QBL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.51Å | |
| C24 | C3 | sing | 1.51Å | 1.51Å | |
| C22 | N3 | sing | 1.47Å | 1.47Å | |
| C3 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.43Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | N4 | sing | 1.48Å | 1.45Å | |
| C21 | C19 | sing | 1.54Å | 1.53Å | |
| N3 | C4 | sing | 1.39Å | 1.44Å | |
| N3 | C19 | sing | 1.47Å | 1.49Å | |
| C4 | C5 | doub | 1.41Å | 1.45Å | Aromatic |
| N4 | C20 | sing | 1.48Å | 1.45Å | |
| C1 | CL1 | sing | 1.74Å | 1.72Å | |
| C1 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.54Å | 1.53Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C14 | C15 | sing | 1.54Å | 1.59Å | |
| O1 | C13 | doub | 1.21Å | 1.23Å | |
| C5 | C18 | sing | 1.39Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.48Å | 1.49Å | |
| C13 | N2 | sing | 1.34Å | 1.31Å | |
| C15 | C16 | sing | 1.51Å | 1.54Å | |
| S1 | C10 | sing | 1.76Å | 1.71Å | Aromatic |
| S1 | C11 | sing | 1.75Å | 1.73Å | Aromatic |
| C6 | C10 | doub | 1.41Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| N2 | C16 | sing | 1.34Å | 1.31Å | |
| N2 | C12 | sing | 1.46Å | 1.46Å | |
| C10 | C9 | sing | 1.40Å | 1.44Å | Aromatic |
| C16 | O2 | doub | 1.21Å | 1.23Å | |
| C7 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.49Å | |
| C11 | C17 | doub | 1.32Å | 1.37Å | Aromatic |
| C9 | C17 | sing | 1.45Å | 1.47Å | Aromatic |
| C9 | N1 | doub | 1.35Å | 1.33Å | Aromatic |
| C8 | N1 | sing | 1.31Å | 1.35Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| N4 | HN4 | sing | 1.01Å | 1.00Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 106.3° | 107.9° |
| C23 | C24 | C3 | 111.0° | 109.7° |
| C24 | C23 | H232 | 110.3° | 109.8° |
| C24 | C23 | H231 | 110.2° | 109.8° |
| C23 | C24 | H242 | 109.1° | 109.4° |
| C23 | C24 | H241 | 109.1° | 109.4° |
| C23 | C22 | N3 | 113.6° | 108.5° |
| C23 | C22 | H222 | 108.4° | 109.3° |
| C23 | C22 | H221 | 108.4° | 110.1° |
| C22 | C23 | H232 | 110.2° | 109.7° |
| C22 | C23 | H231 | 110.3° | 109.7° |
| C24 | C3 | C2 | 118.6° | 118.1° |
| C24 | C3 | C4 | 120.8° | 122.0° |
| C3 | C24 | H242 | 109.1° | 109.4° |
| C3 | C24 | H241 | 109.1° | 109.5° |
| C22 | N3 | C4 | 115.8° | 113.0° |
| C22 | N3 | C19 | 117.6° | 111.3° |
| N3 | C22 | H222 | 108.4° | 109.7° |
| N3 | C22 | H221 | 108.4° | 109.6° |
| C2 | C3 | C4 | 120.5° | 119.9° |
| C3 | C2 | C1 | 120.5° | 120.8° |
| C3 | C2 | H2 | 119.7° | 119.6° |
| C3 | C4 | N3 | 120.1° | 123.0° |
| C3 | C4 | C5 | 118.7° | 119.4° |
| C2 | C1 | CL1 | 119.6° | 120.0° |
| C2 | C1 | C18 | 120.4° | 120.0° |
| C1 | C2 | H2 | 119.8° | 119.6° |
| N4 | C21 | C19 | 86.3° | 86.2° |
| C21 | N4 | C20 | 92.0° | 90.7° |
| C21 | N4 | HN4 | 113.7° | 111.0° |
| N4 | C21 | H212 | 114.9° | 113.8° |
| N4 | C21 | H211 | 114.9° | 113.7° |
| C21 | C19 | N3 | 117.7° | 113.8° |
| C21 | C19 | C20 | 86.2° | 86.3° |
| C21 | C19 | H19 | 111.4° | 113.8° |
| C19 | C21 | H212 | 114.9° | 113.8° |
| C19 | C21 | H211 | 114.9° | 113.8° |
| C4 | N3 | C19 | 115.3° | 111.0° |
| N3 | C4 | C5 | 121.1° | 117.6° |
| N3 | C19 | C20 | 115.5° | 113.8° |
| N3 | C19 | H19 | 112.1° | 112.9° |
| C4 | C5 | C18 | 118.5° | 120.1° |
| C4 | C5 | C6 | 122.5° | 119.9° |
| N4 | C20 | C19 | 86.6° | 86.2° |
| N4 | C20 | H202 | 114.8° | 113.7° |
| N4 | C20 | H201 | 114.8° | 113.9° |
| C20 | N4 | HN4 | 113.6° | 111.0° |
| CL1 | C1 | C18 | 120.0° | 119.9° |
| C1 | C18 | C5 | 121.3° | 119.8° |
| C1 | C18 | H18 | 119.3° | 120.1° |
| C20 | C19 | H19 | 111.5° | 113.7° |
| C19 | C20 | H202 | 114.8° | 113.8° |
| C19 | C20 | H201 | 114.8° | 113.8° |
| C13 | C14 | C15 | 101.1° | 103.6° |
| C14 | C13 | O1 | 122.4° | 125.4° |
| C14 | C13 | N2 | 112.6° | 109.2° |
| C13 | C14 | H141 | 111.5° | 110.7° |
| C13 | C14 | H142 | 111.5° | 110.6° |
| C14 | C15 | C16 | 101.0° | 103.5° |
| C15 | C14 | H141 | 111.5° | 110.6° |
| C15 | C14 | H142 | 111.5° | 110.6° |
| C14 | C15 | H151 | 111.5° | 110.6° |
| C14 | C15 | H152 | 111.6° | 110.6° |
| O1 | C13 | N2 | 125.0° | 125.4° |
| C18 | C5 | C6 | 119.0° | 120.0° |
| C5 | C18 | H18 | 119.4° | 120.1° |
| C5 | C6 | C10 | 121.7° | 120.8° |
| C5 | C6 | C7 | 121.1° | 120.8° |
| C13 | N2 | C16 | 113.0° | 114.4° |
| C13 | N2 | C12 | 123.1° | 122.8° |
| C15 | C16 | N2 | 112.4° | 109.2° |
| C15 | C16 | O2 | 122.3° | 125.4° |
| C16 | C15 | H151 | 111.5° | 110.6° |
| C16 | C15 | H152 | 111.6° | 110.6° |
| C10 | S1 | C11 | 93.6° | 92.1° |
| S1 | C10 | C6 | 129.1° | 130.8° |
| S1 | C10 | C9 | 110.4° | 109.9° |
| S1 | C11 | C12 | 120.9° | 124.3° |
| S1 | C11 | C17 | 112.8° | 111.4° |
| C10 | C6 | C7 | 117.2° | 118.4° |
| C6 | C10 | C9 | 120.5° | 119.3° |
| C6 | C7 | C8 | 119.0° | 119.0° |
| C6 | C7 | H7 | 120.5° | 120.5° |
| C16 | N2 | C12 | 123.9° | 122.8° |
| N2 | C16 | O2 | 125.3° | 125.4° |
| N2 | C12 | C11 | 112.9° | 109.5° |
| N2 | C12 | H122 | 108.6° | 109.5° |
| N2 | C12 | H121 | 108.6° | 109.4° |
| C10 | C9 | C17 | 111.8° | 111.7° |
| C10 | C9 | N1 | 120.1° | 119.3° |
| C7 | C8 | N1 | 123.8° | 121.5° |
| C7 | C8 | H8 | 118.1° | 119.2° |
| C8 | C7 | H7 | 120.5° | 120.5° |
| C12 | C11 | C17 | 126.3° | 124.4° |
| C11 | C12 | H122 | 108.6° | 109.5° |
| C11 | C12 | H121 | 108.6° | 109.5° |
| C11 | C17 | C9 | 111.4° | 114.9° |
| C11 | C17 | H17 | 124.3° | 122.5° |
| C17 | C9 | N1 | 128.0° | 129.0° |
| C9 | C17 | H17 | 124.3° | 122.6° |
| C9 | N1 | C8 | 119.3° | 122.4° |
| N1 | C8 | H8 | 118.1° | 119.2° |
| H122 | C12 | H121 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 110.7° |
| H151 | C15 | H152 | 109.5° | 110.7° |
| H202 | C20 | H201 | 109.5° | 112.9° |
| H212 | C21 | H211 | 109.5° | 113.0° |
| H222 | C22 | H221 | 109.5° | 109.6° |
| H232 | C23 | H231 | 109.5° | 109.8° |
| H242 | C24 | H241 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | H232 | 119.5° | 119.6° |
| C24 | C23 | C22 | H231 | 119.5° | 119.6° |
| C23 | C24 | C3 | H242 | 120.2° | 120.1° |
| C23 | C24 | C3 | H241 | 120.2° | 120.1° |
| C24 | C23 | C22 | N3 | 63.9° | 68.3° |
| C23 | C24 | C3 | C2 | 150.9° | 164.6° |
| C23 | C24 | C3 | C4 | 27.5° | 15.8° |
| C24 | C23 | C22 | H222 | 175.5° | 172.2° |
| C24 | C23 | C22 | H221 | 56.7° | 51.7° |
| C24 | C23 | H232 | H231 | 121.5° | 120.9° |
| C23 | C24 | H242 | H241 | 119.3° | 119.9° |
| C22 | C23 | C24 | C3 | 55.6° | 47.3° |
| C23 | C22 | N3 | H222 | 120.6° | 119.3° |
| C23 | C22 | N3 | H221 | 120.6° | 120.3° |
| C23 | C22 | N3 | C4 | 39.5° | 53.8° |
| C23 | C22 | N3 | C19 | 102.5° | 179.5° |
| C23 | C22 | H222 | H221 | 118.1° | 120.8° |
| C22 | C23 | H232 | H231 | 121.5° | 120.7° |
| C22 | C23 | C24 | H242 | 64.6° | 72.8° |
| C22 | C23 | C24 | H241 | 175.8° | 167.4° |
| C24 | C3 | C2 | C4 | 178.4° | 179.6° |
| C24 | C3 | C2 | C1 | 177.6° | 179.3° |
| C24 | C3 | C4 | N3 | 1.8° | 1.2° |
| C24 | C3 | C4 | C5 | 179.7° | 179.8° |
| C24 | C3 | C2 | H2 | 2.4° | 0.4° |
| C3 | C24 | C23 | H232 | 63.9° | 72.3° |
| C3 | C24 | C23 | H231 | 175.1° | 166.9° |
| C3 | C24 | H242 | H241 | 119.3° | 119.9° |
| C22 | N3 | C4 | C3 | 7.3° | 20.8° |
| C22 | N3 | C19 | C21 | 29.4° | 68.8° |
| C22 | N3 | C4 | C19 | 142.8° | 125.8° |
| C22 | N3 | C4 | C5 | 174.2° | 160.1° |
| C22 | N3 | C19 | C20 | 70.1° | 28.0° |
| C22 | N3 | C19 | H19 | 160.6° | 159.5° |
| N3 | C22 | H222 | H221 | 118.1° | 120.4° |
| N3 | C22 | C23 | H232 | 55.6° | 51.3° |
| N3 | C22 | C23 | H231 | 176.6° | 172.1° |
| C3 | C2 | C1 | H2 | 180.0° | 179.7° |
| C2 | C3 | C4 | N3 | 176.6° | 179.2° |
| C2 | C3 | C4 | C5 | 2.0° | 0.2° |
| C3 | C2 | C1 | CL1 | 178.9° | 179.7° |
| C3 | C2 | C1 | C18 | 1.7° | 0.3° |
| C2 | C3 | C24 | H242 | 88.9° | 75.3° |
| C2 | C3 | C24 | H241 | 30.7° | 44.6° |
| C4 | C3 | C2 | C1 | 0.8° | 0.3° |
| C3 | C4 | N3 | C5 | 178.5° | 179.0° |
| C3 | C4 | N3 | C19 | 135.5° | 146.7° |
| C3 | C4 | C5 | C18 | 3.9° | 0.6° |
| C3 | C4 | C5 | C6 | 174.3° | 179.4° |
| C4 | C3 | C2 | H2 | 179.2° | 180.0° |
| C4 | C3 | C24 | H242 | 92.7° | 104.3° |
| C4 | C3 | C24 | H241 | 147.7° | 135.8° |
| C2 | C1 | CL1 | C18 | 179.4° | 180.0° |
| C2 | C1 | C18 | C5 | 0.3° | 0.2° |
| C2 | C1 | C18 | H18 | 179.6° | 179.6° |
| N4 | C21 | C19 | H212 | 115.8° | 114.4° |
| N4 | C21 | C19 | H211 | 115.8° | 114.3° |
| N4 | C21 | C19 | N3 | 138.6° | 138.1° |
| C21 | N4 | C20 | HN4 | 117.0° | 112.8° |
| N4 | C21 | C19 | C20 | 21.7° | 23.7° |
| N4 | C21 | C19 | H19 | 89.9° | 90.6° |
| C21 | N4 | C20 | H202 | 138.8° | 89.7° |
| C21 | N4 | C20 | H201 | 92.9° | 139.0° |
| N4 | C21 | H212 | H211 | 131.0° | 131.7° |
| C21 | C19 | N3 | C4 | 112.7° | 58.0° |
| C21 | C19 | N3 | C20 | 99.6° | 96.7° |
| C21 | C19 | N3 | H19 | 131.2° | 131.7° |
| C21 | C19 | C20 | H19 | 111.5° | 114.4° |
| C21 | C19 | C20 | H202 | 137.6° | 90.6° |
| C21 | C19 | C20 | H201 | 94.1° | 138.1° |
| C19 | C21 | N4 | HN4 | 94.1° | 88.2° |
| C19 | C21 | H212 | H211 | 131.1° | 131.7° |
| C4 | N3 | C19 | C20 | 147.7° | 154.7° |
| N3 | C4 | C5 | C18 | 174.7° | 179.7° |
| N3 | C4 | C5 | C6 | 7.1° | 0.4° |
| C4 | N3 | C19 | H19 | 18.5° | 73.7° |
| C4 | N3 | C22 | H222 | 160.0° | 173.1° |
| C4 | N3 | C22 | H221 | 81.1° | 66.5° |
| C19 | N3 | C4 | C5 | 43.0° | 34.3° |
| N3 | C19 | C20 | N4 | 140.7° | 138.1° |
| N3 | C19 | C20 | H19 | 129.6° | 131.2° |
| N3 | C19 | C20 | H202 | 103.5° | 23.8° |
| N3 | C19 | C20 | H201 | 24.8° | 107.4° |
| N3 | C19 | C21 | H212 | 22.8° | 107.6° |
| N3 | C19 | C21 | H211 | 105.6° | 23.8° |
| C19 | N3 | C22 | H222 | 18.1° | 61.2° |
| C19 | N3 | C22 | H221 | 136.9° | 59.2° |
| C4 | C5 | C18 | C1 | 3.1° | 0.6° |
| C4 | C5 | C18 | C6 | 178.3° | 180.0° |
| C4 | C5 | C6 | C10 | 129.1° | 69.5° |
| C4 | C5 | C6 | C7 | 50.8° | 110.6° |
| C4 | C5 | C18 | H18 | 176.9° | 180.0° |
| N4 | C20 | C19 | H202 | 115.9° | 114.3° |
| N4 | C20 | C19 | H201 | 115.9° | 114.5° |
| N4 | C20 | C19 | H19 | 89.8° | 90.8° |
| N4 | C20 | H202 | H201 | 130.9° | 131.7° |
| C20 | N4 | C21 | H212 | 93.0° | 139.0° |
| C20 | N4 | C21 | H211 | 138.7° | 89.7° |
| CL1 | C1 | C18 | C5 | 179.1° | 179.9° |
| CL1 | C1 | C2 | H2 | 1.1° | 0.0° |
| CL1 | C1 | C18 | H18 | 1.0° | 0.4° |
| C1 | C18 | C5 | H18 | 180.0° | 179.4° |
| C1 | C18 | C5 | C6 | 175.2° | 179.4° |
| C18 | C1 | C2 | H2 | 178.3° | 180.0° |
| C19 | C20 | H202 | H201 | 130.9° | 131.7° |
| C19 | C20 | N4 | HN4 | 94.0° | 88.2° |
| C20 | C19 | C21 | H212 | 94.1° | 138.0° |
| C20 | C19 | C21 | H211 | 137.5° | 90.6° |
| C13 | C14 | C15 | H141 | 118.6° | 118.6° |
| C13 | C14 | C15 | H142 | 118.6° | 118.5° |
| C14 | C13 | O1 | N2 | 179.0° | 179.9° |
| C13 | C14 | C15 | C16 | 0.5° | 0.0° |
| C14 | C13 | N2 | C16 | 0.4° | 0.1° |
| C14 | C13 | N2 | C12 | 179.3° | 179.7° |
| C13 | C14 | H141 | H142 | 124.0° | 123.0° |
| C13 | C14 | C15 | H151 | 119.1° | 118.5° |
| C13 | C14 | C15 | H152 | 118.2° | 118.5° |
| C15 | C14 | C13 | O1 | 179.2° | 180.0° |
| C15 | C14 | C13 | N2 | 0.1° | 0.0° |
| C14 | C15 | C16 | H151 | 118.6° | 118.5° |
| C14 | C15 | C16 | H152 | 118.6° | 118.5° |
| C14 | C15 | C16 | N2 | 0.8° | 0.0° |
| C14 | C15 | C16 | O2 | 178.4° | 179.7° |
| C15 | C14 | H141 | H142 | 123.9° | 122.9° |
| C14 | C15 | H151 | H152 | 124.0° | 123.0° |
| O1 | C13 | N2 | C16 | 178.6° | 180.0° |
| O1 | C13 | N2 | C12 | 0.2° | 0.3° |
| O1 | C13 | C14 | H141 | 60.6° | 61.5° |
| O1 | C13 | C14 | H142 | 62.2° | 61.5° |
| C18 | C5 | C6 | C10 | 52.7° | 110.5° |
| C18 | C5 | C6 | C7 | 127.4° | 69.4° |
| C5 | C6 | C10 | S1 | 1.7° | 0.1° |
| C5 | C6 | C10 | C7 | 179.9° | 179.9° |
| C5 | C6 | C10 | C9 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 179.5° | 180.0° |
| C5 | C6 | C7 | H7 | 0.5° | 0.1° |
| C6 | C5 | C18 | H18 | 4.9° | 0.0° |
| C13 | N2 | C16 | C15 | 0.8° | 0.1° |
| C13 | N2 | C16 | C12 | 178.8° | 179.7° |
| C13 | N2 | C16 | O2 | 178.4° | 179.7° |
| C13 | N2 | C12 | C11 | 88.1° | 89.6° |
| C13 | N2 | C12 | H122 | 32.4° | 150.3° |
| C13 | N2 | C12 | H121 | 151.4° | 30.3° |
| N2 | C13 | C14 | H141 | 118.5° | 118.5° |
| N2 | C13 | C14 | H142 | 118.7° | 118.5° |
| C15 | C16 | N2 | O2 | 179.2° | 179.7° |
| C15 | C16 | N2 | C12 | 179.6° | 179.7° |
| C16 | C15 | C14 | H141 | 118.1° | 118.6° |
| C16 | C15 | C14 | H142 | 119.1° | 118.5° |
| C16 | C15 | H151 | H152 | 124.0° | 122.9° |
| S1 | C10 | C6 | C9 | 178.4° | 179.9° |
| S1 | C10 | C6 | C7 | 178.2° | 180.0° |
| C10 | S1 | C11 | C12 | 179.1° | 180.0° |
| C10 | S1 | C11 | C17 | 0.7° | 0.0° |
| S1 | C10 | C9 | C17 | 0.5° | 0.0° |
| S1 | C10 | C9 | N1 | 179.8° | 180.0° |
| C11 | S1 | C10 | C6 | 178.4° | 180.0° |
| S1 | C11 | C12 | N2 | 85.8° | 90.0° |
| C11 | S1 | C10 | C9 | 0.1° | 0.0° |
| S1 | C11 | C12 | C17 | 179.8° | 180.0° |
| S1 | C11 | C17 | C9 | 1.1° | 0.0° |
| S1 | C11 | C12 | H122 | 34.8° | 30.0° |
| S1 | C11 | C12 | H121 | 153.8° | 150.0° |
| S1 | C11 | C17 | H17 | 178.8° | 179.9° |
| C10 | C6 | C7 | C8 | 0.6° | 0.1° |
| C6 | C10 | C9 | C17 | 179.1° | 180.0° |
| C6 | C10 | C9 | N1 | 1.2° | 0.1° |
| C10 | C6 | C7 | H7 | 179.4° | 179.9° |
| C7 | C6 | C10 | C9 | 0.1° | 0.1° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | N1 | 0.3° | 0.0° |
| C6 | C7 | C8 | H8 | 179.7° | 180.0° |
| C16 | N2 | C12 | C11 | 93.2° | 90.0° |
| C16 | N2 | C12 | H122 | 146.3° | 30.1° |
| C16 | N2 | C12 | H121 | 27.4° | 150.0° |
| N2 | C16 | C15 | H151 | 119.4° | 118.5° |
| N2 | C16 | C15 | H152 | 117.8° | 118.6° |
| C12 | N2 | C16 | O2 | 0.4° | 0.0° |
| N2 | C12 | C11 | H122 | 120.5° | 120.1° |
| N2 | C12 | C11 | H121 | 120.5° | 120.0° |
| N2 | C12 | C11 | C17 | 94.1° | 89.9° |
| N2 | C12 | H122 | H121 | 118.4° | 120.0° |
| C10 | C9 | C17 | C11 | 1.1° | 0.0° |
| C10 | C9 | C17 | N1 | 179.6° | 180.0° |
| C10 | C9 | N1 | C8 | 2.0° | 0.0° |
| C10 | C9 | C17 | H17 | 178.9° | 179.9° |
| O2 | C16 | C15 | H151 | 59.8° | 61.8° |
| O2 | C16 | C15 | H152 | 63.0° | 61.2° |
| C7 | C8 | N1 | C9 | 1.6° | 0.0° |
| C7 | C8 | N1 | H8 | 180.0° | 180.0° |
| C12 | C11 | C17 | C9 | 178.7° | 180.0° |
| C11 | C12 | H122 | H121 | 118.4° | 120.0° |
| C12 | C11 | C17 | H17 | 1.3° | 0.1° |
| C11 | C17 | C9 | H17 | 180.0° | 179.9° |
| C11 | C17 | C9 | N1 | 179.3° | 180.0° |
| C17 | C11 | C12 | H122 | 145.4° | 150.0° |
| C17 | C11 | C12 | H121 | 26.4° | 30.0° |
| C17 | C9 | N1 | C8 | 178.4° | 180.0° |
| C9 | N1 | C8 | H8 | 178.4° | 180.0° |
| N1 | C9 | C17 | H17 | 0.7° | 0.1° |
| N1 | C8 | C7 | H7 | 179.8° | 180.0° |
| H8 | C8 | C7 | H7 | 0.2° | 0.0° |
| H141 | C14 | C15 | H151 | 0.4° | 0.0° |
| H141 | C14 | C15 | H152 | 123.2° | 123.0° |
| H142 | C14 | C15 | H151 | 122.3° | 123.0° |
| H142 | C14 | C15 | H152 | 0.5° | 0.0° |
| H19 | C19 | C20 | H202 | 26.1° | 154.9° |
| H19 | C19 | C20 | H201 | 154.4° | 23.7° |
| H19 | C19 | C21 | H212 | 154.3° | 23.7° |
| H19 | C19 | C21 | H211 | 25.9° | 155.1° |
| H202 | C20 | N4 | HN4 | 21.8° | 157.4° |
| H201 | C20 | N4 | HN4 | 150.1° | 26.2° |
| HN4 | N4 | C21 | H212 | 150.1° | 26.2° |
| HN4 | N4 | C21 | H211 | 21.7° | 157.5° |
| H222 | C22 | C23 | H232 | 65.0° | 68.2° |
| H222 | C22 | C23 | H231 | 56.0° | 52.5° |
| H221 | C22 | C23 | H232 | 176.2° | 171.3° |
| H221 | C22 | C23 | H231 | 62.8° | 68.0° |
| H232 | C23 | C24 | H242 | 175.9° | 167.6° |
| H232 | C23 | C24 | H241 | 56.4° | 47.8° |
| H231 | C23 | C24 | H242 | 54.9° | 46.8° |
| H231 | C23 | C24 | H241 | 64.7° | 73.0° |
