A1AWV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C23 | sing | 1.51Å | 1.52Å | |
| C22 | C23 | doub | 1.38Å | 1.51Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.31Å | Aromatic |
| C23 | C25 | sing | 1.38Å | 1.32Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C21 | C20 | doub | 1.39Å | 1.52Å | Aromatic |
| C25 | C26 | doub | 1.38Å | 1.52Å | Aromatic |
| C20 | C26 | sing | 1.39Å | 1.32Å | Aromatic |
| C20 | N6 | sing | 1.40Å | 1.44Å | |
| N5 | N6 | sing | 1.40Å | 1.37Å | Aromatic |
| N5 | C15 | doub | 1.31Å | 1.34Å | Aromatic |
| C16 | C19 | sing | 1.53Å | 1.52Å | |
| C16 | C15 | sing | 1.51Å | 1.51Å | |
| C16 | C18 | sing | 1.53Å | 1.52Å | |
| N6 | C13 | sing | 1.36Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.40Å | 1.42Å | Aromatic |
| C13 | C14 | doub | 1.36Å | 1.36Å | Aromatic |
| C13 | N4 | sing | 1.39Å | 1.39Å | |
| N4 | C12 | sing | 1.35Å | 1.43Å | |
| C12 | O3 | doub | 1.22Å | 1.20Å | |
| C12 | N3 | sing | 1.35Å | 1.44Å | |
| N3 | C11 | sing | 1.47Å | 1.44Å | |
| C11 | C10 | sing | 1.51Å | 1.49Å | |
| C10 | C27 | doub | 1.38Å | 1.50Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.31Å | Aromatic |
| O2 | C9 | sing | 1.36Å | 1.37Å | |
| O2 | C8 | sing | 1.36Å | 1.42Å | |
| C27 | C28 | sing | 1.38Å | 1.32Å | Aromatic |
| C7 | C8 | doub | 1.39Å | 1.41Å | Aromatic |
| C7 | C6 | sing | 1.37Å | 1.39Å | Aromatic |
| C9 | C30 | doub | 1.39Å | 1.50Å | Aromatic |
| C8 | C31 | sing | 1.38Å | 1.43Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.37Å | Aromatic |
| C28 | F1 | sing | 1.35Å | 1.33Å | |
| C28 | C29 | doub | 1.38Å | 1.51Å | Aromatic |
| C5 | C4 | sing | 1.41Å | 1.45Å | Aromatic |
| C5 | N1 | sing | 1.37Å | 1.50Å | Aromatic |
| C31 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.30Å | Aromatic |
| C4 | C3 | sing | 1.46Å | 1.40Å | Aromatic |
| C2 | N1 | sing | 1.46Å | 1.46Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| N1 | N2 | sing | 1.40Å | 1.35Å | Aromatic |
| C3 | N2 | doub | 1.30Å | 1.27Å | Aromatic |
| C1 | O1 | sing | 1.43Å | 1.40Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.08Å | 1.08Å | |
| C22 | H8 | sing | 1.08Å | 1.08Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.08Å | 1.08Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C2 | H24 | sing | 1.09Å | 1.10Å | |
| C2 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C29 | H28 | sing | 1.08Å | 1.08Å | |
| C3 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| N4 | H32 | sing | 0.97Å | 1.00Å | |
| O1 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 119.2° | 119.9° |
| C24 | C23 | C25 | 120.9° | 119.9° |
| C23 | C24 | H9 | 109.5° | 109.5° |
| C23 | C24 | H10 | 109.5° | 109.5° |
| C23 | C24 | H11 | 109.5° | 109.5° |
| C23 | C22 | C21 | 120.2° | 120.0° |
| C22 | C23 | C25 | 119.9° | 120.2° |
| C23 | C22 | H8 | 119.9° | 120.0° |
| C22 | C21 | C20 | 120.2° | 119.9° |
| C22 | C21 | H7 | 119.9° | 120.0° |
| C21 | C22 | H8 | 119.9° | 120.0° |
| C23 | C25 | C26 | 120.5° | 120.0° |
| C23 | C25 | H26 | 119.7° | 120.0° |
| C17 | C16 | C19 | 110.5° | 109.5° |
| C17 | C16 | C15 | 108.6° | 109.5° |
| C17 | C16 | C18 | 110.2° | 109.5° |
| C16 | C17 | H4 | 109.5° | 109.5° |
| C16 | C17 | H5 | 109.5° | 109.5° |
| C16 | C17 | H6 | 109.5° | 109.5° |
| C21 | C20 | C26 | 120.2° | 119.9° |
| C21 | C20 | N6 | 116.5° | 120.0° |
| C20 | C21 | H7 | 119.9° | 120.1° |
| C25 | C26 | C20 | 118.9° | 119.9° |
| C25 | C26 | H12 | 120.5° | 120.0° |
| C26 | C25 | H26 | 119.7° | 120.0° |
| C26 | C20 | N6 | 123.2° | 120.0° |
| C20 | C26 | H12 | 120.6° | 120.1° |
| C20 | N6 | N5 | 121.9° | 126.1° |
| C20 | N6 | C13 | 130.6° | 126.1° |
| N6 | N5 | C15 | 107.9° | 108.4° |
| N5 | N6 | C13 | 107.5° | 107.8° |
| N5 | C15 | C16 | 121.2° | 125.8° |
| N5 | C15 | C14 | 109.8° | 108.5° |
| C19 | C16 | C15 | 108.5° | 109.5° |
| C19 | C16 | C18 | 111.5° | 109.4° |
| C16 | C19 | H21 | 109.5° | 109.5° |
| C16 | C19 | H22 | 109.5° | 109.5° |
| C16 | C19 | H23 | 109.5° | 109.5° |
| C15 | C16 | C18 | 107.4° | 109.4° |
| C16 | C15 | C14 | 129.1° | 125.7° |
| C16 | C18 | H18 | 109.5° | 109.5° |
| C16 | C18 | H19 | 109.5° | 109.5° |
| C16 | C18 | H20 | 109.5° | 109.5° |
| N6 | C13 | C14 | 110.1° | 107.5° |
| N6 | C13 | N4 | 118.6° | 126.3° |
| C15 | C14 | C13 | 104.7° | 107.8° |
| C15 | C14 | H17 | 127.7° | 126.1° |
| C14 | C13 | N4 | 131.1° | 126.3° |
| C13 | C14 | H17 | 127.6° | 126.1° |
| C13 | N4 | C12 | 121.2° | 120.0° |
| C13 | N4 | H32 | 119.4° | 120.0° |
| N4 | C12 | O3 | 124.2° | 120.0° |
| N4 | C12 | N3 | 111.6° | 120.0° |
| C12 | N4 | H32 | 119.4° | 120.0° |
| O3 | C12 | N3 | 124.2° | 120.0° |
| C12 | N3 | C11 | 119.2° | 120.0° |
| C12 | N3 | H1 | 120.4° | 120.0° |
| N3 | C11 | C10 | 116.4° | 109.5° |
| C11 | N3 | H1 | 120.4° | 120.0° |
| N3 | C11 | H15 | 107.7° | 109.5° |
| N3 | C11 | H16 | 107.7° | 109.5° |
| C11 | C10 | C27 | 123.3° | 120.0° |
| C11 | C10 | C9 | 116.1° | 120.0° |
| C10 | C11 | H15 | 107.7° | 109.5° |
| C10 | C11 | H16 | 107.7° | 109.5° |
| C27 | C10 | C9 | 120.6° | 120.0° |
| C10 | C27 | C28 | 116.8° | 120.0° |
| C10 | C27 | H27 | 121.6° | 120.0° |
| C10 | C9 | O2 | 119.6° | 120.1° |
| C10 | C9 | C30 | 121.9° | 119.9° |
| C9 | O2 | C8 | 116.1° | 118.0° |
| O2 | C9 | C30 | 118.5° | 120.0° |
| O2 | C8 | C7 | 114.1° | 119.8° |
| O2 | C8 | C31 | 126.7° | 119.8° |
| C27 | C28 | F1 | 122.1° | 120.0° |
| C27 | C28 | C29 | 122.8° | 120.1° |
| C28 | C27 | H27 | 121.6° | 120.0° |
| C8 | C7 | C6 | 122.1° | 120.8° |
| C7 | C8 | C31 | 119.2° | 120.4° |
| C8 | C7 | H3 | 119.0° | 119.6° |
| C7 | C6 | C5 | 119.7° | 120.1° |
| C7 | C6 | H2 | 120.1° | 120.0° |
| C6 | C7 | H3 | 118.9° | 119.6° |
| C9 | C30 | C29 | 118.2° | 120.0° |
| C9 | C30 | H30 | 120.9° | 120.0° |
| C8 | C31 | C4 | 118.7° | 119.5° |
| C8 | C31 | H31 | 120.6° | 120.3° |
| C6 | C5 | C4 | 120.3° | 119.6° |
| C6 | C5 | N1 | 135.8° | 133.7° |
| C5 | C6 | H2 | 120.2° | 119.9° |
| F1 | C28 | C29 | 115.1° | 119.9° |
| C28 | C29 | C30 | 119.7° | 120.0° |
| C28 | C29 | H28 | 120.1° | 120.0° |
| C4 | C5 | N1 | 103.9° | 106.7° |
| C5 | C4 | C31 | 120.1° | 119.7° |
| C5 | C4 | C3 | 99.1° | 106.4° |
| C5 | N1 | C2 | 125.1° | 125.4° |
| C5 | N1 | N2 | 111.5° | 109.1° |
| C31 | C4 | C3 | 140.8° | 133.9° |
| C4 | C31 | H31 | 120.6° | 120.2° |
| C30 | C29 | H28 | 120.1° | 120.0° |
| C29 | C30 | H30 | 120.9° | 120.0° |
| C4 | C3 | N2 | 123.6° | 107.8° |
| C4 | C3 | H29 | 118.2° | 126.2° |
| N1 | C2 | C1 | 109.9° | 109.5° |
| C2 | N1 | N2 | 123.4° | 125.5° |
| N1 | C2 | H24 | 109.3° | 109.5° |
| N1 | C2 | H25 | 109.4° | 109.5° |
| C2 | C1 | O1 | 106.4° | 109.5° |
| C2 | C1 | H13 | 110.2° | 109.4° |
| C2 | C1 | H14 | 110.3° | 109.4° |
| C1 | C2 | H24 | 109.4° | 109.5° |
| C1 | C2 | H25 | 109.4° | 109.4° |
| N1 | N2 | C3 | 101.8° | 110.1° |
| N2 | C3 | H29 | 118.2° | 126.0° |
| O1 | C1 | H13 | 110.2° | 109.6° |
| O1 | C1 | H14 | 110.2° | 109.5° |
| C1 | O1 | H33 | 109.5° | 114.0° |
| H4 | C17 | H5 | 109.5° | 109.5° |
| H4 | C17 | H6 | 109.5° | 109.5° |
| H5 | C17 | H6 | 109.4° | 109.5° |
| H9 | C24 | H10 | 109.4° | 109.5° |
| H9 | C24 | H11 | 109.5° | 109.4° |
| H10 | C24 | H11 | 109.5° | 109.5° |
| H13 | C1 | H14 | 109.5° | 109.5° |
| H15 | C11 | H16 | 109.5° | 109.4° |
| H18 | C18 | H19 | 109.5° | 109.5° |
| H18 | C18 | H20 | 109.5° | 109.4° |
| H19 | C18 | H20 | 109.5° | 109.5° |
| H21 | C19 | H22 | 109.4° | 109.4° |
| H21 | C19 | H23 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.5° |
| H24 | C2 | H25 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | C25 | 179.7° | 179.7° |
| C24 | C23 | C22 | C21 | 179.7° | 180.0° |
| C24 | C23 | C25 | C26 | 179.9° | 179.7° |
| C24 | C23 | C22 | H8 | 0.3° | 0.0° |
| C23 | C24 | H9 | H10 | 120.0° | 120.0° |
| C23 | C24 | H9 | H11 | 120.0° | 120.0° |
| C23 | C24 | H10 | H11 | 120.0° | 120.0° |
| C24 | C23 | C25 | H26 | 0.0° | 0.3° |
| C23 | C22 | C21 | H8 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 1.2° | 0.1° |
| C22 | C23 | C25 | C26 | 0.3° | 0.6° |
| C23 | C22 | C21 | H7 | 178.8° | 180.0° |
| C22 | C23 | C24 | H9 | 90.2° | 90.0° |
| C22 | C23 | C24 | H10 | 149.8° | 150.0° |
| C22 | C23 | C24 | H11 | 29.9° | 29.9° |
| C22 | C23 | C25 | H26 | 179.7° | 180.0° |
| C21 | C22 | C23 | C25 | 0.0° | 0.4° |
| C22 | C21 | C20 | H7 | 180.0° | 179.9° |
| C22 | C21 | C20 | C26 | 2.4° | 0.1° |
| C22 | C21 | C20 | N6 | 179.0° | 179.7° |
| C23 | C25 | C26 | H26 | 180.0° | 179.3° |
| C23 | C25 | C26 | C20 | 0.9° | 0.6° |
| C25 | C23 | C22 | H8 | 180.0° | 179.7° |
| C25 | C23 | C24 | H9 | 90.1° | 90.3° |
| C25 | C23 | C24 | H10 | 29.8° | 29.7° |
| C25 | C23 | C24 | H11 | 149.8° | 149.7° |
| C23 | C25 | C26 | H12 | 179.1° | 179.4° |
| C17 | C16 | C15 | N5 | 13.4° | 105.4° |
| C17 | C16 | C19 | C15 | 119.0° | 120.1° |
| C17 | C16 | C19 | C18 | 122.9° | 120.0° |
| C17 | C16 | C15 | C18 | 119.2° | 120.0° |
| C17 | C16 | C15 | C14 | 166.5° | 75.0° |
| C16 | C17 | H4 | H5 | 120.0° | 120.0° |
| C16 | C17 | H4 | H6 | 120.0° | 120.0° |
| C16 | C17 | H5 | H6 | 120.0° | 120.0° |
| C17 | C16 | C18 | H18 | 180.0° | 60.0° |
| C17 | C16 | C18 | H19 | 60.0° | 180.0° |
| C17 | C16 | C18 | H20 | 60.0° | 60.0° |
| C17 | C16 | C19 | H21 | 180.0° | 60.0° |
| C17 | C16 | C19 | H22 | 60.0° | 180.0° |
| C17 | C16 | C19 | H23 | 60.0° | 60.1° |
| C21 | C20 | C26 | C25 | 2.2° | 0.3° |
| C21 | C20 | C26 | N6 | 176.3° | 179.7° |
| C21 | C20 | N6 | N5 | 40.3° | 145.3° |
| C21 | C20 | N6 | C13 | 138.0° | 34.7° |
| C20 | C21 | C22 | H8 | 178.8° | 180.0° |
| C21 | C20 | C26 | H12 | 177.8° | 179.7° |
| C25 | C26 | C20 | H12 | 180.0° | 180.0° |
| C25 | C26 | C20 | N6 | 178.5° | 180.0° |
| C26 | C20 | N6 | N5 | 136.1° | 35.0° |
| C26 | C20 | N6 | C13 | 45.5° | 145.0° |
| C26 | C20 | C21 | H7 | 177.6° | 180.0° |
| C20 | C26 | C25 | H26 | 179.1° | 180.0° |
| C20 | N6 | N5 | C13 | 178.7° | 180.0° |
| C20 | N6 | N5 | C15 | 179.8° | 179.8° |
| C20 | N6 | C13 | C14 | 178.6° | 180.0° |
| C20 | N6 | C13 | N4 | 3.2° | 0.3° |
| N6 | C20 | C21 | H7 | 1.0° | 0.4° |
| N6 | C20 | C26 | H12 | 1.5° | 0.0° |
| N6 | N5 | C15 | C16 | 179.7° | 180.0° |
| N6 | N5 | C15 | C14 | 0.4° | 0.4° |
| N5 | N6 | C13 | C14 | 2.8° | 0.1° |
| N5 | N6 | C13 | N4 | 178.2° | 179.7° |
| N5 | C15 | C16 | C19 | 133.6° | 134.6° |
| N5 | C15 | C16 | C14 | 179.9° | 179.6° |
| N5 | C15 | C16 | C18 | 105.8° | 14.6° |
| C15 | N5 | N6 | C13 | 1.4° | 0.2° |
| N5 | C15 | C14 | C13 | 2.0° | 0.4° |
| N5 | C15 | C14 | H17 | 178.0° | 179.6° |
| C19 | C16 | C15 | C18 | 120.6° | 120.0° |
| C19 | C16 | C15 | C14 | 46.4° | 45.0° |
| C19 | C16 | C17 | H4 | 180.0° | 60.0° |
| C19 | C16 | C17 | H5 | 60.0° | 180.0° |
| C19 | C16 | C17 | H6 | 60.0° | 60.0° |
| C19 | C16 | C18 | H18 | 56.9° | 180.0° |
| C19 | C16 | C18 | H19 | 176.9° | 60.0° |
| C19 | C16 | C18 | H20 | 63.1° | 60.0° |
| C16 | C19 | H21 | H22 | 120.0° | 120.0° |
| C16 | C19 | H21 | H23 | 120.0° | 120.1° |
| C16 | C19 | H22 | H23 | 120.0° | 120.0° |
| C16 | C15 | C14 | C13 | 178.0° | 179.9° |
| C15 | C16 | C17 | H4 | 61.1° | 60.0° |
| C15 | C16 | C17 | H5 | 58.9° | 59.9° |
| C15 | C16 | C17 | H6 | 178.9° | 180.0° |
| C16 | C15 | C14 | H17 | 2.0° | 0.0° |
| C15 | C16 | C18 | H18 | 61.8° | 60.0° |
| C15 | C16 | C18 | H19 | 58.2° | 60.0° |
| C15 | C16 | C18 | H20 | 178.2° | 180.0° |
| C15 | C16 | C19 | H21 | 61.0° | 179.9° |
| C15 | C16 | C19 | H22 | 179.0° | 60.0° |
| C15 | C16 | C19 | H23 | 59.0° | 60.0° |
| C18 | C16 | C15 | C14 | 74.3° | 165.0° |
| C18 | C16 | C17 | H4 | 56.4° | 180.0° |
| C18 | C16 | C17 | H5 | 176.4° | 60.0° |
| C18 | C16 | C17 | H6 | 63.7° | 60.0° |
| C16 | C18 | H18 | H19 | 120.0° | 120.0° |
| C16 | C18 | H18 | H20 | 120.0° | 120.0° |
| C16 | C18 | H19 | H20 | 120.0° | 120.0° |
| C18 | C16 | C19 | H21 | 57.1° | 60.0° |
| C18 | C16 | C19 | H22 | 62.9° | 60.0° |
| C18 | C16 | C19 | H23 | 177.1° | 180.0° |
| N6 | C13 | C14 | C15 | 2.9° | 0.3° |
| N6 | C13 | C14 | N4 | 174.6° | 179.7° |
| N6 | C13 | N4 | C12 | 147.7° | 179.7° |
| N6 | C13 | C14 | H17 | 177.1° | 179.8° |
| N6 | C13 | N4 | H32 | 32.2° | 0.4° |
| C15 | C14 | C13 | H17 | 180.0° | 180.0° |
| C15 | C14 | C13 | N4 | 177.5° | 179.9° |
| C14 | C13 | N4 | C12 | 26.5° | 0.1° |
| C14 | C13 | N4 | H32 | 153.5° | 180.0° |
| C13 | N4 | C12 | H32 | 180.0° | 179.9° |
| C13 | N4 | C12 | O3 | 4.1° | 0.1° |
| C13 | N4 | C12 | N3 | 176.9° | 180.0° |
| N4 | C13 | C14 | H17 | 2.4° | 0.1° |
| N4 | C12 | O3 | N3 | 178.9° | 180.0° |
| N4 | C12 | N3 | C11 | 177.6° | 180.0° |
| N4 | C12 | N3 | H1 | 2.3° | 0.1° |
| O3 | C12 | N3 | C11 | 3.3° | 0.0° |
| O3 | C12 | N3 | H1 | 176.7° | 180.0° |
| O3 | C12 | N4 | H32 | 175.9° | 180.0° |
| C12 | N3 | C11 | H1 | 180.0° | 180.0° |
| C12 | N3 | C11 | C10 | 115.2° | 180.0° |
| C12 | N3 | C11 | H15 | 5.8° | 60.0° |
| C12 | N3 | C11 | H16 | 123.9° | 60.0° |
| N3 | C12 | N4 | H32 | 3.1° | 0.1° |
| N3 | C11 | C10 | H15 | 121.0° | 120.0° |
| N3 | C11 | C10 | H16 | 121.0° | 120.0° |
| N3 | C11 | C10 | C27 | 10.0° | 100.0° |
| N3 | C11 | C10 | C9 | 171.9° | 79.8° |
| N3 | C11 | H15 | H16 | 116.9° | 120.0° |
| C11 | C10 | C27 | C9 | 178.1° | 179.8° |
| C11 | C10 | C9 | O2 | 0.2° | 0.2° |
| C11 | C10 | C27 | C28 | 179.3° | 179.7° |
| C11 | C10 | C9 | C30 | 179.3° | 179.7° |
| C10 | C11 | N3 | H1 | 64.8° | 0.0° |
| C10 | C11 | H15 | H16 | 116.9° | 120.0° |
| C11 | C10 | C27 | H27 | 0.8° | 0.3° |
| C27 | C10 | C9 | O2 | 178.4° | 180.0° |
| C10 | C27 | C28 | H27 | 180.0° | 179.9° |
| C27 | C10 | C9 | C30 | 2.4° | 0.1° |
| C10 | C27 | C28 | F1 | 177.9° | 180.0° |
| C10 | C27 | C28 | C29 | 0.2° | 0.0° |
| C27 | C10 | C11 | H15 | 111.0° | 140.0° |
| C27 | C10 | C11 | H16 | 131.0° | 20.0° |
| C10 | C9 | O2 | C30 | 179.2° | 179.8° |
| C10 | C9 | O2 | C8 | 119.3° | 173.7° |
| C9 | C10 | C27 | C28 | 1.2° | 0.0° |
| C10 | C9 | C30 | C29 | 2.3° | 0.1° |
| C9 | C10 | C11 | H15 | 67.1° | 40.2° |
| C9 | C10 | C11 | H16 | 50.9° | 160.2° |
| C9 | C10 | C27 | H27 | 178.8° | 179.9° |
| C10 | C9 | C30 | H30 | 177.7° | 180.0° |
| C9 | O2 | C8 | C7 | 176.7° | 112.3° |
| C9 | O2 | C8 | C31 | 3.2° | 67.7° |
| O2 | C9 | C30 | C29 | 178.5° | 180.0° |
| O2 | C9 | C30 | H30 | 1.5° | 0.1° |
| O2 | C8 | C7 | C31 | 179.9° | 179.9° |
| O2 | C8 | C7 | C6 | 179.7° | 180.0° |
| C8 | O2 | C9 | C30 | 61.6° | 6.1° |
| O2 | C8 | C31 | C4 | 179.2° | 180.0° |
| O2 | C8 | C7 | H3 | 0.3° | 0.0° |
| O2 | C8 | C31 | H31 | 0.8° | 0.0° |
| C27 | C28 | F1 | C29 | 178.3° | 180.0° |
| C27 | C28 | C29 | C30 | 0.4° | 0.0° |
| C27 | C28 | C29 | H28 | 179.7° | 180.0° |
| C8 | C7 | C6 | H3 | 180.0° | 180.0° |
| C8 | C7 | C6 | C5 | 0.7° | 0.0° |
| C7 | C8 | C31 | C4 | 0.6° | 0.1° |
| C8 | C7 | C6 | H2 | 179.3° | 180.0° |
| C7 | C8 | C31 | H31 | 179.3° | 180.0° |
| C6 | C7 | C8 | C31 | 0.1° | 0.1° |
| C7 | C6 | C5 | H2 | 180.0° | 180.0° |
| C7 | C6 | C5 | C4 | 1.0° | 0.0° |
| C7 | C6 | C5 | N1 | 179.6° | 180.0° |
| C9 | C30 | C29 | C28 | 0.8° | 0.0° |
| C9 | C30 | C29 | H30 | 180.0° | 179.9° |
| C9 | C30 | C29 | H28 | 179.2° | 179.9° |
| C8 | C31 | C4 | C5 | 0.4° | 0.1° |
| C8 | C31 | C4 | H31 | 180.0° | 180.0° |
| C8 | C31 | C4 | C3 | 179.0° | 180.0° |
| C31 | C8 | C7 | H3 | 179.9° | 179.9° |
| C6 | C5 | C4 | N1 | 179.6° | 180.0° |
| C6 | C5 | C4 | C31 | 0.5° | 0.0° |
| C6 | C5 | C4 | C3 | 178.7° | 180.0° |
| C6 | C5 | N1 | C2 | 0.8° | 0.3° |
| C6 | C5 | N1 | N2 | 179.1° | 180.0° |
| C5 | C6 | C7 | H3 | 179.3° | 180.0° |
| F1 | C28 | C29 | C30 | 177.9° | 180.0° |
| F1 | C28 | C27 | H27 | 2.1° | 0.1° |
| F1 | C28 | C29 | H28 | 2.1° | 0.0° |
| C28 | C29 | C30 | H28 | 180.0° | 180.0° |
| C29 | C28 | C27 | H27 | 179.7° | 180.0° |
| C28 | C29 | C30 | H30 | 179.2° | 180.0° |
| C5 | C4 | C31 | C3 | 178.7° | 180.0° |
| C4 | C5 | N1 | C2 | 178.7° | 179.7° |
| C4 | C5 | N1 | N2 | 0.4° | 0.1° |
| C5 | C4 | C3 | N2 | 1.5° | 0.0° |
| C4 | C5 | C6 | H2 | 179.0° | 180.0° |
| C5 | C4 | C3 | H29 | 178.5° | 180.0° |
| C5 | C4 | C31 | H31 | 179.6° | 180.0° |
| N1 | C5 | C4 | C31 | 180.0° | 180.0° |
| N1 | C5 | C4 | C3 | 0.9° | 0.0° |
| C5 | N1 | C2 | N2 | 178.1° | 179.6° |
| C5 | N1 | C2 | C1 | 79.3° | 90.3° |
| C5 | N1 | N2 | C3 | 0.5° | 0.0° |
| N1 | C5 | C6 | H2 | 0.4° | 0.0° |
| C5 | N1 | C2 | H24 | 160.6° | 29.7° |
| C5 | N1 | C2 | H25 | 40.7° | 149.7° |
| C31 | C4 | C3 | N2 | 179.7° | 180.0° |
| C31 | C4 | C3 | H29 | 0.3° | 0.0° |
| C4 | C3 | N2 | N1 | 1.3° | 0.0° |
| C4 | C3 | N2 | H29 | 180.0° | 180.0° |
| C3 | C4 | C31 | H31 | 1.0° | 0.0° |
| N1 | C2 | C1 | H24 | 120.1° | 120.1° |
| N1 | C2 | C1 | H25 | 120.1° | 120.0° |
| C2 | N1 | N2 | C3 | 177.9° | 179.7° |
| N1 | C2 | C1 | O1 | 82.9° | 180.0° |
| N1 | C2 | C1 | H13 | 157.6° | 59.9° |
| N1 | C2 | C1 | H14 | 36.6° | 60.0° |
| N1 | C2 | H24 | H25 | 119.8° | 120.0° |
| C1 | C2 | N1 | N2 | 102.5° | 90.1° |
| C2 | C1 | O1 | H13 | 119.5° | 120.0° |
| C2 | C1 | O1 | H14 | 119.5° | 120.0° |
| C2 | C1 | H13 | H14 | 121.5° | 119.9° |
| C1 | C2 | H24 | H25 | 119.8° | 119.9° |
| C2 | C1 | O1 | H33 | 180.0° | 180.0° |
| N2 | N1 | C2 | H24 | 17.6° | 149.9° |
| N2 | N1 | C2 | H25 | 137.4° | 29.9° |
| N1 | N2 | C3 | H29 | 178.7° | 180.0° |
| O1 | C1 | H13 | H14 | 121.4° | 120.1° |
| O1 | C1 | C2 | H24 | 37.2° | 60.0° |
| O1 | C1 | C2 | H25 | 157.1° | 60.0° |
| H1 | N3 | C11 | H15 | 174.1° | 120.0° |
| H1 | N3 | C11 | H16 | 56.1° | 120.0° |
| H2 | C6 | C7 | H3 | 0.7° | 0.0° |
| H4 | C17 | H5 | H6 | 120.0° | 120.0° |
| H7 | C21 | C22 | H8 | 1.2° | 0.1° |
| H9 | C24 | H10 | H11 | 120.0° | 120.0° |
| H12 | C26 | C25 | H26 | 0.9° | 0.1° |
| H13 | C1 | C2 | H24 | 82.3° | 180.0° |
| H13 | C1 | C2 | H25 | 37.6° | 60.1° |
| H13 | C1 | O1 | H33 | 60.5° | 60.0° |
| H14 | C1 | C2 | H24 | 156.7° | 60.1° |
| H14 | C1 | C2 | H25 | 83.4° | 180.0° |
| H14 | C1 | O1 | H33 | 60.5° | 60.0° |
| H18 | C18 | H19 | H20 | 120.0° | 120.0° |
| H21 | C19 | H22 | H23 | 120.0° | 120.0° |
| H28 | C29 | C30 | H30 | 0.8° | 0.0° |
