 | H51 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C1 | C4 | H37 | 115.9° | 114.8° |
| N2 | C1 | C4 | H36 | 115.9° | 114.8° |
| C1 | N2 | C3 | C10 | 179.9° | 179.9° |
| N2 | C1 | C4 | C3 | 5.8° | 25.7° |
| N2 | C1 | C4 | C6 | 107.5° | 88.0° |
| N2 | C1 | C4 | C7 | 123.3° | 139.4° |
| C1 | N2 | C10 | C11 | 0.4° | 180.0° |
| C1 | N2 | C10 | O12 | 179.9° | 0.2° |
| N2 | C1 | H37 | H36 | 130.8° | 130.9° |
| C1 | N2 | C3 | H38 | 109.7° | 88.1° |
| C1 | N2 | C3 | H39 | 122.1° | 141.4° |
| C4 | C1 | N2 | C10 | 173.7° | 153.4° |
| C1 | C4 | C3 | C6 | 116.2° | 113.7° |
| C1 | C4 | C3 | C7 | 116.8° | 113.7° |
| C1 | C4 | C6 | C7 | 130.9° | 132.9° |
| C1 | C4 | C6 | C5 | 73.0° | 75.6° |
| C1 | C4 | C7 | C8 | 76.8° | 75.6° |
| C4 | C1 | H37 | H36 | 130.9° | 130.8° |
| C1 | C4 | C3 | H38 | 110.1° | 89.0° |
| C1 | C4 | C3 | H39 | 121.7° | 140.5° |
| C1 | C4 | C6 | H43 | 166.9° | 164.5° |
| C1 | C4 | C6 | H42 | 47.0° | 44.4° |
| C1 | C4 | C7 | H44 | 43.4° | 44.4° |
| C1 | C4 | C7 | H45 | 162.9° | 164.6° |
| N2 | C3 | C4 | H38 | 115.9° | 114.7° |
| N2 | C3 | C4 | H39 | 115.9° | 114.7° |
| N2 | C3 | C4 | C6 | 110.4° | 87.9° |
| N2 | C3 | C4 | C7 | 122.6° | 139.4° |
| C3 | N2 | C10 | C11 | 179.8° | 0.1° |
| C3 | N2 | C10 | O12 | 0.1° | 179.7° |
| C3 | N2 | C1 | H37 | 122.1° | 141.4° |
| C3 | N2 | C1 | H36 | 109.7° | 88.1° |
| N2 | C3 | H38 | H39 | 130.9° | 130.9° |
| C10 | N2 | C3 | C4 | 173.7° | 153.4° |
| N2 | C10 | C11 | O12 | 179.7° | 179.8° |
| N2 | C10 | C11 | C13 | 115.7° | 179.8° |
| N2 | C10 | C11 | C15 | 124.3° | 60.1° |
| N2 | C10 | C11 | H48 | 4.9° | 59.8° |
| C10 | N2 | C1 | H37 | 57.8° | 38.7° |
| C10 | N2 | C1 | H36 | 70.4° | 91.8° |
| C10 | N2 | C3 | H38 | 70.4° | 91.9° |
| C10 | N2 | C3 | H39 | 57.8° | 38.7° |
| C3 | C4 | C6 | C7 | 129.4° | 133.0° |
| C3 | C4 | C6 | C5 | 172.7° | 169.7° |
| C3 | C4 | C7 | C8 | 178.4° | 169.7° |
| C3 | C4 | C1 | H37 | 121.7° | 140.5° |
| C3 | C4 | C1 | H36 | 110.1° | 89.1° |
| C4 | C3 | H38 | H39 | 130.8° | 130.8° |
| C3 | C4 | C6 | H43 | 67.2° | 70.4° |
| C3 | C4 | C6 | H42 | 52.6° | 49.8° |
| C3 | C4 | C7 | H44 | 58.2° | 49.8° |
| C3 | C4 | C7 | H45 | 61.3° | 70.4° |
| C4 | C6 | C5 | H43 | 120.1° | 119.9° |
| C4 | C6 | C5 | H42 | 120.0° | 119.9° |
| C4 | C6 | C5 | N9 | 58.8° | 52.3° |
| C6 | C4 | C7 | C8 | 54.2° | 57.3° |
| C6 | C4 | C1 | H37 | 8.4° | 26.8° |
| C6 | C4 | C1 | H36 | 136.6° | 157.2° |
| C6 | C4 | C3 | H38 | 133.7° | 157.3° |
| C6 | C4 | C3 | H39 | 5.5° | 26.8° |
| C4 | C6 | C5 | H41 | 179.0° | 172.1° |
| C4 | C6 | C5 | H40 | 61.4° | 67.6° |
| C4 | C6 | H43 | H42 | 119.8° | 120.1° |
| C6 | C4 | C7 | H44 | 174.4° | 177.2° |
| C6 | C4 | C7 | H45 | 66.0° | 62.6° |
| C7 | C4 | C6 | C5 | 57.9° | 57.3° |
| C4 | C7 | C8 | H44 | 120.2° | 119.9° |
| C4 | C7 | C8 | H45 | 120.2° | 119.8° |
| C4 | C7 | C8 | N9 | 51.6° | 52.2° |
| C7 | C4 | C1 | H37 | 120.8° | 105.8° |
| C7 | C4 | C1 | H36 | 7.4° | 24.7° |
| C7 | C4 | C3 | H38 | 6.7° | 24.6° |
| C7 | C4 | C3 | H39 | 121.5° | 105.9° |
| C7 | C4 | C6 | H43 | 62.2° | 62.6° |
| C7 | C4 | C6 | H42 | 178.0° | 177.2° |
| C4 | C7 | H44 | H45 | 119.4° | 120.1° |
| C4 | C7 | C8 | H46 | 68.8° | 67.5° |
| C4 | C7 | C8 | H47 | 171.9° | 172.0° |
| C6 | C5 | N9 | H41 | 120.2° | 119.8° |
| C6 | C5 | N9 | H40 | 120.2° | 119.8° |
| C6 | C5 | N9 | C8 | 57.1° | 55.6° |
| C6 | C5 | N9 | C21 | 160.0° | 124.4° |
| C6 | C5 | H41 | H40 | 119.4° | 120.4° |
| C5 | C6 | H43 | H42 | 119.9° | 120.2° |
| C5 | N9 | C8 | C7 | 53.4° | 55.6° |
| C5 | N9 | C8 | C21 | 141.6° | 180.0° |
| C5 | N9 | C21 | O22 | 3.6° | 180.0° |
| C5 | N9 | C21 | O24 | 174.8° | 0.0° |
| N9 | C5 | H41 | H40 | 119.4° | 120.4° |
| N9 | C5 | C6 | H43 | 61.3° | 67.7° |
| N9 | C5 | C6 | H42 | 178.9° | 172.2° |
| C5 | N9 | C8 | H46 | 66.9° | 64.1° |
| C5 | N9 | C8 | H47 | 173.8° | 175.4° |
| C7 | C8 | N9 | H46 | 120.4° | 119.8° |
| C7 | C8 | N9 | H47 | 120.4° | 119.8° |
| C7 | C8 | N9 | C21 | 165.0° | 124.4° |
| C8 | C7 | H44 | H45 | 119.4° | 120.2° |
| C7 | C8 | H46 | H47 | 118.8° | 120.4° |
| C8 | N9 | C21 | O22 | 144.0° | 0.0° |
| C8 | N9 | C21 | O24 | 34.4° | 179.9° |
| C8 | N9 | C5 | H41 | 177.3° | 175.4° |
| C8 | N9 | C5 | H40 | 63.1° | 64.2° |
| N9 | C8 | C7 | H44 | 171.8° | 172.1° |
| N9 | C8 | C7 | H45 | 68.7° | 67.6° |
| N9 | C8 | H46 | H47 | 118.8° | 120.3° |
| N9 | C21 | O22 | O24 | 178.5° | 179.9° |
| N9 | C21 | O22 | C23 | 97.1° | 180.0° |
| C21 | N9 | C5 | H41 | 39.8° | 4.6° |
| C21 | N9 | C5 | H40 | 79.8° | 115.8° |
| C21 | N9 | C8 | H46 | 74.7° | 115.9° |
| C21 | N9 | C8 | H47 | 44.6° | 4.6° |
| C10 | C11 | C13 | C15 | 118.9° | 120.0° |
| C10 | C11 | C13 | H48 | 120.9° | 119.9° |
| C10 | C11 | C15 | H48 | 119.5° | 119.9° |
| C10 | C11 | C13 | C14 | 177.3° | 169.9° |
| C10 | C11 | C15 | C16 | 177.6° | 169.9° |
| C10 | C11 | C13 | H50 | 56.9° | 49.9° |
| C10 | C11 | C13 | H49 | 62.2° | 70.1° |
| C10 | C11 | C15 | H54 | 63.2° | 50.1° |
| C10 | C11 | C15 | H53 | 58.4° | 70.4° |
| O12 | C10 | C11 | C13 | 64.6° | 0.0° |
| O12 | C10 | C11 | C15 | 55.4° | 120.1° |
| O12 | C10 | C11 | H48 | 174.8° | 120.0° |
| C13 | C11 | C15 | H48 | 120.2° | 120.1° |
| C11 | C13 | C14 | H50 | 120.5° | 120.0° |
| C11 | C13 | C14 | H49 | 120.5° | 120.1° |
| C11 | C13 | C14 | C17 | 26.8° | 49.7° |
| C13 | C11 | C15 | C16 | 62.1° | 49.9° |
| C11 | C13 | H50 | H49 | 118.5° | 120.0° |
| C13 | C11 | C15 | H54 | 57.0° | 69.9° |
| C13 | C11 | C15 | H53 | 178.7° | 169.6° |
| C11 | C13 | C14 | H52 | 93.2° | 69.9° |
| C11 | C13 | C14 | H51 | 146.8° | 169.4° |
| C15 | C11 | C13 | C14 | 63.8° | 70.1° |
| C11 | C15 | C16 | H54 | 119.1° | 119.8° |
| C11 | C15 | C16 | H53 | 119.2° | 119.7° |
| C11 | C15 | C16 | C17 | 31.2° | 16.5° |
| C11 | C15 | C16 | N20 | 146.8° | 163.5° |
| C15 | C11 | C13 | H50 | 175.7° | 169.9° |
| C15 | C11 | C13 | H49 | 56.7° | 50.0° |
| C11 | C15 | H54 | H53 | 122.4° | 120.6° |
| C13 | C14 | C17 | H52 | 120.0° | 119.7° |
| C13 | C14 | C17 | H51 | 120.0° | 119.7° |
| C13 | C14 | C17 | C16 | 5.6° | 16.4° |
| C13 | C14 | C17 | N18 | 175.2° | 163.5° |
| C14 | C13 | C11 | H48 | 56.5° | 50.0° |
| C14 | C13 | H50 | H49 | 118.5° | 119.9° |
| C13 | C14 | H52 | H51 | 119.9° | 120.7° |
| C14 | C17 | C16 | C15 | 2.8° | 0.3° |
| C14 | C17 | C16 | N18 | 179.3° | 179.9° |
| C14 | C17 | C16 | N20 | 178.9° | 179.8° |
| C14 | C17 | N18 | N19 | 178.9° | 179.8° |
| C17 | C14 | C13 | H50 | 147.3° | 169.7° |
| C17 | C14 | C13 | H49 | 93.7° | 70.4° |
| C17 | C14 | H52 | H51 | 119.9° | 120.5° |
| C14 | C17 | N18 | H55 | 1.1° | 0.2° |
| C15 | C16 | C17 | N20 | 178.4° | 180.0° |
| C15 | C16 | C17 | N18 | 177.9° | 179.8° |
| C15 | C16 | N20 | N19 | 177.9° | 179.9° |
| C16 | C15 | C11 | H48 | 58.1° | 70.2° |
| C16 | C15 | H54 | H53 | 122.5° | 120.5° |
| C16 | C17 | N18 | N19 | 0.4° | 0.1° |
| C17 | C16 | N20 | N19 | 0.4° | 0.1° |
| C17 | C16 | C15 | H54 | 87.9° | 103.3° |
| C17 | C16 | C15 | H53 | 150.4° | 136.3° |
| C16 | C17 | C14 | H52 | 125.6° | 103.3° |
| C16 | C17 | C14 | H51 | 114.4° | 136.1° |
| C16 | C17 | N18 | H55 | 179.6° | 179.9° |
| N20 | C16 | C17 | N18 | 0.5° | 0.1° |
| C16 | N20 | N19 | N18 | 0.1° | 0.0° |
| N20 | C16 | C15 | H54 | 94.0° | 76.8° |
| N20 | C16 | C15 | H53 | 27.6° | 43.7° |
| C17 | N18 | N19 | H55 | 180.0° | 180.0° |
| C17 | N18 | N19 | N20 | 0.2° | 0.1° |
| N18 | C17 | C14 | H52 | 55.2° | 76.8° |
| N18 | C17 | C14 | H51 | 64.8° | 43.8° |
| N20 | N19 | N18 | H55 | 179.8° | 179.9° |
| C21 | O22 | C23 | C25 | 158.4° | 180.0° |
| C21 | O22 | C23 | H56 | 37.8° | 60.1° |
| C21 | O22 | C23 | H57 | 81.1° | 59.9° |
| O24 | C21 | O22 | C23 | 84.4° | 0.1° |
| O22 | C23 | C25 | H56 | 120.6° | 119.9° |
| O22 | C23 | C25 | H57 | 120.6° | 120.0° |
| O22 | C23 | C25 | C26 | 147.8° | 180.0° |
| O22 | C23 | C25 | C30 | 35.0° | 0.3° |
| O22 | C23 | H56 | H57 | 118.2° | 120.0° |
| C23 | C25 | C26 | C30 | 177.5° | 179.7° |
| C23 | C25 | C26 | C27 | 176.6° | 180.0° |
| C23 | C25 | C26 | F31 | 2.7° | 0.0° |
| C23 | C25 | C30 | C29 | 176.1° | 179.7° |
| C25 | C23 | H56 | H57 | 118.1° | 120.0° |
| C23 | C25 | C30 | H60 | 3.9° | 0.0° |
| C25 | C26 | C27 | F31 | 179.3° | 179.9° |
| C25 | C26 | C27 | C28 | 0.3° | 0.0° |
| C26 | C25 | C30 | C29 | 1.2° | 0.6° |
| C26 | C25 | C23 | H56 | 91.6° | 60.1° |
| C26 | C25 | C23 | H57 | 27.2° | 60.0° |
| C25 | C26 | C27 | H58 | 179.7° | 180.0° |
| C26 | C25 | C30 | H60 | 178.8° | 179.8° |
| C30 | C25 | C26 | C27 | 0.9° | 0.3° |
| C30 | C25 | C26 | F31 | 179.8° | 179.7° |
| C25 | C30 | C29 | C28 | 0.3° | 0.6° |
| C25 | C30 | C29 | H60 | 180.0° | 179.6° |
| C30 | C25 | C23 | H56 | 85.7° | 119.7° |
| C30 | C25 | C23 | H57 | 155.6° | 120.3° |
| C25 | C30 | C29 | H59 | 179.7° | 179.6° |
| C26 | C27 | C28 | H58 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 1.3° | 0.0° |
| C26 | C27 | C28 | C32 | 176.8° | 179.9° |
| F31 | C26 | C27 | C28 | 179.0° | 180.0° |
| F31 | C26 | C27 | H58 | 1.0° | 0.1° |
| C27 | C28 | C29 | C32 | 178.0° | 179.9° |
| C27 | C28 | C29 | C30 | 1.0° | 0.3° |
| C27 | C28 | C32 | F33 | 119.0° | 90.0° |
| C27 | C28 | C32 | F34 | 121.2° | 150.0° |
| C27 | C28 | C32 | F35 | 2.9° | 30.0° |
| C27 | C28 | C29 | H59 | 179.0° | 179.9° |
| C28 | C29 | C30 | H59 | 180.0° | 179.7° |
| C29 | C28 | C32 | F33 | 63.0° | 90.1° |
| C29 | C28 | C32 | F34 | 56.9° | 30.0° |
| C29 | C28 | C32 | F35 | 175.1° | 149.9° |
| C29 | C28 | C27 | H58 | 178.7° | 179.9° |
| C28 | C29 | C30 | H60 | 179.7° | 179.7° |
| C32 | C28 | C29 | C30 | 177.0° | 179.7° |
| C28 | C32 | F33 | F34 | 126.2° | 120.0° |
| C28 | C32 | F33 | F35 | 126.7° | 120.0° |
| C28 | C32 | F34 | F35 | 125.0° | 120.0° |
| C32 | C28 | C27 | H58 | 3.2° | 0.0° |
| C32 | C28 | C29 | H59 | 3.0° | 0.0° |
| F33 | C32 | F34 | F35 | 109.5° | 120.0° |
| H48 | C11 | C13 | H50 | 64.0° | 70.0° |
| H48 | C11 | C13 | H49 | 176.9° | 170.0° |
| H48 | C11 | C15 | H54 | 177.2° | 170.0° |
| H48 | C11 | C15 | H53 | 61.1° | 49.5° |
| H50 | C13 | C14 | H52 | 27.3° | 50.1° |
| H50 | C13 | C14 | H51 | 92.7° | 70.6° |
| H49 | C13 | C14 | H52 | 146.3° | 170.0° |
| H49 | C13 | C14 | H51 | 26.4° | 49.3° |
| H41 | C5 | C6 | H43 | 58.9° | 52.1° |
| H41 | C5 | C6 | H42 | 61.0° | 68.0° |
| H40 | C5 | C6 | H43 | 178.5° | 172.5° |
| H40 | C5 | C6 | H42 | 58.7° | 52.4° |
| H44 | C7 | C8 | H46 | 51.4° | 52.4° |
| H44 | C7 | C8 | H47 | 67.8° | 68.1° |
| H45 | C7 | C8 | H46 | 170.9° | 172.7° |
| H45 | C7 | C8 | H47 | 51.7° | 52.2° |
| H59 | C29 | C30 | H60 | 0.3° | 0.0° |
