WSN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C1 | C12 | sing | 1.55Å | 1.53Å | |
| C1 | N15 | sing | 1.47Å | 1.46Å | |
| C2 | O3 | doub | 1.21Å | 1.25Å | |
| C2 | N4 | sing | 1.35Å | 1.33Å | |
| N4 | C5 | sing | 1.46Å | 1.44Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | N7 | doub | 1.28Å | 1.29Å | |
| C8 | C9 | sing | 1.51Å | 1.51Å | |
| C9 | N10 | sing | 1.35Å | 1.33Å | |
| C9 | O11 | doub | 1.21Å | 1.24Å | |
| C12 | C13 | sing | 1.55Å | 1.51Å | |
| C13 | C14 | sing | 1.54Å | 1.50Å | |
| C14 | N15 | sing | 1.47Å | 1.48Å | |
| N15 | C16 | sing | 1.35Å | 1.34Å | |
| C16 | O17 | doub | 1.21Å | 1.23Å | |
| C16 | C18 | sing | 1.51Å | 1.52Å | |
| C18 | C19 | sing | 1.51Å | 1.51Å | |
| C18 | C33 | sing | 1.53Å | 1.53Å | |
| C18 | C34 | sing | 1.53Å | 1.52Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.39Å | 1.38Å | Aromatic |
| C22 | O25 | sing | 1.36Å | 1.37Å | |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| O25 | C26 | sing | 1.43Å | 1.43Å | |
| C26 | C27 | sing | 1.51Å | 1.51Å | |
| C27 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.37Å | Aromatic |
| C28 | F36 | sing | 1.35Å | 1.35Å | |
| C29 | C30 | doub | 1.38Å | 1.37Å | Aromatic |
| C30 | C31 | sing | 1.38Å | 1.37Å | Aromatic |
| C30 | F35 | sing | 1.35Å | 1.35Å | |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | sing | 1.53Å | 1.49Å | |
| C13 | H46 | sing | 1.09Å | 1.10Å | |
| C13 | H47 | sing | 1.09Å | 1.10Å | |
| C20 | H50 | sing | 1.08Å | 1.08Å | |
| C21 | H51 | sing | 1.08Å | 1.08Å | |
| C23 | H52 | sing | 1.08Å | 1.08Å | |
| C24 | H53 | sing | 1.08Å | 1.08Å | |
| C26 | H54 | sing | 1.09Å | 1.10Å | |
| C26 | H55 | sing | 1.09Å | 1.10Å | |
| C1 | H37 | sing | 1.09Å | 1.10Å | |
| N4 | H38 | sing | 0.97Å | 1.00Å | |
| C5 | H39 | sing | 1.09Å | 1.10Å | |
| C6 | H1 | sing | 1.08Å | 1.08Å | |
| N7 | H7 | sing | 0.97Å | 1.00Å | |
| C8 | H41 | sing | 1.09Å | 1.10Å | |
| C8 | H40 | sing | 1.09Å | 1.10Å | |
| N10 | H43 | sing | 0.97Å | 1.00Å | |
| N10 | H42 | sing | 0.97Å | 1.00Å | |
| C12 | H44 | sing | 1.09Å | 1.10Å | |
| C12 | H45 | sing | 1.09Å | 1.10Å | |
| C14 | H48 | sing | 1.09Å | 1.10Å | |
| C14 | H49 | sing | 1.09Å | 1.10Å | |
| C29 | H56 | sing | 1.08Å | 1.08Å | |
| C31 | H57 | sing | 1.08Å | 1.08Å | |
| C32 | H58 | sing | 1.08Å | 1.08Å | |
| C33 | H60 | sing | 1.09Å | 1.10Å | |
| C33 | H59 | sing | 1.09Å | 1.10Å | |
| C34 | H61 | sing | 1.09Å | 1.10Å | |
| C34 | H62 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C12 | 110.6° | 110.4° |
| C2 | C1 | N15 | 114.3° | 110.3° |
| C1 | C2 | O3 | 122.4° | 120.0° |
| C1 | C2 | N4 | 113.7° | 120.0° |
| C2 | C1 | H37 | 108.8° | 110.3° |
| C12 | C1 | N15 | 104.5° | 104.8° |
| C1 | C12 | C13 | 106.5° | 101.5° |
| C12 | C1 | H37 | 108.8° | 110.4° |
| C1 | C12 | H44 | 110.2° | 111.0° |
| C1 | C12 | H45 | 110.2° | 111.1° |
| C1 | N15 | C14 | 113.4° | 108.7° |
| C1 | N15 | C16 | 118.1° | 125.7° |
| N15 | C1 | H37 | 109.7° | 110.5° |
| O3 | C2 | N4 | 123.8° | 120.0° |
| C2 | N4 | C5 | 123.7° | 120.0° |
| C2 | N4 | H38 | 118.2° | 120.0° |
| N4 | C5 | C6 | 107.1° | 109.5° |
| N4 | C5 | C8 | 112.0° | 109.5° |
| C5 | N4 | H38 | 118.1° | 120.0° |
| N4 | C5 | H39 | 109.9° | 109.5° |
| C6 | C5 | C8 | 110.2° | 109.5° |
| C5 | C6 | N7 | 116.2° | 120.0° |
| C6 | C5 | H39 | 109.1° | 109.4° |
| C5 | C6 | H1 | 121.9° | 120.0° |
| C5 | C8 | C9 | 112.2° | 109.5° |
| C8 | C5 | H39 | 108.6° | 109.5° |
| C5 | C8 | H41 | 108.8° | 109.5° |
| C5 | C8 | H40 | 108.8° | 109.5° |
| N7 | C6 | H1 | 121.9° | 120.0° |
| C6 | N7 | H7 | 112.0° | 120.0° |
| C8 | C9 | N10 | 116.3° | 120.0° |
| C8 | C9 | O11 | 120.8° | 120.0° |
| C9 | C8 | H41 | 108.8° | 109.4° |
| C9 | C8 | H40 | 108.8° | 109.4° |
| N10 | C9 | O11 | 122.9° | 120.0° |
| C9 | N10 | H43 | 120.0° | 120.0° |
| C9 | N10 | H42 | 120.0° | 120.1° |
| C12 | C13 | C14 | 109.2° | 103.0° |
| C12 | C13 | H46 | 109.5° | 110.7° |
| C12 | C13 | H47 | 109.5° | 110.8° |
| C13 | C12 | H44 | 110.2° | 111.0° |
| C13 | C12 | H45 | 110.2° | 111.0° |
| C13 | C14 | N15 | 104.4° | 107.2° |
| C14 | C13 | H46 | 109.5° | 110.7° |
| C14 | C13 | H47 | 109.5° | 110.8° |
| C13 | C14 | H48 | 110.7° | 109.9° |
| C13 | C14 | H49 | 110.7° | 109.9° |
| C14 | N15 | C16 | 128.4° | 125.7° |
| N15 | C14 | H48 | 110.7° | 109.9° |
| N15 | C14 | H49 | 110.7° | 109.9° |
| N15 | C16 | O17 | 120.6° | 120.0° |
| N15 | C16 | C18 | 116.8° | 120.0° |
| O17 | C16 | C18 | 122.5° | 120.0° |
| C16 | C18 | C19 | 114.8° | 115.5° |
| C16 | C18 | C33 | 117.5° | 117.5° |
| C16 | C18 | C34 | 114.4° | 117.5° |
| C19 | C18 | C33 | 120.6° | 117.5° |
| C19 | C18 | C34 | 119.4° | 117.5° |
| C18 | C19 | C20 | 120.5° | 120.0° |
| C18 | C19 | C24 | 121.2° | 120.0° |
| C33 | C18 | C34 | 58.7° | 60.0° |
| C18 | C33 | C34 | 60.5° | 59.9° |
| C18 | C33 | H60 | 119.9° | 117.5° |
| C18 | C33 | H59 | 119.9° | 117.5° |
| C18 | C34 | C33 | 60.8° | 60.0° |
| C18 | C34 | H61 | 119.9° | 117.5° |
| C18 | C34 | H62 | 119.9° | 117.5° |
| C20 | C19 | C24 | 118.2° | 120.1° |
| C19 | C20 | C21 | 121.2° | 120.1° |
| C19 | C20 | H50 | 119.4° | 119.9° |
| C19 | C24 | C23 | 121.4° | 120.1° |
| C19 | C24 | H53 | 119.3° | 120.0° |
| C20 | C21 | C22 | 119.8° | 119.9° |
| C21 | C20 | H50 | 119.4° | 120.0° |
| C20 | C21 | H51 | 120.1° | 120.0° |
| C21 | C22 | C23 | 119.6° | 119.9° |
| C21 | C22 | O25 | 113.9° | 120.1° |
| C22 | C21 | H51 | 120.1° | 120.1° |
| C23 | C22 | O25 | 126.5° | 120.1° |
| C22 | C23 | C24 | 119.7° | 120.0° |
| C22 | C23 | H52 | 120.2° | 120.0° |
| C22 | O25 | C26 | 117.3° | 117.0° |
| C24 | C23 | H52 | 120.1° | 120.0° |
| C23 | C24 | H53 | 119.3° | 120.0° |
| O25 | C26 | C27 | 117.2° | 109.5° |
| O25 | C26 | H54 | 107.5° | 109.5° |
| O25 | C26 | H55 | 107.5° | 109.5° |
| C26 | C27 | C28 | 122.3° | 120.0° |
| C26 | C27 | C32 | 120.1° | 120.0° |
| C27 | C26 | H54 | 107.5° | 109.5° |
| C27 | C26 | H55 | 107.5° | 109.4° |
| C28 | C27 | C32 | 117.2° | 120.0° |
| C27 | C28 | C29 | 123.4° | 120.0° |
| C27 | C28 | F36 | 117.8° | 120.0° |
| C27 | C32 | C31 | 120.9° | 120.0° |
| C27 | C32 | H58 | 119.5° | 119.9° |
| C29 | C28 | F36 | 118.7° | 120.0° |
| C28 | C29 | C30 | 116.4° | 119.9° |
| C28 | C29 | H56 | 121.8° | 120.0° |
| C29 | C30 | C31 | 123.7° | 120.0° |
| C29 | C30 | F35 | 117.8° | 120.0° |
| C30 | C29 | H56 | 121.8° | 120.0° |
| C31 | C30 | F35 | 118.4° | 120.0° |
| C30 | C31 | C32 | 118.2° | 120.0° |
| C30 | C31 | H57 | 120.9° | 120.1° |
| C32 | C31 | H57 | 120.9° | 119.9° |
| C31 | C32 | H58 | 119.5° | 120.0° |
| C34 | C33 | H60 | 119.9° | 117.5° |
| C34 | C33 | H59 | 119.9° | 117.5° |
| C33 | C34 | H61 | 119.9° | 117.6° |
| C33 | C34 | H62 | 119.9° | 117.5° |
| H46 | C13 | H47 | 109.5° | 110.7° |
| H54 | C26 | H55 | 109.5° | 109.4° |
| H41 | C8 | H40 | 109.5° | 109.5° |
| H43 | N10 | H42 | 120.0° | 119.9° |
| H44 | C12 | H45 | 109.5° | 110.9° |
| H48 | C14 | H49 | 109.5° | 110.0° |
| H60 | C33 | H59 | 109.5° | 115.6° |
| H61 | C34 | H62 | 109.5° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C12 | N15 | 123.5° | 118.8° |
| C2 | C1 | C12 | H37 | 119.5° | 122.3° |
| C2 | C1 | N15 | H37 | 122.5° | 122.2° |
| C1 | C2 | O3 | N4 | 179.1° | 180.0° |
| C1 | C2 | N4 | C5 | 173.2° | 180.0° |
| C2 | C1 | C12 | C13 | 109.2° | 155.8° |
| C2 | C1 | N15 | C14 | 109.5° | 143.0° |
| C2 | C1 | N15 | C16 | 74.2° | 37.1° |
| C1 | C2 | N4 | H38 | 6.7° | 0.1° |
| C2 | C1 | C12 | H44 | 10.3° | 86.1° |
| C2 | C1 | C12 | H45 | 131.2° | 37.7° |
| C12 | C1 | N15 | H37 | 116.5° | 118.9° |
| C12 | C1 | C2 | O3 | 83.4° | 87.9° |
| C12 | C1 | C2 | N4 | 95.7° | 92.1° |
| C1 | C12 | C13 | H44 | 119.5° | 118.0° |
| C1 | C12 | C13 | H45 | 119.5° | 118.1° |
| C1 | C12 | C13 | C14 | 12.6° | 35.5° |
| C12 | C1 | N15 | C14 | 11.5° | 24.2° |
| C12 | C1 | N15 | C16 | 164.8° | 155.9° |
| C1 | C12 | C13 | H46 | 107.4° | 153.9° |
| C1 | C12 | C13 | H47 | 132.5° | 82.9° |
| C1 | C12 | H44 | H45 | 121.3° | 123.9° |
| N15 | C1 | C2 | O3 | 34.1° | 27.5° |
| N15 | C1 | C2 | N4 | 146.7° | 152.5° |
| N15 | C1 | C12 | C13 | 14.3° | 37.1° |
| C1 | N15 | C14 | C13 | 3.9° | 1.1° |
| C1 | N15 | C14 | C16 | 175.8° | 179.9° |
| C1 | N15 | C16 | O17 | 0.4° | 5.8° |
| C1 | N15 | C16 | C18 | 176.3° | 174.2° |
| N15 | C1 | C12 | H44 | 133.8° | 155.1° |
| N15 | C1 | C12 | H45 | 105.3° | 81.1° |
| C1 | N15 | C14 | H48 | 115.2° | 120.5° |
| C1 | N15 | C14 | H49 | 123.1° | 118.3° |
| O3 | C2 | N4 | C5 | 5.9° | 0.0° |
| O3 | C2 | C1 | H37 | 157.1° | 149.8° |
| O3 | C2 | N4 | H38 | 174.1° | 180.0° |
| C2 | N4 | C5 | H38 | 180.0° | 180.0° |
| C2 | N4 | C5 | C6 | 104.0° | 85.0° |
| C2 | N4 | C5 | C8 | 135.1° | 155.0° |
| N4 | C2 | C1 | H37 | 23.7° | 30.2° |
| C2 | N4 | C5 | H39 | 14.3° | 35.0° |
| N4 | C5 | C6 | C8 | 122.1° | 120.1° |
| N4 | C5 | C6 | H39 | 118.8° | 120.0° |
| N4 | C5 | C8 | H39 | 121.5° | 120.0° |
| N4 | C5 | C6 | N7 | 143.7° | 0.1° |
| N4 | C5 | C8 | C9 | 61.7° | 65.0° |
| N4 | C5 | C6 | H1 | 36.3° | 180.0° |
| N4 | C5 | C8 | H41 | 58.7° | 55.0° |
| N4 | C5 | C8 | H40 | 177.9° | 175.0° |
| C6 | C5 | C8 | H39 | 119.4° | 119.9° |
| C5 | C6 | N7 | H1 | 180.0° | 179.9° |
| C6 | C5 | C8 | C9 | 179.2° | 175.0° |
| C6 | C5 | N4 | H38 | 76.0° | 95.1° |
| C5 | C6 | N7 | H7 | 180.0° | 180.0° |
| C6 | C5 | C8 | H41 | 60.4° | 65.1° |
| C6 | C5 | C8 | H40 | 58.8° | 55.0° |
| C8 | C5 | C6 | N7 | 94.2° | 120.0° |
| C5 | C8 | C9 | H41 | 120.4° | 120.0° |
| C5 | C8 | C9 | H40 | 120.4° | 120.0° |
| C5 | C8 | C9 | N10 | 129.4° | 180.0° |
| C5 | C8 | C9 | O11 | 50.9° | 0.0° |
| C8 | C5 | N4 | H38 | 44.9° | 25.0° |
| C8 | C5 | C6 | H1 | 85.8° | 59.9° |
| C5 | C8 | H41 | H40 | 118.8° | 120.0° |
| N7 | C6 | C5 | H39 | 24.9° | 120.1° |
| C8 | C9 | N10 | O11 | 179.6° | 180.0° |
| C9 | C8 | C5 | H39 | 59.9° | 55.0° |
| C9 | C8 | H41 | H40 | 118.7° | 120.0° |
| C8 | C9 | N10 | H43 | 179.6° | 0.0° |
| C8 | C9 | N10 | H42 | 0.4° | 180.0° |
| N10 | C9 | C8 | H41 | 9.0° | 60.0° |
| N10 | C9 | C8 | H40 | 110.1° | 60.0° |
| C9 | N10 | H43 | H42 | 180.0° | 180.0° |
| O11 | C9 | C8 | H41 | 171.3° | 120.0° |
| O11 | C9 | C8 | H40 | 69.5° | 120.0° |
| O11 | C9 | N10 | H43 | 0.0° | 180.0° |
| O11 | C9 | N10 | H42 | 180.0° | 0.0° |
| C12 | C13 | C14 | H46 | 120.0° | 118.3° |
| C12 | C13 | C14 | H47 | 119.9° | 118.5° |
| C12 | C13 | C14 | N15 | 5.6° | 22.2° |
| C12 | C13 | H46 | H47 | 120.1° | 123.3° |
| C13 | C12 | C1 | H37 | 131.3° | 81.9° |
| C13 | C12 | H44 | H45 | 121.4° | 123.9° |
| C12 | C13 | C14 | H48 | 124.8° | 97.2° |
| C12 | C13 | C14 | H49 | 113.6° | 141.6° |
| C13 | C14 | N15 | H48 | 119.2° | 119.4° |
| C13 | C14 | N15 | H49 | 119.2° | 119.4° |
| C13 | C14 | N15 | C16 | 171.9° | 179.0° |
| C14 | C13 | H46 | H47 | 120.1° | 123.2° |
| C14 | C13 | C12 | H44 | 132.1° | 153.6° |
| C14 | C13 | C12 | H45 | 106.9° | 82.6° |
| C13 | C14 | H48 | H49 | 122.3° | 121.1° |
| C14 | N15 | C16 | O17 | 175.3° | 174.3° |
| C14 | N15 | C16 | C18 | 0.7° | 5.6° |
| N15 | C14 | C13 | H46 | 114.3° | 140.5° |
| N15 | C14 | C13 | H47 | 125.5° | 96.3° |
| C14 | N15 | C1 | H37 | 128.0° | 94.8° |
| N15 | C14 | H48 | H49 | 122.4° | 121.1° |
| N15 | C16 | O17 | C18 | 175.7° | 180.0° |
| N15 | C16 | C18 | C19 | 78.4° | 51.1° |
| N15 | C16 | C18 | C33 | 72.3° | 94.5° |
| N15 | C16 | C18 | C34 | 138.2° | 163.2° |
| C16 | N15 | C1 | H37 | 48.3° | 85.1° |
| C16 | N15 | C14 | H48 | 68.9° | 59.6° |
| C16 | N15 | C14 | H49 | 52.7° | 61.6° |
| O17 | C16 | C18 | C19 | 105.7° | 128.8° |
| O17 | C16 | C18 | C33 | 103.6° | 85.5° |
| O17 | C16 | C18 | C34 | 37.7° | 16.8° |
| C16 | C18 | C19 | C33 | 149.7° | 145.6° |
| C16 | C18 | C19 | C34 | 141.5° | 145.7° |
| C16 | C18 | C33 | C34 | 103.2° | 107.5° |
| C16 | C18 | C19 | C20 | 62.7° | 42.8° |
| C16 | C18 | C19 | C24 | 117.9° | 136.9° |
| C16 | C18 | C33 | H60 | 147.2° | 145.0° |
| C16 | C18 | C33 | H59 | 6.4° | 0.1° |
| C16 | C18 | C34 | H61 | 1.2° | 0.0° |
| C16 | C18 | C34 | H62 | 141.9° | 145.0° |
| C19 | C18 | C33 | C34 | 107.9° | 107.5° |
| C18 | C19 | C20 | C24 | 179.4° | 179.7° |
| C18 | C19 | C20 | C21 | 178.4° | 180.0° |
| C18 | C19 | C24 | C23 | 179.6° | 179.7° |
| C18 | C19 | C20 | H50 | 1.6° | 0.0° |
| C18 | C19 | C24 | H53 | 0.4° | 0.0° |
| C19 | C18 | C33 | H60 | 1.7° | 0.1° |
| C19 | C18 | C33 | H59 | 142.5° | 145.0° |
| C19 | C18 | C34 | H61 | 140.4° | 145.0° |
| C19 | C18 | C34 | H62 | 0.2° | 0.0° |
| C33 | C18 | C19 | C20 | 147.6° | 171.5° |
| C33 | C18 | C19 | C24 | 31.8° | 8.8° |
| C18 | C33 | C34 | H60 | 109.6° | 107.5° |
| C18 | C33 | C34 | H59 | 109.6° | 107.4° |
| C18 | C33 | H60 | H59 | 144.5° | 145.7° |
| C33 | C18 | C34 | H61 | 109.7° | 107.6° |
| C33 | C18 | C34 | H62 | 109.7° | 107.4° |
| C34 | C18 | C19 | C20 | 78.8° | 102.9° |
| C34 | C18 | C19 | C24 | 100.7° | 77.4° |
| C18 | C34 | H61 | H62 | 144.3° | 145.7° |
| C19 | C20 | C21 | H50 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.6° | 0.0° |
| C20 | C19 | C24 | C23 | 1.0° | 0.6° |
| C19 | C20 | C21 | H51 | 179.4° | 180.0° |
| C20 | C19 | C24 | H53 | 179.0° | 179.7° |
| C24 | C19 | C20 | C21 | 1.1° | 0.3° |
| C19 | C24 | C23 | C22 | 3.5° | 0.5° |
| C19 | C24 | C23 | H53 | 180.0° | 179.7° |
| C24 | C19 | C20 | H50 | 179.0° | 179.7° |
| C19 | C24 | C23 | H52 | 176.5° | 179.7° |
| C20 | C21 | C22 | H51 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 1.9° | 0.0° |
| C20 | C21 | C22 | O25 | 179.2° | 180.0° |
| C21 | C22 | C23 | O25 | 176.9° | 180.0° |
| C21 | C22 | C23 | C24 | 3.9° | 0.2° |
| C21 | C22 | O25 | C26 | 176.7° | 180.0° |
| C22 | C21 | C20 | H50 | 179.4° | 180.0° |
| C21 | C22 | C23 | H52 | 176.0° | 180.0° |
| C22 | C23 | C24 | H52 | 180.0° | 179.8° |
| C23 | C22 | O25 | C26 | 0.4° | 0.0° |
| C23 | C22 | C21 | H51 | 178.1° | 180.0° |
| C22 | C23 | C24 | H53 | 176.5° | 179.8° |
| O25 | C22 | C23 | C24 | 179.1° | 179.8° |
| C22 | O25 | C26 | C27 | 173.3° | 180.0° |
| O25 | C22 | C21 | H51 | 0.7° | 0.0° |
| O25 | C22 | C23 | H52 | 0.9° | 0.0° |
| C22 | O25 | C26 | H54 | 65.6° | 60.0° |
| C22 | O25 | C26 | H55 | 52.2° | 60.0° |
| O25 | C26 | C27 | H54 | 121.1° | 120.1° |
| O25 | C26 | C27 | H55 | 121.1° | 120.0° |
| O25 | C26 | C27 | C28 | 76.2° | 180.0° |
| O25 | C26 | C27 | C32 | 111.1° | 0.3° |
| O25 | C26 | H54 | H55 | 116.5° | 120.0° |
| C26 | C27 | C28 | C32 | 172.9° | 179.7° |
| C26 | C27 | C28 | C29 | 177.2° | 180.0° |
| C26 | C27 | C28 | F36 | 5.6° | 0.1° |
| C26 | C27 | C32 | C31 | 175.9° | 179.8° |
| C27 | C26 | H54 | H55 | 116.5° | 119.9° |
| C26 | C27 | C32 | H58 | 4.1° | 0.1° |
| C27 | C28 | C29 | F36 | 177.1° | 180.0° |
| C27 | C28 | C29 | C30 | 4.3° | 0.0° |
| C28 | C27 | C32 | C31 | 2.9° | 0.6° |
| C28 | C27 | C26 | H54 | 44.9° | 59.9° |
| C28 | C27 | C26 | H55 | 162.7° | 60.0° |
| C27 | C28 | C29 | H56 | 175.7° | 180.0° |
| C28 | C27 | C32 | H58 | 177.2° | 179.7° |
| C32 | C27 | C28 | C29 | 4.4° | 0.3° |
| C32 | C27 | C28 | F36 | 178.5° | 179.7° |
| C27 | C32 | C31 | C30 | 1.6° | 0.5° |
| C27 | C32 | C31 | H58 | 180.0° | 179.7° |
| C32 | C27 | C26 | H54 | 127.8° | 119.7° |
| C32 | C27 | C26 | H55 | 10.0° | 120.3° |
| C27 | C32 | C31 | H57 | 178.4° | 179.7° |
| C28 | C29 | C30 | H56 | 180.0° | 180.0° |
| C28 | C29 | C30 | C31 | 2.9° | 0.0° |
| C28 | C29 | C30 | F35 | 175.9° | 180.0° |
| F36 | C28 | C29 | C30 | 178.6° | 180.0° |
| F36 | C28 | C29 | H56 | 1.4° | 0.0° |
| C29 | C30 | C31 | F35 | 178.7° | 180.0° |
| C29 | C30 | C31 | C32 | 1.6° | 0.3° |
| C29 | C30 | C31 | H57 | 178.4° | 180.0° |
| C30 | C31 | C32 | H57 | 180.0° | 179.7° |
| C31 | C30 | C29 | H56 | 177.1° | 180.0° |
| C30 | C31 | C32 | H58 | 178.4° | 179.8° |
| F35 | C30 | C31 | C32 | 177.1° | 179.7° |
| F35 | C30 | C29 | H56 | 4.1° | 0.0° |
| F35 | C30 | C31 | H57 | 2.9° | 0.0° |
| C34 | C33 | H60 | H59 | 144.4° | 145.7° |
| C33 | C34 | H61 | H62 | 144.3° | 145.7° |
| H46 | C13 | C12 | H44 | 12.2° | 88.1° |
| H46 | C13 | C12 | H45 | 133.1° | 35.8° |
| H46 | C13 | C14 | H48 | 4.9° | 21.1° |
| H46 | C13 | C14 | H49 | 126.5° | 100.1° |
| H47 | C13 | C12 | H44 | 107.9° | 35.1° |
| H47 | C13 | C12 | H45 | 13.0° | 158.9° |
| H47 | C13 | C14 | H48 | 115.2° | 144.3° |
| H47 | C13 | C14 | H49 | 6.4° | 23.1° |
| H50 | C20 | C21 | H51 | 0.6° | 0.0° |
| H52 | C23 | C24 | H53 | 3.5° | 0.0° |
| H37 | C1 | C12 | H44 | 109.1° | 36.1° |
| H37 | C1 | C12 | H45 | 11.8° | 160.0° |
| H38 | N4 | C5 | H39 | 165.7° | 145.0° |
| H39 | C5 | C6 | H1 | 155.1° | 60.0° |
| H39 | C5 | C8 | H41 | 179.8° | 175.0° |
| H39 | C5 | C8 | H40 | 60.6° | 64.9° |
| H1 | C6 | N7 | H7 | 0.0° | 0.1° |
| H57 | C31 | C32 | H58 | 1.5° | 0.0° |
| H60 | C33 | C34 | H61 | 140.7° | 145.0° |
| H60 | C33 | C34 | H62 | 0.1° | 0.0° |
| H59 | C33 | C34 | H61 | 0.1° | 0.1° |
| H59 | C33 | C34 | H62 | 140.7° | 145.1° |
