A1CGY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N5 | C15 | sing | 1.47Å | 1.46Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.55Å | 1.52Å | |
| C16 | C17 | sing | 1.54Å | 1.53Å | |
| C2 | C4 | sing | 1.51Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.55Å | 1.52Å | |
| C28 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C13 | sing | 1.54Å | 1.54Å | |
| C14 | C13 | sing | 1.54Å | 1.52Å | |
| C26 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
| C26 | C27 | sing | 1.51Å | 1.50Å | |
| C5 | C6 | sing | 1.39Å | 1.37Å | Aromatic |
| C13 | N2 | sing | 1.46Å | 1.47Å | |
| C6 | O1 | sing | 1.36Å | 1.39Å | |
| C12 | N2 | sing | 1.35Å | 1.36Å | Aromatic |
| C12 | N3 | doub | 1.30Å | 1.31Å | Aromatic |
| N2 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| N3 | C18 | sing | 1.34Å | 1.38Å | Aromatic |
| O1 | C7 | sing | 1.35Å | 1.34Å | |
| N4 | C7 | doub | 1.32Å | 1.32Å | Aromatic |
| N4 | C10 | sing | 1.33Å | 1.35Å | Aromatic |
| C11 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.47Å | 1.47Å | |
| C18 | C19 | sing | 1.48Å | 1.47Å | |
| C7 | N1 | sing | 1.32Å | 1.33Å | Aromatic |
| C10 | C9 | doub | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | doub | 1.40Å | 1.38Å | Aromatic |
| C19 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | C8 | doub | 1.32Å | 1.34Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.49Å | |
| F1 | C23 | sing | 1.40Å | 1.33Å | |
| C23 | F3 | sing | 1.40Å | 1.33Å | |
| C23 | F2 | sing | 1.40Å | 1.33Å | |
| C5 | H8 | sing | 1.08Å | 1.08Å | |
| C8 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å | |
| C28 | H27 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.08Å | 1.08Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.08Å | 1.08Å | |
| N5 | H29 | sing | 1.01Å | 1.00Å | |
| N5 | H30 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N5 | C15 | C16 | 111.8° | 110.9° |
| N5 | C15 | C14 | 112.4° | 110.8° |
| N5 | C15 | H15 | 109.8° | 110.6° |
| C15 | N5 | H29 | 109.5° | 111.0° |
| C15 | N5 | H30 | 109.5° | 111.0° |
| C1 | C2 | C4 | 111.7° | 109.5° |
| C1 | C2 | C3 | 110.6° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C1 | C2 | H4 | 106.7° | 109.5° |
| C15 | C16 | C17 | 104.0° | 104.2° |
| C16 | C15 | C14 | 104.7° | 102.7° |
| C16 | C15 | H15 | 109.0° | 110.7° |
| C15 | C16 | H17 | 110.8° | 110.5° |
| C15 | C16 | H16 | 110.8° | 110.5° |
| C16 | C17 | C13 | 106.0° | 106.6° |
| C16 | C17 | H19 | 110.3° | 110.0° |
| C16 | C17 | H18 | 110.3° | 110.1° |
| C17 | C16 | H17 | 110.8° | 110.5° |
| C17 | C16 | H16 | 110.8° | 110.5° |
| C4 | C2 | C3 | 113.6° | 109.5° |
| C2 | C4 | C29 | 120.3° | 119.9° |
| C2 | C4 | C5 | 120.9° | 120.0° |
| C4 | C2 | H4 | 106.9° | 109.4° |
| C3 | C2 | H4 | 106.9° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.4° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C28 | C29 | C4 | 120.5° | 120.1° |
| C29 | C28 | C26 | 120.5° | 120.0° |
| C29 | C28 | H27 | 119.8° | 120.0° |
| C28 | C29 | H28 | 119.7° | 119.9° |
| C29 | C4 | C5 | 118.8° | 120.1° |
| C4 | C29 | H28 | 119.8° | 119.9° |
| C15 | C14 | C13 | 100.0° | 104.2° |
| C14 | C15 | H15 | 109.0° | 110.8° |
| C15 | C14 | H13 | 111.8° | 110.5° |
| C15 | C14 | H14 | 111.8° | 110.5° |
| C28 | C26 | C6 | 118.2° | 120.0° |
| C28 | C26 | C27 | 120.8° | 120.0° |
| C26 | C28 | H27 | 119.8° | 120.0° |
| C4 | C5 | C6 | 120.7° | 120.0° |
| C4 | C5 | H8 | 119.7° | 120.1° |
| C17 | C13 | C14 | 105.0° | 106.6° |
| C17 | C13 | N2 | 110.3° | 110.0° |
| C17 | C13 | H12 | 108.6° | 110.0° |
| C13 | C17 | H19 | 110.4° | 110.0° |
| C13 | C17 | H18 | 110.3° | 110.0° |
| C14 | C13 | N2 | 114.5° | 110.0° |
| C14 | C13 | H12 | 108.8° | 110.1° |
| C13 | C14 | H13 | 111.8° | 110.5° |
| C13 | C14 | H14 | 111.8° | 110.5° |
| C6 | C26 | C27 | 121.0° | 120.0° |
| C26 | C6 | C5 | 121.3° | 119.8° |
| C26 | C6 | O1 | 119.6° | 120.1° |
| C26 | C27 | H24 | 109.5° | 109.5° |
| C26 | C27 | H26 | 109.5° | 109.4° |
| C26 | C27 | H25 | 109.4° | 109.5° |
| C5 | C6 | O1 | 119.0° | 120.1° |
| C6 | C5 | H8 | 119.6° | 120.0° |
| C13 | N2 | C12 | 124.0° | 126.3° |
| C13 | N2 | C11 | 130.1° | 126.3° |
| N2 | C13 | H12 | 109.5° | 110.0° |
| C6 | O1 | C7 | 118.1° | 118.0° |
| N2 | C12 | N3 | 112.7° | 109.6° |
| C12 | N2 | C11 | 105.9° | 107.3° |
| N2 | C12 | H11 | 123.7° | 125.2° |
| C12 | N3 | C18 | 106.0° | 109.6° |
| N3 | C12 | H11 | 123.7° | 125.2° |
| N2 | C11 | C18 | 105.9° | 106.1° |
| N2 | C11 | C10 | 123.5° | 126.9° |
| N3 | C18 | C11 | 109.5° | 107.4° |
| N3 | C18 | C19 | 119.5° | 126.3° |
| O1 | C7 | N4 | 119.2° | 119.1° |
| O1 | C7 | N1 | 112.6° | 119.1° |
| C7 | N4 | C10 | 115.6° | 120.5° |
| N4 | C7 | N1 | 128.2° | 121.8° |
| N4 | C10 | C11 | 118.9° | 120.6° |
| N4 | C10 | C9 | 120.9° | 118.9° |
| C18 | C11 | C10 | 130.6° | 126.9° |
| C11 | C18 | C19 | 130.9° | 126.3° |
| C11 | C10 | C9 | 120.2° | 120.5° |
| C18 | C19 | C20 | 119.5° | 120.1° |
| C18 | C19 | C25 | 121.5° | 120.1° |
| C7 | N1 | C8 | 116.1° | 121.0° |
| C10 | C9 | C8 | 118.1° | 118.4° |
| C10 | C9 | H10 | 120.9° | 120.8° |
| C20 | C19 | C25 | 118.6° | 119.7° |
| C19 | C20 | C21 | 120.8° | 119.9° |
| C19 | C20 | H20 | 119.6° | 120.1° |
| C19 | C25 | C24 | 120.8° | 119.9° |
| C19 | C25 | H23 | 119.6° | 120.0° |
| N1 | C8 | C9 | 121.1° | 119.3° |
| N1 | C8 | H9 | 119.5° | 120.4° |
| C9 | C8 | H9 | 119.5° | 120.3° |
| C8 | C9 | H10 | 121.0° | 120.8° |
| C20 | C21 | C22 | 120.0° | 120.1° |
| C21 | C20 | H20 | 119.6° | 120.1° |
| C20 | C21 | H21 | 120.0° | 119.9° |
| C25 | C24 | C22 | 119.6° | 120.1° |
| C25 | C24 | H22 | 120.2° | 119.9° |
| C24 | C25 | H23 | 119.6° | 120.1° |
| C21 | C22 | C24 | 120.0° | 120.3° |
| C21 | C22 | C23 | 119.9° | 119.8° |
| C22 | C21 | H21 | 120.0° | 120.0° |
| C24 | C22 | C23 | 119.9° | 119.9° |
| C22 | C24 | H22 | 120.2° | 120.0° |
| C22 | C23 | F1 | 111.8° | 109.5° |
| C22 | C23 | F3 | 114.2° | 109.4° |
| C22 | C23 | F2 | 112.9° | 109.5° |
| F1 | C23 | F3 | 103.5° | 109.4° |
| F1 | C23 | F2 | 102.8° | 109.5° |
| F3 | C23 | F2 | 110.6° | 109.5° |
| H19 | C17 | H18 | 109.4° | 110.0° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H13 | C14 | H14 | 109.5° | 110.5° |
| H17 | C16 | H16 | 109.5° | 110.5° |
| H24 | C27 | H26 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.4° |
| H26 | C27 | H25 | 109.5° | 109.5° |
| H6 | C3 | H5 | 109.4° | 109.4° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H5 | C3 | H7 | 109.5° | 109.5° |
| H29 | N5 | H30 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N5 | C15 | C16 | C14 | 121.9° | 118.4° |
| N5 | C15 | C16 | H15 | 121.6° | 123.3° |
| N5 | C15 | C16 | C17 | 155.2° | 156.3° |
| N5 | C15 | C14 | H15 | 122.0° | 123.2° |
| N5 | C15 | C14 | C13 | 166.6° | 156.4° |
| N5 | C15 | C14 | H13 | 74.9° | 37.8° |
| N5 | C15 | C14 | H14 | 48.2° | 84.8° |
| N5 | C15 | C16 | H17 | 36.1° | 37.6° |
| N5 | C15 | C16 | H16 | 85.7° | 85.0° |
| C15 | N5 | H29 | H30 | 120.0° | 123.9° |
| C1 | C2 | C4 | C3 | 126.0° | 120.0° |
| C1 | C2 | C4 | H4 | 116.3° | 120.0° |
| C1 | C2 | C3 | H4 | 115.8° | 120.0° |
| C1 | C2 | C4 | C29 | 80.2° | 59.7° |
| C1 | C2 | C4 | C5 | 99.4° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H3 | H2 | 120.0° | 120.1° |
| C1 | C2 | C3 | H6 | 180.0° | 60.0° |
| C1 | C2 | C3 | H5 | 60.0° | 180.0° |
| C1 | C2 | C3 | H7 | 60.0° | 60.0° |
| C15 | C16 | C17 | H17 | 119.1° | 118.7° |
| C15 | C16 | C17 | H16 | 119.1° | 118.7° |
| C16 | C15 | C14 | H15 | 116.5° | 118.3° |
| C15 | C16 | C17 | C13 | 8.0° | 23.6° |
| C16 | C15 | C14 | C13 | 45.1° | 37.9° |
| C15 | C16 | C17 | H19 | 127.5° | 95.7° |
| C15 | C16 | C17 | H18 | 111.4° | 142.9° |
| C16 | C15 | C14 | H13 | 163.5° | 80.8° |
| C16 | C15 | C14 | H14 | 73.4° | 156.6° |
| C15 | C16 | H17 | H16 | 122.6° | 122.6° |
| C16 | C15 | N5 | H29 | 180.0° | 66.5° |
| C16 | C15 | N5 | H30 | 60.0° | 57.4° |
| C17 | C16 | C15 | C14 | 33.2° | 37.9° |
| C16 | C17 | C13 | H19 | 119.4° | 119.3° |
| C16 | C17 | C13 | H18 | 119.5° | 119.3° |
| C16 | C17 | C13 | C14 | 19.8° | 0.0° |
| C16 | C17 | C13 | N2 | 143.6° | 119.3° |
| C16 | C17 | C13 | H12 | 96.4° | 119.3° |
| C17 | C16 | C15 | H15 | 83.3° | 80.4° |
| C16 | C17 | H19 | H18 | 121.6° | 121.5° |
| C17 | C16 | H17 | H16 | 122.5° | 122.6° |
| C4 | C2 | C3 | H4 | 117.6° | 119.9° |
| C2 | C4 | C29 | C28 | 179.7° | 179.7° |
| C2 | C4 | C29 | C5 | 179.6° | 179.6° |
| C2 | C4 | C5 | C6 | 179.9° | 180.0° |
| C2 | C4 | C5 | H8 | 0.1° | 0.0° |
| C4 | C2 | C1 | H1 | 180.0° | 60.0° |
| C4 | C2 | C1 | H3 | 60.0° | 180.0° |
| C4 | C2 | C1 | H2 | 60.0° | 60.0° |
| C2 | C4 | C29 | H28 | 0.3° | 0.4° |
| C4 | C2 | C3 | H6 | 53.4° | 60.0° |
| C4 | C2 | C3 | H5 | 66.6° | 60.0° |
| C4 | C2 | C3 | H7 | 173.4° | 180.0° |
| C3 | C2 | C4 | C29 | 153.8° | 60.4° |
| C3 | C2 | C4 | C5 | 26.6° | 120.0° |
| C3 | C2 | C1 | H1 | 52.3° | 60.0° |
| C3 | C2 | C1 | H3 | 67.7° | 60.0° |
| C3 | C2 | C1 | H2 | 172.4° | 180.0° |
| C2 | C3 | H6 | H5 | 120.0° | 120.0° |
| C2 | C3 | H6 | H7 | 120.0° | 120.0° |
| C2 | C3 | H5 | H7 | 120.0° | 120.0° |
| C28 | C29 | C4 | H28 | 180.0° | 179.3° |
| C29 | C28 | C26 | H27 | 180.0° | 179.7° |
| C28 | C29 | C4 | C5 | 0.1° | 0.6° |
| C29 | C28 | C26 | C6 | 0.4° | 0.3° |
| C29 | C28 | C26 | C27 | 180.0° | 179.7° |
| C4 | C29 | C28 | C26 | 0.3° | 0.6° |
| C29 | C4 | C5 | C6 | 0.3° | 0.3° |
| C29 | C4 | C5 | H8 | 179.7° | 179.6° |
| C4 | C29 | C28 | H27 | 179.7° | 179.7° |
| C29 | C4 | C2 | H4 | 36.1° | 179.7° |
| C15 | C14 | C13 | C17 | 39.4° | 23.6° |
| C15 | C14 | C13 | H13 | 118.4° | 118.7° |
| C15 | C14 | C13 | H14 | 118.4° | 118.7° |
| C15 | C14 | C13 | N2 | 160.5° | 142.9° |
| C15 | C14 | C13 | H12 | 76.7° | 95.7° |
| C15 | C14 | H13 | H14 | 124.4° | 122.6° |
| C14 | C15 | C16 | H17 | 85.9° | 80.8° |
| C14 | C15 | C16 | H16 | 152.4° | 156.6° |
| C14 | C15 | N5 | H29 | 62.6° | 180.0° |
| C14 | C15 | N5 | H30 | 177.4° | 56.1° |
| C28 | C26 | C6 | C27 | 179.6° | 179.9° |
| C28 | C26 | C6 | C5 | 0.1° | 0.1° |
| C28 | C26 | C6 | O1 | 178.0° | 180.0° |
| C28 | C26 | C27 | H24 | 89.8° | 90.0° |
| C28 | C26 | C27 | H26 | 150.2° | 30.0° |
| C28 | C26 | C27 | H25 | 30.2° | 150.0° |
| C26 | C28 | C29 | H28 | 179.8° | 180.0° |
| C4 | C5 | C6 | C26 | 0.2° | 0.1° |
| C4 | C5 | C6 | H8 | 180.0° | 180.0° |
| C4 | C5 | C6 | O1 | 177.7° | 180.0° |
| C5 | C4 | C2 | H4 | 144.3° | 0.0° |
| C5 | C4 | C29 | H28 | 179.9° | 180.0° |
| C17 | C13 | C14 | N2 | 121.1° | 119.3° |
| C17 | C13 | C14 | H12 | 116.1° | 119.3° |
| C17 | C13 | N2 | H12 | 119.4° | 121.4° |
| C17 | C13 | N2 | C12 | 77.3° | 66.3° |
| C17 | C13 | N2 | C11 | 101.0° | 113.7° |
| C13 | C17 | H19 | H18 | 121.6° | 121.4° |
| C17 | C13 | C14 | H13 | 157.8° | 95.1° |
| C17 | C13 | C14 | H14 | 79.1° | 142.3° |
| C13 | C17 | C16 | H17 | 111.1° | 95.1° |
| C13 | C17 | C16 | H16 | 127.2° | 142.3° |
| C14 | C13 | N2 | H12 | 122.5° | 121.4° |
| C14 | C13 | N2 | C12 | 40.8° | 51.0° |
| C14 | C13 | N2 | C11 | 140.9° | 129.0° |
| C13 | C14 | C15 | H15 | 71.4° | 80.4° |
| C14 | C13 | C17 | H19 | 99.6° | 119.2° |
| C14 | C13 | C17 | H18 | 139.3° | 119.4° |
| C13 | C14 | H13 | H14 | 124.4° | 122.6° |
| C26 | C6 | C5 | O1 | 177.9° | 180.0° |
| C26 | C6 | O1 | C7 | 93.6° | 85.4° |
| C26 | C6 | C5 | H8 | 179.8° | 179.9° |
| C6 | C26 | C28 | H27 | 179.6° | 180.0° |
| C6 | C26 | C27 | H24 | 89.8° | 89.9° |
| C6 | C26 | C27 | H26 | 30.2° | 150.0° |
| C6 | C26 | C27 | H25 | 150.2° | 30.0° |
| C27 | C26 | C6 | C5 | 179.7° | 180.0° |
| C27 | C26 | C6 | O1 | 2.4° | 0.0° |
| C27 | C26 | C28 | H27 | 0.0° | 0.0° |
| C26 | C27 | H24 | H26 | 120.0° | 120.0° |
| C26 | C27 | H24 | H25 | 120.0° | 120.0° |
| C26 | C27 | H26 | H25 | 120.0° | 120.0° |
| C5 | C6 | O1 | C7 | 88.4° | 94.6° |
| C13 | N2 | C12 | C11 | 178.7° | 180.0° |
| C13 | N2 | C12 | N3 | 179.3° | 180.0° |
| C13 | N2 | C11 | C18 | 178.5° | 180.0° |
| C13 | N2 | C11 | C10 | 4.2° | 0.0° |
| N2 | C13 | C17 | H19 | 24.2° | 121.4° |
| N2 | C13 | C17 | H18 | 96.9° | 0.0° |
| C13 | N2 | C12 | H11 | 0.7° | 0.1° |
| N2 | C13 | C14 | H13 | 81.1° | 24.2° |
| N2 | C13 | C14 | H14 | 42.0° | 98.4° |
| C6 | O1 | C7 | N4 | 1.4° | 175.0° |
| C6 | O1 | C7 | N1 | 177.4° | 5.0° |
| O1 | C6 | C5 | H8 | 2.3° | 0.0° |
| N2 | C12 | N3 | H11 | 180.0° | 179.9° |
| N2 | C12 | N3 | C18 | 1.0° | 0.0° |
| C12 | N2 | C11 | C18 | 0.0° | 0.0° |
| C12 | N2 | C11 | C10 | 177.3° | 180.0° |
| C12 | N2 | C13 | H12 | 163.2° | 172.4° |
| N3 | C12 | N2 | C11 | 0.7° | 0.0° |
| C12 | N3 | C18 | C11 | 1.0° | 0.0° |
| C12 | N3 | C18 | C19 | 175.0° | 179.9° |
| N2 | C11 | C18 | N3 | 0.6° | 0.0° |
| N2 | C11 | C10 | N4 | 34.4° | 150.8° |
| N2 | C11 | C18 | C10 | 177.0° | 180.0° |
| N2 | C11 | C18 | C19 | 174.8° | 179.9° |
| N2 | C11 | C10 | C9 | 145.2° | 29.2° |
| C11 | N2 | C13 | H12 | 18.5° | 7.6° |
| C11 | N2 | C12 | H11 | 179.4° | 179.9° |
| N3 | C18 | C11 | C19 | 175.4° | 179.9° |
| N3 | C18 | C11 | C10 | 176.4° | 180.0° |
| N3 | C18 | C19 | C20 | 29.8° | 34.9° |
| N3 | C18 | C19 | C25 | 143.6° | 145.6° |
| C18 | N3 | C12 | H11 | 179.0° | 179.9° |
| O1 | C7 | N4 | N1 | 178.6° | 180.0° |
| O1 | C7 | N4 | C10 | 178.0° | 180.0° |
| O1 | C7 | N1 | C8 | 179.1° | 180.0° |
| C7 | N4 | C10 | C11 | 179.7° | 180.0° |
| C7 | N4 | C10 | C9 | 0.1° | 0.0° |
| N4 | C7 | N1 | C8 | 0.4° | 0.0° |
| N4 | C10 | C11 | C18 | 149.1° | 29.2° |
| N4 | C10 | C11 | C9 | 179.6° | 180.0° |
| C10 | N4 | C7 | N1 | 0.5° | 0.0° |
| N4 | C10 | C9 | C8 | 1.7° | 0.0° |
| N4 | C10 | C9 | H10 | 178.3° | 180.0° |
| C18 | C11 | C10 | C9 | 31.3° | 150.8° |
| C11 | C18 | C19 | C20 | 155.2° | 145.0° |
| C11 | C18 | C19 | C25 | 31.4° | 34.5° |
| C10 | C11 | C18 | C19 | 8.2° | 0.1° |
| C11 | C10 | C9 | C8 | 178.8° | 180.0° |
| C11 | C10 | C9 | H10 | 1.3° | 0.0° |
| C18 | C19 | C20 | C25 | 173.6° | 179.4° |
| C18 | C19 | C20 | C21 | 178.7° | 179.9° |
| C18 | C19 | C25 | C24 | 178.4° | 180.0° |
| C18 | C19 | C20 | H20 | 1.3° | 0.3° |
| C18 | C19 | C25 | H23 | 1.6° | 0.0° |
| C7 | N1 | C8 | C9 | 2.0° | 0.0° |
| C7 | N1 | C8 | H9 | 177.9° | 180.0° |
| C10 | C9 | C8 | N1 | 2.7° | 0.0° |
| C10 | C9 | C8 | H10 | 180.0° | 180.0° |
| C10 | C9 | C8 | H9 | 177.3° | 180.0° |
| C19 | C20 | C21 | H20 | 180.0° | 179.8° |
| C20 | C19 | C25 | C24 | 5.0° | 0.5° |
| C19 | C20 | C21 | C22 | 1.7° | 0.2° |
| C19 | C20 | C21 | H21 | 178.3° | 179.8° |
| C20 | C19 | C25 | H23 | 175.1° | 179.5° |
| C25 | C19 | C20 | C21 | 5.1° | 0.5° |
| C19 | C25 | C24 | H23 | 180.0° | 180.0° |
| C19 | C25 | C24 | C22 | 1.4° | 0.2° |
| C25 | C19 | C20 | H20 | 174.9° | 179.7° |
| C19 | C25 | C24 | H22 | 178.6° | 179.7° |
| N1 | C8 | C9 | H9 | 180.0° | 179.9° |
| N1 | C8 | C9 | H10 | 177.3° | 180.0° |
| C20 | C21 | C22 | H21 | 180.0° | 179.9° |
| C20 | C21 | C22 | C24 | 2.0° | 0.1° |
| C20 | C21 | C22 | C23 | 177.5° | 180.0° |
| C25 | C24 | C22 | C21 | 2.2° | 0.1° |
| C25 | C24 | C22 | H22 | 180.0° | 180.0° |
| C25 | C24 | C22 | C23 | 177.6° | 180.0° |
| C21 | C22 | C24 | C23 | 175.4° | 179.9° |
| C21 | C22 | C23 | F1 | 96.8° | 150.0° |
| C21 | C22 | C23 | F3 | 20.4° | 90.1° |
| C21 | C22 | C23 | F2 | 147.9° | 30.0° |
| C22 | C21 | C20 | H20 | 178.3° | 180.0° |
| C21 | C22 | C24 | H22 | 177.8° | 180.0° |
| C24 | C22 | C23 | F1 | 78.7° | 29.9° |
| C24 | C22 | C23 | F3 | 164.2° | 90.0° |
| C24 | C22 | C23 | F2 | 36.7° | 149.9° |
| C24 | C22 | C21 | H21 | 178.0° | 180.0° |
| C22 | C24 | C25 | H23 | 178.6° | 179.8° |
| C22 | C23 | F1 | F3 | 123.4° | 119.9° |
| C22 | C23 | F1 | F2 | 121.4° | 120.0° |
| C22 | C23 | F3 | F2 | 128.7° | 120.1° |
| C23 | C22 | C21 | H21 | 2.5° | 0.1° |
| C23 | C22 | C24 | H22 | 2.4° | 0.1° |
| F1 | C23 | F3 | F2 | 109.5° | 120.0° |
| H9 | C8 | C9 | H10 | 2.7° | 0.0° |
| H12 | C13 | C17 | H19 | 144.1° | 0.1° |
| H12 | C13 | C17 | H18 | 23.0° | 121.3° |
| H12 | C13 | C14 | H13 | 41.7° | 145.6° |
| H12 | C13 | C14 | H14 | 164.8° | 23.0° |
| H15 | C15 | C14 | H13 | 47.1° | 160.9° |
| H15 | C15 | C14 | H14 | 170.2° | 38.3° |
| H15 | C15 | C16 | H17 | 157.6° | 160.9° |
| H15 | C15 | C16 | H16 | 35.9° | 38.3° |
| H15 | C15 | N5 | H29 | 58.9° | 56.8° |
| H15 | C15 | N5 | H30 | 61.1° | 179.3° |
| H19 | C17 | C16 | H17 | 8.4° | 145.7° |
| H19 | C17 | C16 | H16 | 113.4° | 23.1° |
| H18 | C17 | C16 | H17 | 129.4° | 24.2° |
| H18 | C17 | C16 | H16 | 7.7° | 98.4° |
| H20 | C20 | C21 | H21 | 1.7° | 0.0° |
| H22 | C24 | C25 | H23 | 1.3° | 0.3° |
| H27 | C28 | C29 | H28 | 0.2° | 0.4° |
| H1 | C1 | H3 | H2 | 120.0° | 119.9° |
| H1 | C1 | C2 | H4 | 63.6° | 179.9° |
| H3 | C1 | C2 | H4 | 176.5° | 60.0° |
| H2 | C1 | C2 | H4 | 56.5° | 60.0° |
| H4 | C2 | C3 | H6 | 64.2° | 179.9° |
| H4 | C2 | C3 | H5 | 175.8° | 60.0° |
| H4 | C2 | C3 | H7 | 55.8° | 60.1° |
| H24 | C27 | H26 | H25 | 120.0° | 120.0° |
| H6 | C3 | H5 | H7 | 120.0° | 120.0° |
