A1IVD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.40Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C32 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C32 | N14 | sing | 1.40Å | 1.43Å | |
| C27 | C16 | sing | 1.51Å | 1.52Å | |
| O12 | S11 | doub | 1.42Å | 1.42Å | |
| N14 | C15 | sing | 1.47Å | 1.49Å | |
| N14 | S11 | sing | 1.66Å | 1.65Å | |
| C26 | C16 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C3 | N2 | sing | 1.47Å | 1.47Å | |
| C33 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
| C33 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C34 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| S11 | C10 | sing | 1.76Å | 1.75Å | |
| S11 | O13 | doub | 1.42Å | 1.43Å | |
| C10 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | N19 | sing | 1.47Å | 1.47Å | |
| O5 | S4 | doub | 1.42Å | 1.42Å | |
| N2 | S4 | sing | 1.66Å | 1.62Å | |
| N2 | C1 | sing | 1.47Å | 1.47Å | |
| C7 | S4 | sing | 1.76Å | 1.75Å | |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | N19 | sing | 1.47Å | 1.47Å | |
| N19 | C20 | sing | 1.47Å | 1.47Å | |
| S4 | O6 | doub | 1.42Å | 1.43Å | |
| C9 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| F22 | C21 | sing | 1.40Å | 1.33Å | |
| F24 | C21 | sing | 1.40Å | 1.33Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C21 | F23 | sing | 1.40Å | 1.33Å | |
| C1 | H36 | sing | 1.09Å | 1.10Å | |
| C1 | H35 | sing | 1.09Å | 1.10Å | |
| C1 | H37 | sing | 1.09Å | 1.10Å | |
| C3 | H40 | sing | 1.09Å | 1.10Å | |
| C3 | H39 | sing | 1.09Å | 1.10Å | |
| C3 | H38 | sing | 1.09Å | 1.10Å | |
| C8 | H41 | sing | 1.08Å | 1.08Å | |
| C15 | H43 | sing | 1.09Å | 1.10Å | |
| C15 | H44 | sing | 1.09Å | 1.10Å | |
| C25 | H51 | sing | 1.09Å | 1.10Å | |
| C25 | H52 | sing | 1.09Å | 1.10Å | |
| C26 | H54 | sing | 1.09Å | 1.10Å | |
| C26 | H53 | sing | 1.09Å | 1.10Å | |
| C28 | H55 | sing | 1.08Å | 1.08Å | |
| C31 | H58 | sing | 1.08Å | 1.08Å | |
| C17 | H45 | sing | 1.09Å | 1.10Å | |
| C17 | H46 | sing | 1.09Å | 1.10Å | |
| C18 | H47 | sing | 1.09Å | 1.10Å | |
| C18 | H48 | sing | 1.09Å | 1.10Å | |
| C20 | H49 | sing | 1.09Å | 1.10Å | |
| C20 | H50 | sing | 1.09Å | 1.10Å | |
| C29 | H56 | sing | 1.08Å | 1.08Å | |
| C30 | H57 | sing | 1.08Å | 1.08Å | |
| C33 | H59 | sing | 1.08Å | 1.08Å | |
| C34 | H60 | sing | 1.08Å | 1.08Å | |
| C9 | H42 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C29 | C30 | C31 | 120.1° | 120.2° |
| C30 | C29 | C28 | 120.0° | 119.9° |
| C30 | C29 | H56 | 120.0° | 120.0° |
| C29 | C30 | H57 | 120.0° | 120.0° |
| C30 | C31 | C32 | 119.7° | 120.3° |
| C30 | C31 | H58 | 120.2° | 119.9° |
| C31 | C30 | H57 | 120.0° | 119.9° |
| C29 | C28 | C27 | 120.0° | 120.2° |
| C29 | C28 | H55 | 120.0° | 119.9° |
| C28 | C29 | H56 | 120.0° | 120.1° |
| C31 | C32 | C27 | 120.5° | 119.0° |
| C31 | C32 | N14 | 130.2° | 129.3° |
| C32 | C31 | H58 | 120.1° | 119.8° |
| C28 | C27 | C32 | 119.7° | 120.4° |
| C28 | C27 | C16 | 130.0° | 131.3° |
| C27 | C28 | H55 | 120.0° | 119.9° |
| C27 | C32 | N14 | 109.2° | 111.7° |
| C32 | C27 | C16 | 110.3° | 108.3° |
| C32 | N14 | C15 | 107.5° | 109.9° |
| C32 | N14 | S11 | 125.4° | 125.0° |
| C27 | C16 | C26 | 112.9° | 110.5° |
| C27 | C16 | C15 | 101.7° | 105.0° |
| C27 | C16 | C17 | 111.0° | 110.5° |
| O12 | S11 | N14 | 107.1° | 106.4° |
| O12 | S11 | C10 | 108.9° | 106.4° |
| O12 | S11 | O13 | 120.1° | 123.1° |
| C15 | N14 | S11 | 120.0° | 125.1° |
| N14 | C15 | C16 | 103.7° | 105.1° |
| N14 | C15 | H43 | 110.9° | 110.3° |
| N14 | C15 | H44 | 110.9° | 110.3° |
| N14 | S11 | C10 | 105.1° | 107.2° |
| N14 | S11 | O13 | 106.8° | 106.4° |
| C16 | C26 | C25 | 110.8° | 109.3° |
| C26 | C16 | C15 | 112.2° | 110.3° |
| C26 | C16 | C17 | 105.5° | 110.2° |
| C16 | C26 | H54 | 109.2° | 109.5° |
| C16 | C26 | H53 | 109.1° | 109.5° |
| C26 | C25 | N19 | 112.3° | 109.5° |
| C26 | C25 | H51 | 108.7° | 109.5° |
| C26 | C25 | H52 | 108.7° | 109.5° |
| C25 | C26 | H54 | 109.1° | 109.5° |
| C25 | C26 | H53 | 109.1° | 109.5° |
| C15 | C16 | C17 | 113.8° | 110.3° |
| C16 | C15 | H43 | 110.9° | 110.4° |
| C16 | C15 | H44 | 110.9° | 110.4° |
| C16 | C17 | C18 | 111.9° | 109.3° |
| C16 | C17 | H45 | 108.9° | 109.5° |
| C16 | C17 | H46 | 108.9° | 109.5° |
| C3 | N2 | S4 | 117.0° | 120.0° |
| C3 | N2 | C1 | 113.1° | 120.0° |
| N2 | C3 | H40 | 109.5° | 109.5° |
| N2 | C3 | H39 | 109.5° | 109.5° |
| N2 | C3 | H38 | 109.5° | 109.4° |
| C34 | C33 | C10 | 119.4° | 120.0° |
| C33 | C34 | C7 | 119.6° | 120.0° |
| C34 | C33 | H59 | 120.3° | 120.0° |
| C33 | C34 | H60 | 120.2° | 120.0° |
| C33 | C10 | S11 | 119.9° | 120.0° |
| C33 | C10 | C9 | 120.9° | 120.1° |
| C10 | C33 | H59 | 120.3° | 120.1° |
| C34 | C7 | S4 | 119.6° | 120.0° |
| C34 | C7 | C8 | 121.0° | 120.0° |
| C7 | C34 | H60 | 120.2° | 120.0° |
| C17 | C18 | N19 | 112.8° | 109.5° |
| C18 | C17 | H45 | 108.8° | 109.5° |
| C18 | C17 | H46 | 108.9° | 109.5° |
| C17 | C18 | H47 | 108.6° | 109.5° |
| C17 | C18 | H48 | 108.6° | 109.5° |
| C10 | S11 | O13 | 107.8° | 106.4° |
| S11 | C10 | C9 | 119.2° | 120.0° |
| C10 | C9 | C8 | 119.6° | 120.0° |
| C10 | C9 | H42 | 120.2° | 120.0° |
| C25 | N19 | C18 | 112.2° | 111.2° |
| C25 | N19 | C20 | 110.4° | 111.0° |
| N19 | C25 | H51 | 108.8° | 109.4° |
| N19 | C25 | H52 | 108.8° | 109.4° |
| O5 | S4 | N2 | 107.0° | 106.4° |
| O5 | S4 | C7 | 108.9° | 106.4° |
| O5 | S4 | O6 | 120.4° | 123.2° |
| S4 | N2 | C1 | 117.8° | 120.0° |
| N2 | S4 | C7 | 102.8° | 107.2° |
| N2 | S4 | O6 | 107.2° | 106.4° |
| N2 | C1 | H36 | 109.5° | 109.5° |
| N2 | C1 | H35 | 109.5° | 109.4° |
| N2 | C1 | H37 | 109.4° | 109.4° |
| S4 | C7 | C8 | 119.4° | 120.0° |
| C7 | S4 | O6 | 109.1° | 106.4° |
| C7 | C8 | C9 | 119.4° | 120.0° |
| C7 | C8 | H41 | 120.3° | 120.0° |
| C18 | N19 | C20 | 108.4° | 111.0° |
| N19 | C18 | H47 | 108.6° | 109.4° |
| N19 | C18 | H48 | 108.7° | 109.4° |
| N19 | C20 | C21 | 117.2° | 109.5° |
| N19 | C20 | H49 | 107.5° | 109.5° |
| N19 | C20 | H50 | 107.5° | 109.4° |
| C9 | C8 | H41 | 120.3° | 120.0° |
| C8 | C9 | H42 | 120.2° | 120.0° |
| F22 | C21 | F24 | 106.8° | 109.5° |
| F22 | C21 | C20 | 113.0° | 109.5° |
| F22 | C21 | F23 | 106.0° | 109.4° |
| F24 | C21 | C20 | 112.4° | 109.5° |
| F24 | C21 | F23 | 106.5° | 109.5° |
| C20 | C21 | F23 | 111.8° | 109.5° |
| C21 | C20 | H49 | 107.5° | 109.5° |
| C21 | C20 | H50 | 107.5° | 109.5° |
| H36 | C1 | H35 | 109.5° | 109.5° |
| H36 | C1 | H37 | 109.5° | 109.5° |
| H35 | C1 | H37 | 109.5° | 109.5° |
| H40 | C3 | H39 | 109.5° | 109.5° |
| H40 | C3 | H38 | 109.5° | 109.4° |
| H39 | C3 | H38 | 109.4° | 109.5° |
| H43 | C15 | H44 | 109.4° | 110.2° |
| H51 | C25 | H52 | 109.5° | 109.5° |
| H54 | C26 | H53 | 109.5° | 109.6° |
| H45 | C17 | H46 | 109.4° | 109.6° |
| H47 | C18 | H48 | 109.5° | 109.5° |
| H49 | C20 | H50 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C29 | C30 | C31 | H57 | 180.0° | 179.9° |
| C30 | C29 | C28 | H56 | 180.0° | 179.9° |
| C29 | C30 | C31 | C32 | 0.0° | 0.1° |
| C30 | C29 | C28 | C27 | 0.1° | 0.1° |
| C30 | C29 | C28 | H55 | 179.9° | 180.0° |
| C29 | C30 | C31 | H58 | 180.0° | 179.9° |
| C31 | C30 | C29 | C28 | 0.0° | 0.1° |
| C30 | C31 | C32 | H58 | 180.0° | 180.0° |
| C30 | C31 | C32 | C27 | 0.3° | 0.0° |
| C30 | C31 | C32 | N14 | 179.7° | 180.0° |
| C31 | C30 | C29 | H56 | 180.0° | 180.0° |
| C29 | C28 | C27 | H55 | 180.0° | 180.0° |
| C29 | C28 | C27 | C32 | 0.3° | 0.0° |
| C29 | C28 | C27 | C16 | 179.9° | 179.9° |
| C28 | C29 | C30 | H57 | 180.0° | 180.0° |
| C31 | C32 | C27 | C28 | 0.4° | 0.0° |
| C31 | C32 | C27 | N14 | 179.5° | 180.0° |
| C31 | C32 | C27 | C16 | 180.0° | 180.0° |
| C31 | C32 | N14 | C15 | 162.5° | 179.9° |
| C31 | C32 | N14 | S11 | 47.5° | 0.1° |
| C32 | C31 | C30 | H57 | 180.0° | 180.0° |
| C28 | C27 | C32 | C16 | 179.7° | 179.9° |
| C28 | C27 | C32 | N14 | 179.9° | 179.9° |
| C28 | C27 | C16 | C26 | 43.4° | 61.0° |
| C28 | C27 | C16 | C15 | 163.8° | 179.9° |
| C28 | C27 | C16 | C17 | 74.9° | 61.3° |
| C27 | C28 | C29 | H56 | 179.9° | 180.0° |
| C27 | C32 | N14 | C15 | 17.0° | 0.0° |
| C27 | C32 | N14 | S11 | 133.0° | 179.9° |
| C32 | C27 | C16 | C26 | 137.0° | 118.9° |
| C32 | C27 | C16 | C15 | 16.6° | 0.0° |
| C32 | C27 | C16 | C17 | 104.7° | 118.8° |
| C32 | C27 | C28 | H55 | 179.7° | 180.0° |
| C27 | C32 | C31 | H58 | 179.8° | 180.0° |
| N14 | C32 | C27 | C16 | 0.5° | 0.0° |
| C32 | N14 | S11 | O12 | 45.1° | 23.5° |
| C32 | N14 | C15 | S11 | 151.9° | 180.0° |
| C32 | N14 | C15 | C16 | 26.8° | 0.1° |
| C32 | N14 | S11 | C10 | 70.6° | 90.0° |
| C32 | N14 | S11 | O13 | 175.0° | 156.4° |
| C32 | N14 | C15 | H43 | 145.9° | 118.9° |
| C32 | N14 | C15 | H44 | 92.3° | 119.1° |
| N14 | C32 | C31 | H58 | 0.4° | 0.0° |
| C27 | C16 | C15 | N14 | 25.5° | 0.1° |
| C27 | C16 | C26 | C15 | 114.2° | 115.6° |
| C27 | C16 | C26 | C17 | 121.4° | 122.4° |
| C27 | C16 | C26 | C25 | 178.2° | 179.0° |
| C27 | C16 | C15 | C17 | 119.4° | 119.0° |
| C27 | C16 | C17 | C18 | 178.6° | 179.1° |
| C27 | C16 | C15 | H43 | 144.6° | 118.9° |
| C27 | C16 | C15 | H44 | 93.6° | 119.0° |
| C27 | C16 | C26 | H54 | 58.0° | 61.1° |
| C27 | C16 | C26 | H53 | 61.6° | 59.0° |
| C16 | C27 | C28 | H55 | 0.1° | 0.0° |
| C27 | C16 | C17 | H45 | 61.0° | 59.1° |
| C27 | C16 | C17 | H46 | 58.2° | 61.0° |
| O12 | S11 | N14 | C15 | 168.3° | 156.5° |
| O12 | S11 | N14 | C10 | 115.7° | 113.6° |
| O12 | S11 | N14 | O13 | 129.9° | 132.9° |
| O12 | S11 | C10 | C33 | 28.9° | 23.9° |
| O12 | S11 | C10 | O13 | 131.8° | 132.9° |
| O12 | S11 | C10 | C9 | 151.5° | 156.4° |
| N14 | C15 | C16 | C26 | 146.3° | 119.1° |
| N14 | C15 | C16 | H43 | 119.1° | 118.9° |
| N14 | C15 | C16 | H44 | 119.1° | 119.0° |
| N14 | C15 | C16 | C17 | 93.9° | 118.9° |
| C15 | N14 | S11 | C10 | 76.0° | 90.0° |
| C15 | N14 | S11 | O13 | 38.4° | 23.5° |
| N14 | C15 | H43 | H44 | 122.6° | 122.1° |
| S11 | N14 | C15 | C16 | 125.1° | 179.9° |
| N14 | S11 | C10 | C33 | 85.7° | 89.7° |
| N14 | S11 | C10 | O13 | 113.7° | 113.6° |
| N14 | S11 | C10 | C9 | 94.0° | 90.0° |
| S11 | N14 | C15 | H43 | 6.0° | 61.1° |
| S11 | N14 | C15 | H44 | 115.7° | 60.9° |
| C16 | C26 | C25 | H54 | 120.2° | 119.9° |
| C16 | C26 | C25 | H53 | 120.2° | 119.9° |
| C26 | C16 | C15 | C17 | 119.7° | 122.0° |
| C26 | C16 | C17 | C18 | 58.8° | 56.6° |
| C16 | C26 | C25 | N19 | 59.0° | 58.5° |
| C26 | C16 | C15 | H43 | 94.6° | 0.2° |
| C26 | C16 | C15 | H44 | 27.3° | 121.9° |
| C16 | C26 | C25 | H51 | 61.4° | 61.6° |
| C16 | C26 | C25 | H52 | 179.5° | 178.4° |
| C16 | C26 | H54 | H53 | 119.4° | 120.0° |
| C26 | C16 | C17 | H45 | 61.6° | 63.3° |
| C26 | C16 | C17 | H46 | 179.2° | 176.5° |
| C25 | C26 | C16 | C15 | 64.1° | 65.4° |
| C25 | C26 | C16 | C17 | 60.4° | 56.6° |
| C26 | C25 | N19 | H51 | 120.4° | 120.1° |
| C26 | C25 | N19 | H52 | 120.4° | 120.0° |
| C26 | C25 | N19 | C18 | 52.1° | 62.1° |
| C26 | C25 | N19 | C20 | 173.1° | 173.8° |
| C26 | C25 | H51 | H52 | 118.7° | 120.0° |
| C25 | C26 | H54 | H53 | 119.4° | 120.2° |
| C15 | C16 | C17 | C18 | 64.7° | 65.4° |
| C16 | C15 | H43 | H44 | 122.7° | 122.2° |
| C15 | C16 | C26 | H54 | 56.1° | 54.5° |
| C15 | C16 | C26 | H53 | 175.7° | 174.7° |
| C15 | C16 | C17 | H45 | 174.9° | 174.7° |
| C15 | C16 | C17 | H46 | 55.7° | 54.5° |
| C16 | C17 | C18 | H45 | 120.4° | 119.9° |
| C16 | C17 | C18 | H46 | 120.4° | 119.9° |
| C16 | C17 | C18 | N19 | 55.4° | 58.5° |
| C17 | C16 | C15 | H43 | 25.1° | 122.2° |
| C17 | C16 | C15 | H44 | 147.0° | 0.1° |
| C17 | C16 | C26 | H54 | 179.4° | 176.5° |
| C17 | C16 | C26 | H53 | 59.8° | 63.4° |
| C16 | C17 | H45 | H46 | 118.9° | 120.1° |
| C16 | C17 | C18 | H47 | 175.9° | 178.4° |
| C16 | C17 | C18 | H48 | 65.1° | 61.5° |
| C3 | N2 | S4 | O5 | 49.9° | 23.5° |
| C3 | N2 | S4 | C1 | 140.0° | 179.9° |
| C3 | N2 | S4 | C7 | 64.7° | 90.0° |
| C3 | N2 | S4 | O6 | 179.7° | 156.4° |
| C3 | N2 | C1 | H36 | 180.0° | 90.0° |
| C3 | N2 | C1 | H35 | 60.0° | 150.0° |
| C3 | N2 | C1 | H37 | 60.0° | 30.0° |
| N2 | C3 | H40 | H39 | 120.0° | 120.0° |
| N2 | C3 | H40 | H38 | 120.0° | 120.0° |
| N2 | C3 | H39 | H38 | 120.0° | 120.0° |
| C34 | C33 | C10 | H59 | 180.0° | 179.9° |
| C33 | C34 | C7 | H60 | 180.0° | 179.9° |
| C34 | C33 | C10 | S11 | 179.8° | 180.0° |
| C34 | C33 | C10 | C9 | 0.1° | 0.4° |
| C33 | C34 | C7 | S4 | 179.6° | 180.0° |
| C33 | C34 | C7 | C8 | 0.3° | 0.3° |
| C10 | C33 | C34 | C7 | 0.1° | 0.1° |
| C33 | C10 | S11 | C9 | 179.6° | 179.7° |
| C33 | C10 | S11 | O13 | 160.6° | 156.7° |
| C33 | C10 | C9 | C8 | 0.2° | 0.3° |
| C10 | C33 | C34 | H60 | 179.9° | 180.0° |
| C33 | C10 | C9 | H42 | 179.8° | 180.0° |
| C34 | C7 | S4 | O5 | 26.4° | 23.3° |
| C34 | C7 | S4 | N2 | 86.9° | 90.3° |
| C34 | C7 | S4 | C8 | 179.3° | 179.7° |
| C34 | C7 | S4 | O6 | 159.5° | 156.2° |
| C34 | C7 | C8 | C9 | 0.3° | 0.3° |
| C34 | C7 | C8 | H41 | 179.7° | 179.8° |
| C7 | C34 | C33 | H59 | 179.9° | 180.0° |
| C17 | C18 | N19 | C25 | 50.2° | 62.1° |
| C17 | C18 | N19 | H47 | 120.5° | 120.0° |
| C17 | C18 | N19 | H48 | 120.5° | 120.1° |
| C17 | C18 | N19 | C20 | 172.3° | 173.7° |
| C18 | C17 | H45 | H46 | 118.9° | 120.1° |
| C17 | C18 | H47 | H48 | 118.5° | 120.1° |
| S11 | C10 | C9 | C8 | 179.8° | 180.0° |
| S11 | C10 | C33 | H59 | 0.2° | 0.1° |
| S11 | C10 | C9 | H42 | 0.2° | 0.3° |
| O13 | S11 | C10 | C9 | 19.7° | 23.6° |
| C10 | C9 | C8 | C7 | 0.0° | 0.0° |
| C10 | C9 | C8 | H42 | 180.0° | 179.7° |
| C10 | C9 | C8 | H41 | 180.0° | 180.0° |
| C9 | C10 | C33 | H59 | 179.8° | 179.7° |
| C25 | N19 | C18 | C20 | 122.2° | 124.1° |
| C25 | N19 | C20 | C21 | 77.6° | 76.9° |
| N19 | C25 | H51 | H52 | 118.7° | 119.9° |
| N19 | C25 | C26 | H54 | 179.3° | 178.4° |
| N19 | C25 | C26 | H53 | 61.2° | 61.4° |
| C25 | N19 | C18 | H47 | 170.6° | 177.9° |
| C25 | N19 | C18 | H48 | 70.3° | 58.0° |
| C25 | N19 | C20 | H49 | 161.3° | 43.2° |
| C25 | N19 | C20 | H50 | 43.5° | 163.2° |
| O5 | S4 | N2 | C7 | 114.6° | 113.5° |
| O5 | S4 | N2 | O6 | 130.4° | 132.9° |
| O5 | S4 | N2 | C1 | 170.2° | 156.4° |
| O5 | S4 | C7 | O6 | 133.1° | 132.9° |
| O5 | S4 | C7 | C8 | 154.3° | 156.4° |
| N2 | S4 | C7 | O6 | 113.6° | 113.5° |
| N2 | S4 | C7 | C8 | 92.4° | 90.0° |
| S4 | N2 | C1 | H36 | 38.6° | 89.9° |
| S4 | N2 | C1 | H35 | 81.5° | 30.0° |
| S4 | N2 | C1 | H37 | 158.6° | 150.0° |
| S4 | N2 | C3 | H40 | 180.0° | 60.0° |
| S4 | N2 | C3 | H39 | 60.0° | 180.0° |
| S4 | N2 | C3 | H38 | 60.0° | 60.0° |
| C1 | N2 | S4 | C7 | 75.2° | 90.0° |
| C1 | N2 | S4 | O6 | 39.8° | 23.5° |
| N2 | C1 | H36 | H35 | 120.0° | 119.9° |
| N2 | C1 | H36 | H37 | 120.0° | 120.0° |
| N2 | C1 | H35 | H37 | 120.0° | 119.9° |
| C1 | N2 | C3 | H40 | 38.2° | 120.0° |
| C1 | N2 | C3 | H39 | 81.8° | 0.1° |
| C1 | N2 | C3 | H38 | 158.2° | 120.1° |
| S4 | C7 | C8 | C9 | 179.6° | 180.0° |
| S4 | C7 | C8 | H41 | 0.4° | 0.0° |
| S4 | C7 | C34 | H60 | 0.4° | 0.1° |
| C8 | C7 | S4 | O6 | 21.2° | 23.5° |
| C7 | C8 | C9 | H41 | 180.0° | 179.9° |
| C8 | C7 | C34 | H60 | 179.7° | 179.7° |
| C7 | C8 | C9 | H42 | 180.0° | 179.7° |
| C18 | N19 | C20 | C21 | 159.2° | 158.9° |
| C18 | N19 | C25 | H51 | 68.3° | 58.0° |
| C18 | N19 | C25 | H52 | 172.5° | 177.9° |
| N19 | C18 | C17 | H45 | 65.0° | 61.4° |
| N19 | C18 | C17 | H46 | 175.8° | 178.4° |
| N19 | C18 | H47 | H48 | 118.5° | 119.9° |
| C18 | N19 | C20 | H49 | 38.1° | 81.1° |
| C18 | N19 | C20 | H50 | 79.7° | 38.9° |
| N19 | C20 | C21 | F22 | 60.2° | 66.0° |
| N19 | C20 | C21 | F24 | 60.7° | 174.0° |
| N19 | C20 | C21 | H49 | 121.1° | 120.0° |
| N19 | C20 | C21 | H50 | 121.1° | 120.0° |
| N19 | C20 | C21 | F23 | 179.6° | 54.0° |
| C20 | N19 | C25 | H51 | 52.7° | 66.2° |
| C20 | N19 | C25 | H52 | 66.5° | 53.8° |
| C20 | N19 | C18 | H47 | 67.2° | 53.8° |
| C20 | N19 | C18 | H48 | 51.9° | 66.2° |
| N19 | C20 | H49 | H50 | 116.5° | 120.0° |
| F22 | C21 | F24 | C20 | 124.4° | 120.0° |
| F22 | C21 | F24 | F23 | 112.9° | 120.0° |
| F22 | C21 | C20 | F23 | 119.4° | 120.0° |
| F22 | C21 | C20 | H49 | 178.7° | 54.0° |
| F22 | C21 | C20 | H50 | 61.0° | 174.1° |
| F24 | C21 | C20 | F23 | 119.7° | 120.0° |
| F24 | C21 | C20 | H49 | 60.4° | 66.0° |
| F24 | C21 | C20 | H50 | 178.1° | 54.0° |
| C21 | C20 | H49 | H50 | 116.5° | 120.0° |
| F23 | C21 | C20 | H49 | 59.3° | 174.0° |
| F23 | C21 | C20 | H50 | 58.4° | 66.0° |
| H36 | C1 | H35 | H37 | 120.0° | 120.1° |
| H40 | C3 | H39 | H38 | 120.0° | 120.0° |
| H41 | C8 | C9 | H42 | 0.0° | 0.2° |
| H51 | C25 | C26 | H54 | 58.8° | 58.4° |
| H51 | C25 | C26 | H53 | 178.4° | 178.5° |
| H52 | C25 | C26 | H54 | 60.3° | 61.7° |
| H52 | C25 | C26 | H53 | 59.3° | 58.5° |
| H55 | C28 | C29 | H56 | 0.1° | 0.0° |
| H58 | C31 | C30 | H57 | 0.0° | 0.0° |
| H45 | C17 | C18 | H47 | 55.5° | 58.5° |
| H45 | C17 | C18 | H48 | 174.5° | 178.5° |
| H46 | C17 | C18 | H47 | 63.8° | 61.7° |
| H46 | C17 | C18 | H48 | 55.3° | 58.4° |
| H56 | C29 | C30 | H57 | 0.0° | 0.1° |
| H59 | C33 | C34 | H60 | 0.1° | 0.1° |
