25S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C5 | doub | 1.21Å | 1.25Å | |
| C5 | N1 | sing | 1.35Å | 1.35Å | |
| C5 | C6 | sing | 1.51Å | 1.53Å | |
| N1 | C4 | sing | 1.40Å | 1.35Å | |
| C4 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C4 | C | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | N | doub | 1.32Å | 1.36Å | Aromatic |
| N | C1 | sing | 1.32Å | 1.36Å | Aromatic |
| C1 | C | doub | 1.38Å | 1.43Å | Aromatic |
| C6 | C24 | sing | 1.53Å | 1.53Å | |
| C6 | N2 | sing | 1.46Å | 1.45Å | |
| C24 | C25 | sing | 1.51Å | 1.49Å | |
| C25 | C28 | sing | 1.46Å | 1.47Å | Aromatic |
| C25 | C26 | doub | 1.34Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.40Å | 1.37Å | Aromatic |
| C28 | C27 | doub | 1.41Å | 1.48Å | Aromatic |
| C29 | C30 | doub | 1.37Å | 1.40Å | Aromatic |
| C30 | C31 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| C27 | N5 | sing | 1.38Å | 1.35Å | Aromatic |
| N5 | C26 | sing | 1.37Å | 1.36Å | Aromatic |
| N2 | C7 | sing | 1.35Å | 1.32Å | |
| C7 | O | doub | 1.22Å | 1.20Å | |
| C7 | C8 | sing | 1.47Å | 1.49Å | |
| C8 | C23 | sing | 1.40Å | 1.48Å | Aromatic |
| C8 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C23 | F2 | sing | 1.35Å | 1.33Å | |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | N3 | sing | 1.39Å | 1.38Å | |
| C10 | C9 | sing | 1.37Å | 1.39Å | Aromatic |
| N3 | C21 | sing | 1.47Å | 1.46Å | |
| N3 | C12 | sing | 1.47Å | 1.47Å | |
| C21 | C20 | sing | 1.53Å | 1.51Å | |
| C20 | N4 | sing | 1.47Å | 1.46Å | |
| N4 | C13 | sing | 1.47Å | 1.47Å | |
| N4 | C14 | sing | 1.40Å | 1.39Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C14 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.37Å | Aromatic |
| C17 | F1 | sing | 1.35Å | 1.33Å | |
| C17 | C16 | doub | 1.39Å | 1.49Å | Aromatic |
| C16 | F | sing | 1.35Å | 1.36Å | |
| C16 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C | H | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | HA | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| N2 | HB | sing | 0.97Å | 1.00Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| N5 | H5 | sing | 0.97Å | 1.00Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C5 | N1 | 125.3° | 120.0° |
| O1 | C5 | C6 | 119.7° | 120.0° |
| N1 | C5 | C6 | 115.0° | 120.0° |
| C5 | N1 | C4 | 122.6° | 120.0° |
| C5 | N1 | H1 | 118.7° | 120.0° |
| C5 | C6 | C24 | 113.2° | 109.5° |
| C5 | C6 | N2 | 114.8° | 109.5° |
| C5 | C6 | H6 | 106.7° | 109.5° |
| N1 | C4 | C3 | 116.9° | 120.9° |
| N1 | C4 | C | 125.5° | 120.9° |
| C4 | N1 | H1 | 118.7° | 120.0° |
| C3 | C4 | C | 117.1° | 118.3° |
| C4 | C3 | C2 | 121.2° | 119.1° |
| C4 | C3 | H3 | 119.4° | 120.4° |
| C4 | C | C1 | 119.4° | 119.1° |
| C4 | C | H | 120.3° | 120.4° |
| C3 | C2 | N | 122.0° | 120.8° |
| C2 | C3 | H3 | 119.4° | 120.5° |
| C3 | C2 | H2 | 119.0° | 119.6° |
| C2 | N | C1 | 118.0° | 121.9° |
| N | C2 | H2 | 119.0° | 119.6° |
| N | C1 | C | 122.3° | 120.8° |
| N | C1 | HA | 118.9° | 119.6° |
| C1 | C | H | 120.3° | 120.5° |
| C | C1 | HA | 118.8° | 119.6° |
| C24 | C6 | N2 | 107.5° | 109.5° |
| C6 | C24 | C25 | 109.1° | 109.4° |
| C24 | C6 | H6 | 106.7° | 109.5° |
| C6 | C24 | H241 | 109.6° | 109.5° |
| C6 | C24 | H242 | 109.6° | 109.4° |
| C6 | N2 | C7 | 120.4° | 120.0° |
| N2 | C6 | H6 | 107.6° | 109.5° |
| C6 | N2 | HB | 119.8° | 120.0° |
| C24 | C25 | C28 | 127.5° | 126.5° |
| C24 | C25 | C26 | 126.8° | 126.5° |
| C25 | C24 | H241 | 109.6° | 109.5° |
| C25 | C24 | H242 | 109.6° | 109.5° |
| C28 | C25 | C26 | 105.6° | 107.0° |
| C25 | C28 | C29 | 132.8° | 134.0° |
| C25 | C28 | C27 | 105.6° | 106.1° |
| C25 | C26 | N5 | 110.3° | 109.9° |
| C25 | C26 | H26 | 124.9° | 125.1° |
| C29 | C28 | C27 | 121.6° | 119.9° |
| C28 | C29 | C30 | 116.9° | 119.8° |
| C28 | C29 | H29 | 121.6° | 120.1° |
| C28 | C27 | C32 | 119.5° | 119.3° |
| C28 | C27 | N5 | 106.6° | 107.1° |
| C29 | C30 | C31 | 122.2° | 120.5° |
| C30 | C29 | H29 | 121.5° | 120.1° |
| C29 | C30 | H30 | 118.9° | 119.7° |
| C30 | C31 | C32 | 122.4° | 120.7° |
| C31 | C30 | H30 | 118.9° | 119.8° |
| C30 | C31 | H31 | 118.8° | 119.7° |
| C31 | C32 | C27 | 117.4° | 119.8° |
| C32 | C31 | H31 | 118.8° | 119.6° |
| C31 | C32 | H32 | 121.3° | 120.1° |
| C32 | C27 | N5 | 133.9° | 133.6° |
| C27 | C32 | H32 | 121.3° | 120.1° |
| C27 | N5 | C26 | 111.8° | 109.9° |
| C27 | N5 | H5 | 124.1° | 125.0° |
| N5 | C26 | H26 | 124.8° | 125.0° |
| C26 | N5 | H5 | 124.1° | 125.1° |
| N2 | C7 | O | 119.1° | 120.0° |
| N2 | C7 | C8 | 123.2° | 120.0° |
| C7 | N2 | HB | 119.8° | 120.0° |
| O | C7 | C8 | 117.7° | 120.0° |
| C7 | C8 | C23 | 124.1° | 120.1° |
| C7 | C8 | C9 | 118.5° | 120.1° |
| C23 | C8 | C9 | 117.4° | 119.8° |
| C8 | C23 | F2 | 120.7° | 120.2° |
| C8 | C23 | C22 | 120.2° | 119.7° |
| C8 | C9 | C10 | 121.0° | 120.1° |
| C8 | C9 | H9 | 119.5° | 120.0° |
| F2 | C23 | C22 | 119.0° | 120.1° |
| C23 | C22 | C11 | 120.0° | 119.9° |
| C23 | C22 | H22 | 120.0° | 120.1° |
| C22 | C11 | C10 | 120.3° | 120.2° |
| C22 | C11 | N3 | 120.7° | 119.9° |
| C11 | C22 | H22 | 120.0° | 120.0° |
| C10 | C11 | N3 | 119.0° | 119.9° |
| C11 | C10 | C9 | 121.0° | 120.2° |
| C11 | C10 | H10 | 119.5° | 119.9° |
| C11 | N3 | C21 | 118.3° | 111.0° |
| C11 | N3 | C12 | 121.6° | 111.0° |
| C10 | C9 | H9 | 119.5° | 119.9° |
| C9 | C10 | H10 | 119.5° | 119.9° |
| C21 | N3 | C12 | 120.0° | 110.9° |
| N3 | C21 | C20 | 103.7° | 109.3° |
| N3 | C21 | H211 | 110.9° | 109.4° |
| N3 | C21 | H212 | 110.9° | 109.5° |
| N3 | C12 | C13 | 106.4° | 109.4° |
| N3 | C12 | H121 | 110.2° | 109.5° |
| N3 | C12 | H122 | 110.2° | 109.5° |
| C21 | C20 | N4 | 99.4° | 109.4° |
| C20 | C21 | H211 | 110.9° | 109.5° |
| C20 | C21 | H212 | 110.9° | 109.5° |
| C21 | C20 | H201 | 111.9° | 109.5° |
| C21 | C20 | H202 | 111.9° | 109.5° |
| C20 | N4 | C13 | 120.0° | 110.9° |
| C20 | N4 | C14 | 117.3° | 111.0° |
| N4 | C20 | H201 | 111.9° | 109.4° |
| N4 | C20 | H202 | 111.9° | 109.5° |
| C13 | N4 | C14 | 122.5° | 111.0° |
| N4 | C13 | C12 | 107.4° | 109.3° |
| N4 | C13 | H131 | 110.0° | 109.5° |
| N4 | C13 | H132 | 110.0° | 109.5° |
| N4 | C14 | C19 | 113.3° | 120.1° |
| N4 | C14 | C15 | 124.8° | 120.0° |
| C13 | C12 | H121 | 110.2° | 109.5° |
| C13 | C12 | H122 | 110.2° | 109.5° |
| C12 | C13 | H131 | 110.0° | 109.4° |
| C12 | C13 | H132 | 110.0° | 109.5° |
| C19 | C14 | C15 | 121.9° | 119.9° |
| C14 | C19 | C18 | 122.1° | 120.0° |
| C14 | C19 | H19 | 119.0° | 120.0° |
| C14 | C15 | C16 | 118.1° | 120.0° |
| C14 | C15 | H15 | 120.9° | 120.0° |
| C19 | C18 | C17 | 118.1° | 120.1° |
| C18 | C19 | H19 | 119.0° | 120.0° |
| C19 | C18 | H18 | 120.9° | 119.9° |
| C18 | C17 | F1 | 116.4° | 119.9° |
| C18 | C17 | C16 | 121.8° | 120.1° |
| C17 | C18 | H18 | 121.0° | 120.0° |
| F1 | C17 | C16 | 121.9° | 120.0° |
| C17 | C16 | F | 118.7° | 120.0° |
| C17 | C16 | C15 | 118.1° | 120.0° |
| F | C16 | C15 | 123.2° | 120.1° |
| C16 | C15 | H15 | 121.0° | 120.0° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.6° |
| H121 | C12 | H122 | 109.5° | 109.5° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C5 | N1 | C6 | 177.6° | 179.6° |
| O1 | C5 | N1 | C4 | 8.4° | 5.4° |
| O1 | C5 | C6 | C24 | 86.3° | 120.0° |
| O1 | C5 | C6 | N2 | 149.8° | 0.0° |
| O1 | C5 | N1 | H1 | 171.6° | 174.7° |
| O1 | C5 | C6 | H6 | 30.7° | 120.0° |
| C5 | N1 | C4 | H1 | 180.0° | 179.9° |
| C5 | N1 | C4 | C3 | 143.8° | 147.6° |
| C5 | N1 | C4 | C | 28.1° | 32.6° |
| N1 | C5 | C6 | C24 | 91.5° | 59.7° |
| N1 | C5 | C6 | N2 | 32.5° | 179.7° |
| N1 | C5 | C6 | H6 | 151.5° | 60.3° |
| C6 | C5 | N1 | C4 | 169.2° | 175.0° |
| C5 | C6 | C24 | N2 | 127.8° | 120.0° |
| C5 | C6 | C24 | H6 | 117.0° | 120.0° |
| C5 | C6 | N2 | H6 | 118.5° | 120.0° |
| C5 | C6 | C24 | C25 | 57.7° | 175.0° |
| C5 | C6 | N2 | C7 | 72.5° | 85.0° |
| C6 | C5 | N1 | H1 | 10.8° | 4.9° |
| C5 | C6 | C24 | H241 | 177.7° | 54.9° |
| C5 | C6 | C24 | H242 | 62.2° | 65.0° |
| C5 | C6 | N2 | HB | 107.5° | 95.0° |
| N1 | C4 | C3 | C | 172.6° | 179.8° |
| N1 | C4 | C3 | C2 | 174.2° | 180.0° |
| N1 | C4 | C | C1 | 174.1° | 179.7° |
| N1 | C4 | C3 | H3 | 5.8° | 0.0° |
| N1 | C4 | C | H | 5.9° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | N | 0.4° | 0.1° |
| C3 | C4 | C | C1 | 2.2° | 0.4° |
| C3 | C4 | N1 | H1 | 36.2° | 32.5° |
| C3 | C4 | C | H | 177.8° | 179.7° |
| C4 | C3 | C2 | H2 | 179.6° | 180.0° |
| C | C4 | C3 | C2 | 1.6° | 0.2° |
| C4 | C | C1 | N | 0.9° | 0.4° |
| C4 | C | C1 | H | 180.0° | 179.9° |
| C | C4 | N1 | H1 | 151.9° | 147.3° |
| C | C4 | C3 | H3 | 178.4° | 179.8° |
| C4 | C | C1 | HA | 179.1° | 179.8° |
| C3 | C2 | N | H2 | 180.0° | 179.9° |
| C3 | C2 | N | C1 | 1.7° | 0.1° |
| C2 | N | C1 | C | 1.0° | 0.2° |
| N | C2 | C3 | H3 | 179.6° | 179.9° |
| C2 | N | C1 | HA | 179.0° | 180.0° |
| N | C1 | C | HA | 180.0° | 179.8° |
| N | C1 | C | H | 179.0° | 179.7° |
| C1 | N | C2 | H2 | 178.3° | 180.0° |
| C24 | C6 | N2 | H6 | 114.6° | 120.0° |
| C6 | C24 | C25 | H241 | 120.0° | 120.0° |
| C6 | C24 | C25 | H242 | 119.9° | 119.9° |
| C6 | C24 | C25 | C28 | 94.1° | 85.1° |
| C6 | C24 | C25 | C26 | 83.6° | 95.3° |
| C24 | C6 | N2 | C7 | 160.6° | 155.0° |
| C6 | C24 | H241 | H242 | 120.2° | 119.9° |
| C24 | C6 | N2 | HB | 19.4° | 25.0° |
| N2 | C6 | C24 | C25 | 70.1° | 65.0° |
| C6 | N2 | C7 | HB | 180.0° | 180.0° |
| C6 | N2 | C7 | O | 5.1° | 0.0° |
| C6 | N2 | C7 | C8 | 174.1° | 180.0° |
| N2 | C6 | C24 | H241 | 49.8° | 175.0° |
| N2 | C6 | C24 | H242 | 170.0° | 55.0° |
| C24 | C25 | C28 | C26 | 178.1° | 179.6° |
| C24 | C25 | C28 | C29 | 2.5° | 0.1° |
| C24 | C25 | C28 | C27 | 178.5° | 180.0° |
| C24 | C25 | C26 | N5 | 178.8° | 179.9° |
| C25 | C24 | C6 | H6 | 174.7° | 55.0° |
| C25 | C24 | H241 | H242 | 120.2° | 120.0° |
| C24 | C25 | C26 | H26 | 1.2° | 0.1° |
| C25 | C28 | C29 | C27 | 178.8° | 179.9° |
| C25 | C28 | C29 | C30 | 179.1° | 180.0° |
| C25 | C28 | C27 | C32 | 179.7° | 180.0° |
| C25 | C28 | C27 | N5 | 0.0° | 0.0° |
| C28 | C25 | C26 | N5 | 0.7° | 0.5° |
| C28 | C25 | C24 | H241 | 146.0° | 34.9° |
| C28 | C25 | C24 | H242 | 25.9° | 155.0° |
| C28 | C25 | C26 | H26 | 179.3° | 179.7° |
| C25 | C28 | C29 | H29 | 0.9° | 0.0° |
| C26 | C25 | C28 | C29 | 179.4° | 179.7° |
| C26 | C25 | C28 | C27 | 0.5° | 0.3° |
| C25 | C26 | N5 | C27 | 0.8° | 0.5° |
| C25 | C26 | N5 | H26 | 180.0° | 179.8° |
| C26 | C25 | C24 | H241 | 36.3° | 144.6° |
| C26 | C25 | C24 | H242 | 156.4° | 24.6° |
| C25 | C26 | N5 | H5 | 179.2° | 179.8° |
| C28 | C29 | C30 | H29 | 180.0° | 180.0° |
| C28 | C29 | C30 | C31 | 0.3° | 0.0° |
| C29 | C28 | C27 | C32 | 1.2° | 0.0° |
| C29 | C28 | C27 | N5 | 179.1° | 180.0° |
| C28 | C29 | C30 | H30 | 179.7° | 180.0° |
| C27 | C28 | C29 | C30 | 0.3° | 0.0° |
| C28 | C27 | C32 | C31 | 1.4° | 0.0° |
| C28 | C27 | C32 | N5 | 179.5° | 180.0° |
| C28 | C27 | N5 | C26 | 0.5° | 0.3° |
| C27 | C28 | C29 | H29 | 179.7° | 180.0° |
| C28 | C27 | C32 | H32 | 178.6° | 180.0° |
| C28 | C27 | N5 | H5 | 179.5° | 180.0° |
| C29 | C30 | C31 | H30 | 180.0° | 180.0° |
| C29 | C30 | C31 | C32 | 0.1° | 0.0° |
| C29 | C30 | C31 | H31 | 179.9° | 180.0° |
| C30 | C31 | C32 | H31 | 180.0° | 180.0° |
| C30 | C31 | C32 | C27 | 0.8° | 0.0° |
| C31 | C30 | C29 | H29 | 179.7° | 180.0° |
| C30 | C31 | C32 | H32 | 179.2° | 180.0° |
| C31 | C32 | C27 | H32 | 180.0° | 180.0° |
| C31 | C32 | C27 | N5 | 179.0° | 180.0° |
| C32 | C31 | C30 | H30 | 179.9° | 180.0° |
| C32 | C27 | N5 | C26 | 179.1° | 179.7° |
| C27 | C32 | C31 | H31 | 179.2° | 180.0° |
| C32 | C27 | N5 | H5 | 0.9° | 0.1° |
| C27 | N5 | C26 | H5 | 180.0° | 179.7° |
| C27 | N5 | C26 | H26 | 179.2° | 179.7° |
| N5 | C27 | C32 | H32 | 1.0° | 0.0° |
| N2 | C7 | O | C8 | 179.3° | 180.0° |
| N2 | C7 | C8 | C23 | 12.9° | 180.0° |
| N2 | C7 | C8 | C9 | 168.2° | 0.3° |
| C7 | N2 | C6 | H6 | 46.0° | 35.0° |
| O | C7 | C8 | C23 | 166.4° | 0.0° |
| O | C7 | C8 | C9 | 12.5° | 179.8° |
| O | C7 | N2 | HB | 174.9° | 180.0° |
| C7 | C8 | C23 | C9 | 178.9° | 179.7° |
| C7 | C8 | C23 | F2 | 1.4° | 0.0° |
| C7 | C8 | C23 | C22 | 179.5° | 180.0° |
| C7 | C8 | C9 | C10 | 179.8° | 179.7° |
| C8 | C7 | N2 | HB | 5.9° | 0.0° |
| C7 | C8 | C9 | H9 | 0.2° | 0.0° |
| C8 | C23 | F2 | C22 | 178.1° | 180.0° |
| C8 | C23 | C22 | C11 | 0.5° | 0.1° |
| C23 | C8 | C9 | C10 | 1.3° | 0.5° |
| C23 | C8 | C9 | H9 | 178.7° | 179.7° |
| C8 | C23 | C22 | H22 | 179.5° | 180.0° |
| C9 | C8 | C23 | F2 | 179.7° | 179.8° |
| C9 | C8 | C23 | C22 | 1.6° | 0.3° |
| C8 | C9 | C10 | C11 | 0.3° | 0.6° |
| C8 | C9 | C10 | H9 | 180.0° | 179.7° |
| C8 | C9 | C10 | H10 | 179.8° | 179.8° |
| F2 | C23 | C22 | C11 | 178.6° | 180.0° |
| F2 | C23 | C22 | H22 | 1.4° | 0.1° |
| C23 | C22 | C11 | H22 | 180.0° | 179.9° |
| C23 | C22 | C11 | C10 | 1.1° | 0.1° |
| C23 | C22 | C11 | N3 | 178.9° | 180.0° |
| C22 | C11 | C10 | N3 | 177.9° | 179.9° |
| C22 | C11 | C10 | C9 | 1.5° | 0.4° |
| C22 | C11 | N3 | C21 | 43.1° | 179.9° |
| C22 | C11 | N3 | C12 | 139.0° | 56.2° |
| C22 | C11 | C10 | H10 | 178.5° | 180.0° |
| C11 | C10 | C9 | H10 | 180.0° | 179.6° |
| C10 | C11 | N3 | C21 | 139.0° | 0.0° |
| C10 | C11 | N3 | C12 | 38.9° | 123.9° |
| C11 | C10 | C9 | H9 | 179.7° | 179.7° |
| C10 | C11 | C22 | H22 | 178.9° | 180.0° |
| N3 | C11 | C10 | C9 | 179.4° | 179.7° |
| C11 | N3 | C21 | C12 | 177.9° | 123.9° |
| C11 | N3 | C21 | C20 | 148.7° | 176.8° |
| C11 | N3 | C12 | C13 | 146.6° | 176.8° |
| N3 | C11 | C22 | H22 | 1.0° | 0.1° |
| N3 | C11 | C10 | H10 | 0.6° | 0.1° |
| C11 | N3 | C21 | H211 | 29.6° | 63.3° |
| C11 | N3 | C21 | H212 | 92.3° | 56.8° |
| C11 | N3 | C12 | H121 | 27.0° | 56.9° |
| C11 | N3 | C12 | H122 | 94.0° | 63.2° |
| N3 | C21 | C20 | H211 | 119.1° | 119.9° |
| N3 | C21 | C20 | H212 | 119.1° | 120.0° |
| N3 | C21 | C20 | N4 | 73.5° | 58.4° |
| C21 | N3 | C12 | C13 | 31.3° | 59.3° |
| N3 | C21 | H211 | H212 | 122.7° | 120.1° |
| C21 | N3 | C12 | H121 | 150.8° | 179.3° |
| C21 | N3 | C12 | H122 | 88.2° | 60.7° |
| N3 | C21 | C20 | H201 | 44.9° | 178.3° |
| N3 | C21 | C20 | H202 | 168.2° | 61.6° |
| C12 | N3 | C21 | C20 | 33.4° | 59.3° |
| N3 | C12 | C13 | N4 | 52.9° | 58.4° |
| N3 | C12 | C13 | H121 | 119.5° | 119.9° |
| N3 | C12 | C13 | H122 | 119.5° | 120.0° |
| C12 | N3 | C21 | H211 | 152.5° | 60.6° |
| C12 | N3 | C21 | H212 | 85.7° | 179.3° |
| N3 | C12 | H121 | H122 | 121.4° | 120.1° |
| N3 | C12 | C13 | H131 | 172.6° | 178.3° |
| N3 | C12 | C13 | H132 | 66.7° | 61.6° |
| C21 | C20 | N4 | H201 | 118.3° | 120.0° |
| C21 | C20 | N4 | H202 | 118.3° | 120.0° |
| C21 | C20 | N4 | C13 | 53.4° | 59.3° |
| C21 | C20 | N4 | C14 | 121.7° | 176.8° |
| C20 | C21 | H211 | H212 | 122.7° | 120.1° |
| C21 | C20 | H201 | H202 | 124.7° | 120.1° |
| C20 | N4 | C13 | C14 | 174.9° | 123.9° |
| C20 | N4 | C13 | C12 | 10.5° | 59.4° |
| C20 | N4 | C14 | C19 | 55.6° | 180.0° |
| C20 | N4 | C14 | C15 | 123.3° | 0.2° |
| N4 | C20 | C21 | H211 | 167.5° | 61.5° |
| N4 | C20 | C21 | H212 | 45.6° | 178.3° |
| N4 | C20 | H201 | H202 | 124.7° | 120.0° |
| C20 | N4 | C13 | H131 | 130.2° | 179.2° |
| C20 | N4 | C13 | H132 | 109.1° | 60.7° |
| N4 | C13 | C12 | H131 | 119.7° | 119.9° |
| N4 | C13 | C12 | H132 | 119.6° | 120.0° |
| C13 | N4 | C14 | C19 | 119.5° | 56.2° |
| C13 | N4 | C14 | C15 | 61.7° | 124.1° |
| N4 | C13 | C12 | H121 | 172.5° | 178.3° |
| N4 | C13 | C12 | H122 | 66.6° | 61.6° |
| C13 | N4 | C20 | H201 | 64.9° | 179.3° |
| C13 | N4 | C20 | H202 | 171.8° | 60.6° |
| N4 | C13 | H131 | H132 | 121.0° | 120.1° |
| C14 | N4 | C13 | C12 | 174.6° | 176.8° |
| N4 | C14 | C19 | C15 | 178.9° | 179.7° |
| N4 | C14 | C19 | C18 | 179.2° | 180.0° |
| N4 | C14 | C15 | C16 | 179.4° | 179.7° |
| C14 | N4 | C20 | H201 | 119.9° | 56.8° |
| C14 | N4 | C20 | H202 | 3.4° | 63.2° |
| C14 | N4 | C13 | H131 | 54.9° | 56.9° |
| C14 | N4 | C13 | H132 | 65.8° | 63.2° |
| N4 | C14 | C19 | H19 | 0.8° | 0.0° |
| N4 | C14 | C15 | H15 | 0.6° | 0.0° |
| C13 | C12 | H121 | H122 | 121.4° | 120.1° |
| C12 | C13 | H131 | H132 | 121.0° | 120.1° |
| C14 | C19 | C18 | H19 | 180.0° | 179.9° |
| C14 | C19 | C18 | C17 | 0.3° | 0.0° |
| C19 | C14 | C15 | C16 | 0.7° | 0.5° |
| C19 | C14 | C15 | H15 | 179.4° | 179.7° |
| C14 | C19 | C18 | H18 | 179.8° | 180.0° |
| C15 | C14 | C19 | C18 | 0.3° | 0.3° |
| C14 | C15 | C16 | C17 | 0.5° | 0.5° |
| C14 | C15 | C16 | F | 179.8° | 179.8° |
| C14 | C15 | C16 | H15 | 180.0° | 179.8° |
| C15 | C14 | C19 | H19 | 179.7° | 179.8° |
| C19 | C18 | C17 | H18 | 180.0° | 180.0° |
| C19 | C18 | C17 | F1 | 179.8° | 180.0° |
| C19 | C18 | C17 | C16 | 0.5° | 0.0° |
| C18 | C17 | F1 | C16 | 179.7° | 180.0° |
| C18 | C17 | C16 | F | 179.6° | 180.0° |
| C18 | C17 | C16 | C15 | 0.1° | 0.2° |
| C17 | C18 | C19 | H19 | 179.7° | 179.9° |
| F1 | C17 | C16 | F | 0.1° | 0.0° |
| F1 | C17 | C16 | C15 | 179.8° | 179.8° |
| F1 | C17 | C18 | H18 | 0.2° | 0.0° |
| C17 | C16 | F | C15 | 179.7° | 179.7° |
| C17 | C16 | C15 | H15 | 179.6° | 179.7° |
| C16 | C17 | C18 | H18 | 179.6° | 180.0° |
| F | C16 | C15 | H15 | 0.2° | 0.0° |
| H6 | C6 | C24 | H241 | 65.4° | 65.0° |
| H6 | C6 | C24 | H242 | 54.7° | 175.0° |
| H6 | C6 | N2 | HB | 133.9° | 145.0° |
| H3 | C3 | C2 | H2 | 0.4° | 0.0° |
| H | C | C1 | HA | 1.0° | 0.1° |
| H26 | C26 | N5 | H5 | 0.8° | 0.0° |
| H29 | C29 | C30 | H30 | 0.3° | 0.0° |
| H30 | C30 | C31 | H31 | 0.1° | 0.0° |
| H31 | C31 | C32 | H32 | 0.8° | 0.0° |
| H9 | C9 | C10 | H10 | 0.2° | 0.0° |
| H211 | C21 | C20 | H201 | 74.2° | 58.4° |
| H211 | C21 | C20 | H202 | 49.1° | 178.5° |
| H212 | C21 | C20 | H201 | 163.9° | 61.7° |
| H212 | C21 | C20 | H202 | 72.7° | 58.4° |
| H121 | C12 | C13 | H131 | 67.9° | 61.7° |
| H121 | C12 | C13 | H132 | 52.8° | 58.3° |
| H122 | C12 | C13 | H131 | 53.1° | 58.3° |
| H122 | C12 | C13 | H132 | 173.8° | 178.4° |
| H19 | C19 | C18 | H18 | 0.3° | 0.1° |
