Q1L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C6 | sing | 1.35Å | 1.27Å | |
| F | C5 | sing | 1.35Å | 1.33Å | |
| C6 | C5 | doub | 1.39Å | 1.34Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| F2 | C7 | sing | 1.35Å | 1.35Å | |
| C5 | C4 | sing | 1.38Å | 1.43Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.35Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.48Å | 1.48Å | |
| C2 | N2 | sing | 1.35Å | 1.35Å | Aromatic |
| C2 | C9 | doub | 1.36Å | 1.36Å | Aromatic |
| N2 | N1 | doub | 1.29Å | 1.26Å | Aromatic |
| C9 | N | sing | 1.35Å | 1.33Å | Aromatic |
| O | C | sing | 1.43Å | 1.41Å | |
| N1 | N | sing | 1.29Å | 1.32Å | Aromatic |
| N | C1 | sing | 1.46Å | 1.47Å | |
| C | C1 | sing | 1.53Å | 1.56Å | |
| C | C22 | sing | 1.53Å | 1.49Å | |
| C1 | C10 | sing | 1.53Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.58Å | |
| C23 | O3 | sing | 1.43Å | 1.43Å | |
| C22 | O2 | sing | 1.43Å | 1.43Å | |
| C10 | O1 | sing | 1.43Å | 1.44Å | |
| C10 | C11 | sing | 1.53Å | 1.56Å | |
| O2 | C11 | sing | 1.43Å | 1.44Å | |
| C11 | C12 | sing | 1.51Å | 1.48Å | |
| N3 | C12 | doub | 1.31Å | 1.35Å | Aromatic |
| N3 | C13 | sing | 1.33Å | 1.44Å | Aromatic |
| C12 | N5 | sing | 1.35Å | 1.33Å | Aromatic |
| C13 | N4 | doub | 1.31Å | 1.35Å | Aromatic |
| N5 | N4 | sing | 1.40Å | 1.30Å | Aromatic |
| N5 | C14 | sing | 1.40Å | 1.37Å | |
| C21 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C18 | sing | 1.39Å | 1.36Å | Aromatic |
| C14 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| S | C18 | sing | 1.76Å | 1.74Å | Aromatic |
| S | C19 | sing | 1.71Å | 1.78Å | Aromatic |
| C18 | C17 | doub | 1.40Å | 1.42Å | Aromatic |
| C15 | C16 | doub | 1.36Å | 1.37Å | Aromatic |
| C17 | C16 | sing | 1.41Å | 1.42Å | Aromatic |
| C17 | N6 | sing | 1.35Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.46Å | |
| C19 | N6 | doub | 1.28Å | 1.33Å | Aromatic |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.08Å | 1.08Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| O1 | H9 | sing | 0.97Å | 0.95Å | |
| O3 | H19 | sing | 0.97Å | 0.95Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| O | H5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C6 | C5 | 118.3° | 120.0° |
| F1 | C6 | C7 | 120.7° | 119.9° |
| F | C5 | C6 | 116.1° | 120.0° |
| F | C5 | C4 | 124.0° | 119.9° |
| C5 | C6 | C7 | 120.8° | 120.2° |
| C6 | C5 | C4 | 119.8° | 120.1° |
| C6 | C7 | F2 | 118.7° | 120.0° |
| C6 | C7 | C8 | 120.7° | 120.1° |
| F2 | C7 | C8 | 119.5° | 120.0° |
| C5 | C4 | C3 | 118.4° | 119.9° |
| C5 | C4 | H6 | 120.8° | 120.1° |
| C7 | C8 | C3 | 119.2° | 119.9° |
| C7 | C8 | H7 | 120.4° | 120.1° |
| C4 | C3 | C8 | 120.8° | 119.8° |
| C4 | C3 | C2 | 121.2° | 120.1° |
| C3 | C4 | H6 | 120.8° | 120.0° |
| C8 | C3 | C2 | 118.0° | 120.0° |
| C3 | C8 | H7 | 120.4° | 120.0° |
| C3 | C2 | N2 | 124.4° | 126.9° |
| C3 | C2 | C9 | 128.6° | 126.9° |
| N2 | C2 | C9 | 106.9° | 106.2° |
| C2 | N2 | N1 | 109.1° | 108.7° |
| C2 | C9 | N | 105.7° | 106.0° |
| C2 | C9 | H8 | 127.1° | 127.0° |
| N2 | N1 | N | 109.5° | 110.5° |
| C9 | N | N1 | 108.7° | 108.5° |
| C9 | N | C1 | 129.5° | 125.8° |
| N | C9 | H8 | 127.2° | 127.0° |
| O | C | C1 | 111.0° | 109.5° |
| O | C | C22 | 109.5° | 109.5° |
| O | C | H | 111.1° | 109.6° |
| C | O | H5 | 109.5° | 114.0° |
| N1 | N | C1 | 121.3° | 125.8° |
| N | C1 | C | 110.6° | 109.5° |
| N | C1 | C10 | 108.2° | 109.6° |
| N | C1 | H1 | 109.9° | 109.5° |
| C1 | C | C22 | 106.3° | 109.2° |
| C | C1 | C10 | 110.2° | 109.0° |
| C | C1 | H1 | 108.7° | 109.6° |
| C1 | C | H | 109.0° | 109.5° |
| C | C22 | C23 | 106.9° | 109.5° |
| C | C22 | O2 | 111.2° | 109.4° |
| C | C22 | H4 | 109.7° | 109.5° |
| C22 | C | H | 109.9° | 109.5° |
| C1 | C10 | O1 | 107.8° | 109.5° |
| C1 | C10 | C11 | 107.2° | 109.2° |
| C10 | C1 | H1 | 109.2° | 109.6° |
| C1 | C10 | H2 | 109.5° | 109.5° |
| C22 | C23 | O3 | 105.4° | 109.5° |
| C23 | C22 | O2 | 109.8° | 109.5° |
| C23 | C22 | H4 | 108.6° | 109.5° |
| C22 | C23 | H17 | 110.5° | 109.4° |
| C22 | C23 | H18 | 110.5° | 109.5° |
| O3 | C23 | H17 | 110.5° | 109.5° |
| O3 | C23 | H18 | 110.5° | 109.5° |
| C23 | O3 | H19 | 109.5° | 114.0° |
| C22 | O2 | C11 | 109.4° | 114.1° |
| O2 | C22 | H4 | 110.5° | 109.5° |
| O1 | C10 | C11 | 112.7° | 109.5° |
| O1 | C10 | H2 | 110.6° | 109.5° |
| C10 | O1 | H9 | 109.5° | 114.0° |
| C10 | C11 | O2 | 108.2° | 109.4° |
| C10 | C11 | C12 | 111.7° | 109.5° |
| C10 | C11 | H3 | 108.8° | 109.5° |
| C11 | C10 | H2 | 108.9° | 109.6° |
| O2 | C11 | C12 | 107.7° | 109.5° |
| O2 | C11 | H3 | 110.6° | 109.5° |
| C11 | C12 | N3 | 124.7° | 126.0° |
| C11 | C12 | N5 | 125.0° | 126.0° |
| C12 | C11 | H3 | 109.9° | 109.5° |
| C12 | N3 | C13 | 100.3° | 109.9° |
| N3 | C12 | N5 | 110.4° | 108.0° |
| N3 | C13 | N4 | 112.3° | 109.0° |
| N3 | C13 | H10 | 123.8° | 125.5° |
| C12 | N5 | N4 | 113.2° | 106.3° |
| C12 | N5 | C14 | 127.7° | 126.8° |
| C13 | N4 | N5 | 103.7° | 106.8° |
| N4 | C13 | H10 | 123.8° | 125.5° |
| N4 | N5 | C14 | 119.0° | 126.9° |
| N5 | C14 | C21 | 120.1° | 120.0° |
| N5 | C14 | C15 | 118.2° | 120.1° |
| C14 | C21 | C18 | 119.1° | 119.9° |
| C21 | C14 | C15 | 121.7° | 119.9° |
| C14 | C21 | H16 | 120.5° | 120.1° |
| C21 | C18 | S | 127.9° | 131.7° |
| C21 | C18 | C17 | 120.9° | 120.3° |
| C18 | C21 | H16 | 120.4° | 120.1° |
| C14 | C15 | C16 | 119.7° | 120.7° |
| C14 | C15 | H11 | 120.2° | 119.6° |
| C18 | S | C19 | 88.0° | 90.9° |
| S | C18 | C17 | 111.2° | 108.0° |
| S | C19 | C20 | 117.0° | 124.2° |
| S | C19 | N6 | 116.2° | 111.5° |
| C18 | C17 | C16 | 118.6° | 118.6° |
| C18 | C17 | N6 | 114.9° | 111.8° |
| C15 | C16 | C17 | 120.0° | 120.5° |
| C15 | C16 | H12 | 120.0° | 119.8° |
| C16 | C15 | H11 | 120.1° | 119.6° |
| C16 | C17 | N6 | 126.5° | 129.6° |
| C17 | C16 | H12 | 120.0° | 119.7° |
| C17 | N6 | C19 | 109.7° | 117.9° |
| C20 | C19 | N6 | 126.6° | 124.3° |
| C19 | C20 | H14 | 109.5° | 109.6° |
| C19 | C20 | H13 | 109.4° | 109.5° |
| C19 | C20 | H15 | 109.5° | 109.5° |
| H14 | C20 | H13 | 109.5° | 109.4° |
| H14 | C20 | H15 | 109.4° | 109.4° |
| H13 | C20 | H15 | 109.5° | 109.4° |
| H17 | C23 | H18 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C6 | C5 | F | 1.3° | 0.1° |
| F1 | C6 | C5 | C7 | 176.5° | 180.0° |
| F1 | C6 | C7 | F2 | 12.8° | 0.0° |
| F1 | C6 | C5 | C4 | 178.8° | 180.0° |
| F1 | C6 | C7 | C8 | 179.2° | 179.8° |
| F | C5 | C6 | C4 | 177.6° | 179.9° |
| F | C5 | C6 | C7 | 175.2° | 179.9° |
| F | C5 | C4 | C3 | 177.1° | 180.0° |
| F | C5 | C4 | H6 | 2.9° | 0.1° |
| C5 | C6 | C7 | F2 | 163.6° | 180.0° |
| C5 | C6 | C7 | C8 | 4.4° | 0.2° |
| C6 | C5 | C4 | C3 | 0.2° | 0.0° |
| C6 | C5 | C4 | H6 | 179.8° | 180.0° |
| C6 | C7 | F2 | C8 | 168.1° | 179.8° |
| C7 | C6 | C5 | C4 | 2.3° | 0.0° |
| C6 | C7 | C8 | C3 | 4.2° | 0.5° |
| C6 | C7 | C8 | H7 | 175.8° | 179.7° |
| F2 | C7 | C8 | C3 | 163.7° | 179.7° |
| F2 | C7 | C8 | H7 | 16.3° | 0.1° |
| C5 | C4 | C3 | H6 | 180.0° | 179.9° |
| C5 | C4 | C3 | C8 | 0.1° | 0.3° |
| C5 | C4 | C3 | C2 | 179.2° | 180.0° |
| C7 | C8 | C3 | C4 | 2.1° | 0.6° |
| C7 | C8 | C3 | H7 | 180.0° | 179.8° |
| C7 | C8 | C3 | C2 | 178.8° | 179.7° |
| C4 | C3 | C8 | C2 | 179.2° | 179.7° |
| C4 | C3 | C2 | N2 | 148.5° | 0.0° |
| C4 | C3 | C2 | C9 | 28.7° | 179.7° |
| C4 | C3 | C8 | H7 | 177.9° | 179.7° |
| C8 | C3 | C2 | N2 | 32.3° | 179.7° |
| C8 | C3 | C2 | C9 | 150.5° | 0.0° |
| C8 | C3 | C4 | H6 | 179.9° | 179.8° |
| C3 | C2 | N2 | C9 | 177.7° | 179.8° |
| C3 | C2 | N2 | N1 | 178.8° | 180.0° |
| C3 | C2 | C9 | N | 177.6° | 179.9° |
| C2 | C3 | C4 | H6 | 0.8° | 0.1° |
| C2 | C3 | C8 | H7 | 1.2° | 0.0° |
| C3 | C2 | C9 | H8 | 2.4° | 0.0° |
| N2 | C2 | C9 | N | 0.0° | 0.3° |
| C2 | N2 | N1 | N | 1.8° | 0.0° |
| N2 | C2 | C9 | H8 | 180.0° | 179.7° |
| C9 | C2 | N2 | N1 | 1.1° | 0.2° |
| C2 | C9 | N | H8 | 180.0° | 179.9° |
| C2 | C9 | N | N1 | 1.0° | 0.3° |
| C2 | C9 | N | C1 | 171.0° | 179.8° |
| N2 | N1 | N | C9 | 1.8° | 0.2° |
| N2 | N1 | N | C1 | 171.1° | 180.0° |
| C9 | N | N1 | C1 | 172.8° | 179.8° |
| C9 | N | C1 | C | 71.4° | 34.3° |
| C9 | N | C1 | C10 | 49.4° | 85.2° |
| C9 | N | C1 | H1 | 168.6° | 154.5° |
| O | C | C1 | N | 58.1° | 57.0° |
| O | C | C1 | C22 | 119.0° | 119.9° |
| O | C | C1 | H | 122.6° | 120.2° |
| O | C | C22 | H | 122.2° | 120.2° |
| O | C | C1 | C10 | 61.5° | 62.9° |
| O | C | C22 | C23 | 61.0° | 57.7° |
| O | C | C22 | O2 | 58.9° | 62.3° |
| O | C | C22 | H4 | 178.5° | 177.7° |
| O | C | C1 | H1 | 178.8° | 177.2° |
| N1 | N | C1 | C | 99.8° | 145.5° |
| N1 | N | C1 | C10 | 139.4° | 94.9° |
| N1 | N | C9 | H8 | 179.0° | 179.7° |
| N1 | N | C1 | H1 | 20.2° | 25.3° |
| N | C1 | C | C10 | 119.6° | 119.9° |
| N | C1 | C | H1 | 120.7° | 120.2° |
| N | C1 | C | C22 | 177.0° | 176.9° |
| N | C1 | C10 | H1 | 119.6° | 120.2° |
| N | C1 | C10 | O1 | 59.8° | 63.3° |
| N | C1 | C10 | C11 | 178.6° | 176.8° |
| C1 | N | C9 | H8 | 9.0° | 0.1° |
| N | C1 | C10 | H2 | 60.6° | 56.9° |
| N | C1 | C | H | 64.6° | 63.2° |
| C1 | C | C22 | H | 117.8° | 119.9° |
| C | C1 | C10 | H1 | 119.4° | 119.9° |
| C1 | C | C22 | C23 | 179.1° | 177.6° |
| C1 | C | C22 | O2 | 61.1° | 57.6° |
| C | C1 | C10 | O1 | 179.1° | 176.9° |
| C | C1 | C10 | C11 | 57.5° | 57.0° |
| C1 | C | C22 | H4 | 61.5° | 62.4° |
| C | C1 | C10 | H2 | 60.5° | 63.0° |
| C1 | C | O | H5 | 180.0° | 180.0° |
| C22 | C | C1 | C10 | 57.4° | 57.0° |
| C | C22 | C23 | O2 | 120.8° | 120.0° |
| C | C22 | C23 | H4 | 118.3° | 120.0° |
| C | C22 | C23 | O3 | 171.6° | 175.1° |
| C | C22 | O2 | H4 | 122.1° | 120.0° |
| C | C22 | O2 | C11 | 67.7° | 61.1° |
| C | C22 | C23 | H17 | 52.2° | 55.1° |
| C | C22 | C23 | H18 | 69.1° | 65.0° |
| C22 | C | C1 | H1 | 62.3° | 62.9° |
| C22 | C | O | H5 | 63.0° | 60.3° |
| C1 | C10 | O1 | C11 | 118.1° | 119.7° |
| C1 | C10 | O1 | H2 | 119.7° | 120.1° |
| C1 | C10 | C11 | H2 | 118.4° | 119.9° |
| C1 | C10 | C11 | O2 | 60.8° | 57.6° |
| C1 | C10 | C11 | C12 | 179.1° | 177.6° |
| C1 | C10 | C11 | H3 | 59.4° | 62.4° |
| C1 | C10 | O1 | H9 | 180.0° | 180.0° |
| C10 | C1 | C | H | 175.8° | 176.9° |
| C22 | C23 | O3 | H17 | 119.3° | 120.0° |
| C22 | C23 | O3 | H18 | 119.4° | 120.0° |
| C23 | C22 | O2 | H4 | 119.8° | 120.0° |
| C23 | C22 | O2 | C11 | 174.2° | 178.9° |
| C22 | C23 | H17 | H18 | 121.9° | 120.0° |
| C22 | C23 | O3 | H19 | 180.0° | 180.0° |
| C23 | C22 | C | H | 61.2° | 62.5° |
| O3 | C23 | C22 | O2 | 67.7° | 65.0° |
| O3 | C23 | C22 | H4 | 53.3° | 55.0° |
| O3 | C23 | H17 | H18 | 121.9° | 120.0° |
| C22 | O2 | C11 | C10 | 65.3° | 61.1° |
| C22 | O2 | C11 | C12 | 173.9° | 178.9° |
| O2 | C22 | C23 | H17 | 173.0° | 175.0° |
| O2 | C22 | C23 | H18 | 51.7° | 55.0° |
| C22 | O2 | C11 | H3 | 53.8° | 58.9° |
| O2 | C22 | C | H | 178.9° | 177.5° |
| O1 | C10 | C11 | H2 | 123.1° | 120.2° |
| O1 | C10 | C11 | O2 | 179.3° | 177.5° |
| O1 | C10 | C11 | C12 | 62.4° | 62.5° |
| O1 | C10 | C11 | H3 | 59.1° | 57.5° |
| O1 | C10 | C1 | H1 | 59.8° | 57.0° |
| C10 | C11 | O2 | C12 | 120.8° | 120.0° |
| C10 | C11 | O2 | H3 | 119.1° | 120.0° |
| C10 | C11 | C12 | H3 | 120.9° | 120.0° |
| C10 | C11 | C12 | N3 | 26.9° | 64.9° |
| C10 | C11 | C12 | N5 | 153.3° | 115.6° |
| C11 | C10 | C1 | H1 | 61.8° | 62.9° |
| C11 | C10 | O1 | H9 | 61.9° | 60.4° |
| O2 | C11 | C12 | H3 | 120.5° | 120.0° |
| O2 | C11 | C12 | N3 | 91.7° | 55.0° |
| O2 | C11 | C12 | N5 | 88.1° | 124.4° |
| C11 | O2 | C22 | H4 | 54.4° | 58.8° |
| O2 | C11 | C10 | H2 | 57.6° | 62.3° |
| C11 | C12 | N3 | N5 | 179.9° | 179.5° |
| C11 | C12 | N3 | C13 | 179.6° | 179.9° |
| C11 | C12 | N5 | N4 | 179.5° | 180.0° |
| C11 | C12 | N5 | C14 | 0.5° | 0.0° |
| C12 | C11 | C10 | H2 | 60.7° | 57.7° |
| C12 | N3 | C13 | N4 | 0.1° | 0.1° |
| N3 | C12 | N5 | N4 | 0.3° | 0.4° |
| N3 | C12 | N5 | C14 | 179.4° | 179.6° |
| C12 | N3 | C13 | H10 | 180.0° | 179.7° |
| N3 | C12 | C11 | H3 | 147.8° | 175.1° |
| C13 | N3 | C12 | N5 | 0.2° | 0.3° |
| N3 | C13 | N4 | H10 | 180.0° | 179.8° |
| N3 | C13 | N4 | N5 | 0.1° | 0.2° |
| C12 | N5 | N4 | C13 | 0.3° | 0.4° |
| C12 | N5 | N4 | C14 | 179.2° | 180.0° |
| C12 | N5 | C14 | C21 | 50.2° | 137.3° |
| C12 | N5 | C14 | C15 | 129.3° | 42.7° |
| N5 | C12 | C11 | H3 | 32.4° | 4.4° |
| C13 | N4 | N5 | C14 | 179.4° | 179.6° |
| N4 | N5 | C14 | C21 | 128.8° | 42.6° |
| N4 | N5 | C14 | C15 | 51.6° | 137.3° |
| N5 | N4 | C13 | H10 | 179.9° | 180.0° |
| N5 | C14 | C21 | C15 | 179.6° | 180.0° |
| N5 | C14 | C21 | C18 | 177.8° | 180.0° |
| N5 | C14 | C15 | C16 | 177.3° | 180.0° |
| N5 | C14 | C15 | H11 | 2.7° | 0.0° |
| N5 | C14 | C21 | H16 | 2.2° | 0.1° |
| C14 | C21 | C18 | H16 | 180.0° | 180.0° |
| C14 | C21 | C18 | S | 176.6° | 179.7° |
| C14 | C21 | C18 | C17 | 0.1° | 0.0° |
| C21 | C14 | C15 | C16 | 2.3° | 0.0° |
| C21 | C14 | C15 | H11 | 177.7° | 180.0° |
| C18 | C21 | C14 | C15 | 1.8° | 0.0° |
| C21 | C18 | S | C17 | 176.8° | 179.7° |
| C21 | C18 | S | C19 | 176.2° | 179.7° |
| C21 | C18 | C17 | C16 | 1.4° | 0.1° |
| C21 | C18 | C17 | N6 | 175.7° | 180.0° |
| C14 | C15 | C16 | H11 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.9° | 0.0° |
| C14 | C15 | C16 | H12 | 179.1° | 180.0° |
| C15 | C14 | C21 | H16 | 178.2° | 180.0° |
| S | C18 | C17 | C16 | 178.4° | 179.8° |
| S | C18 | C17 | N6 | 1.3° | 0.3° |
| C18 | S | C19 | C20 | 175.6° | 179.8° |
| C18 | S | C19 | N6 | 0.2° | 0.3° |
| S | C18 | C21 | H16 | 3.4° | 0.3° |
| C19 | S | C18 | C17 | 0.6° | 0.0° |
| S | C19 | N6 | C17 | 1.0° | 0.5° |
| S | C19 | C20 | N6 | 175.4° | 179.5° |
| S | C19 | C20 | H14 | 0.0° | 90.6° |
| S | C19 | C20 | H13 | 120.0° | 29.4° |
| S | C19 | C20 | H15 | 120.0° | 149.4° |
| C18 | C17 | C16 | C15 | 0.9° | 0.0° |
| C18 | C17 | C16 | N6 | 176.7° | 179.9° |
| C18 | C17 | N6 | C19 | 1.4° | 0.6° |
| C18 | C17 | C16 | H12 | 179.1° | 180.0° |
| C17 | C18 | C21 | H16 | 179.9° | 179.9° |
| C15 | C16 | C17 | H12 | 180.0° | 180.0° |
| C15 | C16 | C17 | N6 | 175.9° | 179.9° |
| C16 | C17 | N6 | C19 | 178.3° | 179.5° |
| C17 | C16 | C15 | H11 | 179.1° | 180.0° |
| C17 | N6 | C19 | C20 | 174.4° | 179.9° |
| N6 | C17 | C16 | H12 | 4.2° | 0.1° |
| C19 | C20 | H14 | H13 | 120.0° | 120.0° |
| C19 | C20 | H14 | H15 | 120.0° | 120.0° |
| C19 | C20 | H13 | H15 | 120.0° | 120.0° |
| N6 | C19 | C20 | H14 | 175.4° | 89.9° |
| N6 | C19 | C20 | H13 | 55.3° | 150.0° |
| N6 | C19 | C20 | H15 | 64.7° | 30.1° |
| H12 | C16 | C15 | H11 | 0.9° | 0.0° |
| H14 | C20 | H13 | H15 | 120.0° | 119.9° |
| H4 | C22 | C23 | H17 | 66.0° | 65.0° |
| H4 | C22 | C23 | H18 | 172.6° | 175.0° |
| H4 | C22 | C | H | 56.3° | 57.5° |
| H17 | C23 | O3 | H19 | 60.7° | 60.0° |
| H18 | C23 | O3 | H19 | 60.7° | 60.0° |
| H3 | C11 | C10 | H2 | 177.8° | 177.7° |
| H1 | C1 | C10 | H2 | 179.8° | 177.1° |
| H1 | C1 | C | H | 56.1° | 56.9° |
| H2 | C10 | O1 | H9 | 60.3° | 59.9° |
| H | C | O | H5 | 58.6° | 59.8° |
