H9F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C19 | N7 | sing | 1.47Å | 1.47Å | |
| O2 | C10 | sing | 1.43Å | 1.42Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C9 | C10 | sing | 1.53Å | 1.46Å | |
| C9 | N5 | sing | 1.47Å | 1.46Å | |
| C15 | N7 | sing | 1.47Å | 1.46Å | |
| N7 | C2 | sing | 1.38Å | 1.35Å | |
| C2 | N1 | doub | 1.32Å | 1.33Å | Aromatic |
| C2 | C1 | sing | 1.42Å | 1.41Å | Aromatic |
| N1 | C3 | sing | 1.33Å | 1.33Å | Aromatic |
| C1 | N4 | sing | 1.34Å | 1.37Å | Aromatic |
| C1 | C4 | doub | 1.41Å | 1.41Å | Aromatic |
| N4 | C6 | doub | 1.32Å | 1.34Å | Aromatic |
| C13 | N6 | sing | 1.46Å | 1.47Å | |
| C13 | C14 | sing | 1.53Å | 1.50Å | |
| C6 | N6 | sing | 1.38Å | 1.34Å | |
| C6 | N3 | sing | 1.33Å | 1.34Å | Aromatic |
| C3 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| C3 | N5 | sing | 1.38Å | 1.33Å | |
| C4 | N2 | sing | 1.34Å | 1.36Å | Aromatic |
| C4 | C5 | sing | 1.42Å | 1.41Å | Aromatic |
| C24 | N8 | sing | 1.47Å | 1.47Å | |
| N5 | C7 | sing | 1.46Å | 1.47Å | |
| N6 | C11 | sing | 1.47Å | 1.47Å | |
| C5 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
| C5 | N8 | sing | 1.38Å | 1.35Å | |
| N8 | C20 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C14 | O4 | sing | 1.43Å | 1.41Å | |
| C12 | O3 | sing | 1.43Å | 1.42Å | |
| C8 | O1 | sing | 1.43Å | 1.41Å | |
| C7 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| O1 | H21 | sing | 0.97Å | 0.95Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| O2 | H24 | sing | 0.97Å | 0.95Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C12 | H27 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.09Å | 1.10Å | |
| O3 | H29 | sing | 0.97Å | 0.95Å | |
| C14 | H30 | sing | 1.09Å | 1.10Å | |
| C14 | H31 | sing | 1.09Å | 1.10Å | |
| O4 | H32 | sing | 0.97Å | 0.95Å | |
| C16 | H33 | sing | 1.09Å | 1.10Å | |
| C16 | H34 | sing | 1.09Å | 1.10Å | |
| C18 | H35 | sing | 1.09Å | 1.10Å | |
| C18 | H36 | sing | 1.09Å | 1.10Å | |
| C19 | H37 | sing | 1.09Å | 1.10Å | |
| C19 | H38 | sing | 1.09Å | 1.10Å | |
| C23 | H39 | sing | 1.09Å | 1.10Å | |
| C23 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | C16 | 111.5° | 109.1° |
| C17 | C18 | C19 | 111.1° | 109.3° |
| C18 | C17 | H11 | 108.9° | 109.6° |
| C18 | C17 | H12 | 109.0° | 109.5° |
| C17 | C18 | H35 | 109.1° | 109.5° |
| C17 | C18 | H36 | 109.1° | 109.6° |
| C17 | C16 | C15 | 114.1° | 109.3° |
| C16 | C17 | H11 | 109.0° | 109.5° |
| C16 | C17 | H12 | 109.0° | 109.5° |
| C17 | C16 | H33 | 108.3° | 109.5° |
| C17 | C16 | H34 | 108.3° | 109.5° |
| C18 | C19 | N7 | 108.6° | 109.5° |
| C19 | C18 | H35 | 109.1° | 109.4° |
| C19 | C18 | H36 | 109.0° | 109.5° |
| C18 | C19 | H37 | 109.7° | 109.5° |
| C18 | C19 | H38 | 109.7° | 109.5° |
| C16 | C15 | N7 | 110.1° | 109.5° |
| C16 | C15 | H9 | 109.3° | 109.5° |
| C16 | C15 | H10 | 109.3° | 109.4° |
| C15 | C16 | H33 | 108.3° | 109.5° |
| C15 | C16 | H34 | 108.3° | 109.5° |
| C23 | C22 | C21 | 111.7° | 109.2° |
| C22 | C23 | C24 | 112.7° | 109.3° |
| C23 | C22 | H17 | 108.9° | 109.5° |
| C23 | C22 | H18 | 108.9° | 109.5° |
| C22 | C23 | H39 | 108.7° | 109.5° |
| C22 | C23 | H40 | 108.7° | 109.5° |
| C22 | C21 | C20 | 113.1° | 109.3° |
| C22 | C21 | H15 | 108.5° | 109.5° |
| C22 | C21 | H16 | 108.5° | 109.6° |
| C21 | C22 | H17 | 108.9° | 109.5° |
| C21 | C22 | H18 | 108.9° | 109.5° |
| C19 | N7 | C15 | 108.2° | 111.2° |
| C19 | N7 | C2 | 121.9° | 111.0° |
| N7 | C19 | H37 | 109.7° | 109.5° |
| N7 | C19 | H38 | 109.7° | 109.4° |
| O2 | C10 | C9 | 105.5° | 109.5° |
| O2 | C10 | H5 | 110.5° | 109.5° |
| O2 | C10 | H6 | 110.5° | 109.5° |
| C10 | O2 | H24 | 109.5° | 114.0° |
| C23 | C24 | N8 | 112.1° | 109.5° |
| C23 | C24 | H19 | 108.8° | 109.5° |
| C23 | C24 | H20 | 108.8° | 109.5° |
| C24 | C23 | H39 | 108.7° | 109.5° |
| C24 | C23 | H40 | 108.7° | 109.5° |
| C21 | C20 | N8 | 111.0° | 109.5° |
| C21 | C20 | H13 | 109.1° | 109.4° |
| C21 | C20 | H14 | 109.1° | 109.5° |
| C20 | C21 | H15 | 108.5° | 109.5° |
| C20 | C21 | H16 | 108.5° | 109.5° |
| C10 | C9 | N5 | 117.5° | 109.5° |
| C9 | C10 | H5 | 110.5° | 109.4° |
| C9 | C10 | H6 | 110.5° | 109.4° |
| C10 | C9 | H22 | 107.4° | 109.5° |
| C10 | C9 | H23 | 107.4° | 109.5° |
| C9 | N5 | C3 | 119.5° | 120.0° |
| C9 | N5 | C7 | 116.4° | 120.0° |
| N5 | C9 | H22 | 107.4° | 109.5° |
| N5 | C9 | H23 | 107.4° | 109.4° |
| C15 | N7 | C2 | 124.6° | 111.0° |
| N7 | C15 | H9 | 109.3° | 109.5° |
| N7 | C15 | H10 | 109.3° | 109.4° |
| N7 | C2 | N1 | 117.3° | 120.9° |
| N7 | C2 | C1 | 122.1° | 120.9° |
| N1 | C2 | C1 | 119.3° | 118.2° |
| C2 | N1 | C3 | 119.4° | 121.5° |
| C2 | C1 | N4 | 121.0° | 122.7° |
| C2 | C1 | C4 | 118.1° | 118.2° |
| N1 | C3 | N2 | 125.5° | 122.6° |
| N1 | C3 | N5 | 116.6° | 118.7° |
| N4 | C1 | C4 | 120.8° | 119.1° |
| C1 | N4 | C6 | 117.1° | 120.3° |
| C1 | C4 | N2 | 120.3° | 119.1° |
| C1 | C4 | C5 | 117.6° | 118.2° |
| N4 | C6 | N6 | 118.4° | 118.6° |
| N4 | C6 | N3 | 124.4° | 122.6° |
| N6 | C13 | C14 | 112.3° | 109.5° |
| C13 | N6 | C6 | 121.9° | 120.0° |
| C13 | N6 | C11 | 116.3° | 120.0° |
| N6 | C13 | H7 | 108.8° | 109.5° |
| N6 | C13 | H8 | 108.8° | 109.5° |
| C13 | C14 | O4 | 111.0° | 109.5° |
| C14 | C13 | H7 | 108.8° | 109.5° |
| C14 | C13 | H8 | 108.8° | 109.5° |
| C13 | C14 | H30 | 109.1° | 109.4° |
| C13 | C14 | H31 | 109.1° | 109.4° |
| N6 | C6 | N3 | 116.9° | 118.7° |
| C6 | N6 | C11 | 120.8° | 120.0° |
| C6 | N3 | C5 | 120.4° | 121.5° |
| N2 | C3 | N5 | 117.9° | 118.6° |
| C3 | N2 | C4 | 117.0° | 120.3° |
| C3 | N5 | C7 | 122.9° | 120.0° |
| N2 | C4 | C5 | 122.1° | 122.7° |
| C4 | C5 | N3 | 119.6° | 118.2° |
| C4 | C5 | N8 | 124.2° | 120.9° |
| C24 | N8 | C5 | 120.5° | 111.0° |
| C24 | N8 | C20 | 111.1° | 111.2° |
| N8 | C24 | H19 | 108.8° | 109.4° |
| N8 | C24 | H20 | 108.8° | 109.4° |
| N5 | C7 | C8 | 117.9° | 109.5° |
| N5 | C7 | H1 | 107.3° | 109.5° |
| N5 | C7 | H2 | 107.3° | 109.5° |
| N6 | C11 | C12 | 116.2° | 109.5° |
| N6 | C11 | H25 | 107.8° | 109.4° |
| N6 | C11 | H26 | 107.8° | 109.5° |
| N3 | C5 | N8 | 116.1° | 120.9° |
| C5 | N8 | C20 | 127.5° | 111.0° |
| N8 | C20 | H13 | 109.1° | 109.5° |
| N8 | C20 | H14 | 109.1° | 109.5° |
| C11 | C12 | O3 | 113.0° | 109.5° |
| C12 | C11 | H25 | 107.8° | 109.5° |
| C12 | C11 | H26 | 107.7° | 109.5° |
| C11 | C12 | H27 | 108.6° | 109.5° |
| C11 | C12 | H28 | 108.6° | 109.5° |
| C7 | C8 | O1 | 112.1° | 109.4° |
| C8 | C7 | H1 | 107.3° | 109.5° |
| C8 | C7 | H2 | 107.3° | 109.4° |
| C7 | C8 | H3 | 108.8° | 109.5° |
| C7 | C8 | H4 | 108.8° | 109.4° |
| O4 | C14 | H30 | 109.1° | 109.5° |
| O4 | C14 | H31 | 109.1° | 109.5° |
| C14 | O4 | H32 | 109.5° | 114.0° |
| O3 | C12 | H27 | 108.6° | 109.4° |
| O3 | C12 | H28 | 108.6° | 109.4° |
| C12 | O3 | H29 | 109.5° | 114.0° |
| O1 | C8 | H3 | 108.8° | 109.5° |
| O1 | C8 | H4 | 108.8° | 109.5° |
| C8 | O1 | H21 | 109.5° | 114.0° |
| H1 | C7 | H2 | 109.5° | 109.5° |
| H3 | C8 | H4 | 109.4° | 109.5° |
| H5 | C10 | H6 | 109.5° | 109.5° |
| H7 | C13 | H8 | 109.5° | 109.4° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.6° |
| H13 | C20 | H14 | 109.5° | 109.4° |
| H15 | C21 | H16 | 109.5° | 109.5° |
| H17 | C22 | H18 | 109.5° | 109.6° |
| H19 | C24 | H20 | 109.5° | 109.5° |
| H22 | C9 | H23 | 109.4° | 109.5° |
| H25 | C11 | H26 | 109.5° | 109.4° |
| H27 | C12 | H28 | 109.5° | 109.5° |
| H30 | C14 | H31 | 109.5° | 109.5° |
| H33 | C16 | H34 | 109.5° | 109.6° |
| H35 | C18 | H36 | 109.5° | 109.6° |
| H37 | C19 | H38 | 109.5° | 109.4° |
| H39 | C23 | H40 | 109.4° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | C16 | H11 | 120.3° | 119.9° |
| C18 | C17 | C16 | H12 | 120.3° | 119.9° |
| C17 | C18 | C19 | H35 | 120.2° | 119.9° |
| C17 | C18 | C19 | H36 | 120.2° | 120.0° |
| C18 | C17 | C16 | C15 | 42.7° | 57.7° |
| C17 | C18 | C19 | N7 | 61.2° | 59.2° |
| C18 | C17 | H11 | H12 | 119.0° | 120.2° |
| C18 | C17 | C16 | H33 | 163.4° | 177.6° |
| C18 | C17 | C16 | H34 | 78.0° | 62.3° |
| C17 | C18 | H35 | H36 | 119.3° | 120.2° |
| C17 | C18 | C19 | H37 | 179.0° | 179.2° |
| C17 | C18 | C19 | H38 | 58.7° | 60.8° |
| C16 | C17 | C18 | C19 | 47.5° | 57.7° |
| C17 | C16 | C15 | H33 | 120.7° | 119.9° |
| C17 | C16 | C15 | H34 | 120.7° | 119.9° |
| C17 | C16 | C15 | N7 | 50.8° | 59.2° |
| C17 | C16 | C15 | H9 | 69.3° | 60.8° |
| C17 | C16 | C15 | H10 | 170.8° | 179.2° |
| C16 | C17 | H11 | H12 | 119.1° | 120.1° |
| C17 | C16 | H33 | H34 | 117.9° | 120.1° |
| C16 | C17 | C18 | H35 | 72.8° | 177.5° |
| C16 | C17 | C18 | H36 | 167.7° | 62.3° |
| C18 | C19 | N7 | H37 | 119.9° | 120.0° |
| C18 | C19 | N7 | H38 | 119.8° | 120.0° |
| C18 | C19 | N7 | C15 | 69.3° | 61.7° |
| C18 | C19 | N7 | C2 | 86.1° | 174.2° |
| C19 | C18 | C17 | H11 | 72.9° | 62.2° |
| C19 | C18 | C17 | H12 | 167.8° | 177.6° |
| C19 | C18 | H35 | H36 | 119.2° | 120.1° |
| C18 | C19 | H37 | H38 | 120.4° | 120.0° |
| C16 | C15 | N7 | C19 | 63.3° | 61.8° |
| C16 | C15 | N7 | H9 | 120.1° | 120.1° |
| C16 | C15 | N7 | H10 | 120.1° | 120.0° |
| C16 | C15 | N7 | C2 | 91.3° | 174.1° |
| C16 | C15 | H9 | H10 | 119.7° | 120.0° |
| C15 | C16 | C17 | H11 | 77.6° | 62.2° |
| C15 | C16 | C17 | H12 | 163.0° | 177.6° |
| C15 | C16 | H33 | H34 | 117.9° | 120.1° |
| C23 | C22 | C21 | H17 | 120.3° | 119.9° |
| C23 | C22 | C21 | H18 | 120.3° | 119.9° |
| C22 | C23 | C24 | H39 | 120.5° | 119.9° |
| C22 | C23 | C24 | H40 | 120.5° | 119.9° |
| C23 | C22 | C21 | C20 | 40.8° | 57.6° |
| C22 | C23 | C24 | N8 | 5.9° | 59.2° |
| C23 | C22 | C21 | H15 | 161.4° | 62.3° |
| C23 | C22 | C21 | H16 | 79.7° | 177.6° |
| C23 | C22 | H17 | H18 | 119.0° | 120.1° |
| C22 | C23 | C24 | H19 | 126.3° | 60.8° |
| C22 | C23 | C24 | H20 | 114.5° | 179.2° |
| C22 | C23 | H39 | H40 | 118.5° | 120.1° |
| C21 | C22 | C23 | C24 | 52.1° | 57.7° |
| C22 | C21 | C20 | H15 | 120.5° | 119.9° |
| C22 | C21 | C20 | H16 | 120.5° | 120.1° |
| C22 | C21 | C20 | N8 | 15.0° | 59.2° |
| C22 | C21 | C20 | H13 | 135.2° | 60.9° |
| C22 | C21 | C20 | H14 | 105.2° | 179.2° |
| C22 | C21 | H15 | H16 | 118.3° | 120.2° |
| C21 | C22 | H17 | H18 | 119.0° | 120.2° |
| C21 | C22 | C23 | H39 | 68.4° | 62.3° |
| C21 | C22 | C23 | H40 | 172.6° | 177.5° |
| C19 | N7 | C15 | C2 | 154.6° | 124.1° |
| C19 | N7 | C2 | N1 | 137.6° | 124.2° |
| C19 | N7 | C2 | C1 | 29.2° | 55.7° |
| C19 | N7 | C15 | H9 | 56.8° | 58.3° |
| C19 | N7 | C15 | H10 | 176.6° | 178.3° |
| N7 | C19 | C18 | H35 | 59.0° | 179.1° |
| N7 | C19 | C18 | H36 | 178.6° | 60.8° |
| N7 | C19 | H37 | H38 | 120.4° | 120.0° |
| O2 | C10 | C9 | H5 | 119.4° | 120.0° |
| O2 | C10 | C9 | H6 | 119.4° | 120.0° |
| O2 | C10 | C9 | N5 | 177.2° | 65.0° |
| O2 | C10 | H5 | H6 | 121.8° | 120.0° |
| O2 | C10 | C9 | H22 | 61.6° | 175.0° |
| O2 | C10 | C9 | H23 | 56.0° | 55.0° |
| C23 | C24 | N8 | H19 | 120.4° | 120.0° |
| C23 | C24 | N8 | H20 | 120.4° | 120.0° |
| C23 | C24 | N8 | C5 | 118.1° | 174.1° |
| C23 | C24 | N8 | C20 | 51.9° | 61.8° |
| C24 | C23 | C22 | H17 | 68.3° | 177.6° |
| C24 | C23 | C22 | H18 | 172.4° | 62.2° |
| C23 | C24 | H19 | H20 | 118.8° | 120.0° |
| C24 | C23 | H39 | H40 | 118.5° | 120.1° |
| C21 | C20 | N8 | C24 | 63.5° | 61.7° |
| C21 | C20 | N8 | C5 | 105.6° | 174.2° |
| C21 | C20 | N8 | H13 | 120.2° | 120.0° |
| C21 | C20 | N8 | H14 | 120.2° | 120.0° |
| C21 | C20 | H13 | H14 | 119.3° | 120.0° |
| C20 | C21 | H15 | H16 | 118.3° | 120.0° |
| C20 | C21 | C22 | H17 | 79.5° | 177.5° |
| C20 | C21 | C22 | H18 | 161.2° | 62.2° |
| C10 | C9 | N5 | H22 | 121.2° | 120.0° |
| C10 | C9 | N5 | H23 | 121.2° | 120.0° |
| C10 | C9 | N5 | C3 | 90.2° | 90.0° |
| C10 | C9 | N5 | C7 | 101.8° | 89.9° |
| C9 | C10 | H5 | H6 | 121.9° | 119.9° |
| C10 | C9 | H22 | H23 | 116.3° | 120.0° |
| C9 | C10 | O2 | H24 | 180.0° | 180.0° |
| C9 | N5 | C3 | N1 | 38.7° | 0.0° |
| C9 | N5 | C3 | N2 | 137.5° | 180.0° |
| C9 | N5 | C3 | C7 | 167.1° | 179.9° |
| C9 | N5 | C7 | C8 | 146.5° | 90.0° |
| C9 | N5 | C7 | H1 | 25.3° | 150.0° |
| C9 | N5 | C7 | H2 | 92.3° | 29.9° |
| N5 | C9 | C10 | H5 | 57.8° | 175.0° |
| N5 | C9 | C10 | H6 | 63.4° | 55.0° |
| N5 | C9 | H22 | H23 | 116.3° | 119.9° |
| C15 | N7 | C2 | N1 | 13.6° | 0.0° |
| C15 | N7 | C2 | C1 | 179.5° | 180.0° |
| N7 | C15 | H9 | H10 | 119.7° | 119.9° |
| N7 | C15 | C16 | H33 | 171.4° | 179.1° |
| N7 | C15 | C16 | H34 | 69.9° | 60.7° |
| C15 | N7 | C19 | H37 | 170.9° | 178.3° |
| C15 | N7 | C19 | H38 | 50.6° | 58.3° |
| N7 | C2 | N1 | C1 | 167.2° | 180.0° |
| N7 | C2 | N1 | C3 | 173.2° | 180.0° |
| N7 | C2 | C1 | N4 | 14.9° | 0.1° |
| N7 | C2 | C1 | C4 | 169.2° | 180.0° |
| C2 | N7 | C15 | H9 | 148.6° | 65.8° |
| C2 | N7 | C15 | H10 | 28.8° | 54.2° |
| C2 | N7 | C19 | H37 | 33.8° | 54.1° |
| C2 | N7 | C19 | H38 | 154.1° | 65.8° |
| N1 | C2 | C1 | N4 | 178.6° | 179.9° |
| N1 | C2 | C1 | C4 | 2.7° | 0.1° |
| C2 | N1 | C3 | N2 | 7.9° | 0.0° |
| C2 | N1 | C3 | N5 | 176.3° | 180.0° |
| C1 | C2 | N1 | C3 | 6.0° | 0.0° |
| C2 | C1 | N4 | C4 | 175.8° | 179.9° |
| C2 | C1 | N4 | C6 | 177.9° | 179.9° |
| C2 | C1 | C4 | N2 | 0.5° | 0.1° |
| C2 | C1 | C4 | C5 | 177.9° | 180.0° |
| N1 | C3 | N2 | N5 | 175.8° | 180.0° |
| N1 | C3 | N2 | C4 | 5.6° | 0.0° |
| N1 | C3 | N5 | C7 | 154.2° | 180.0° |
| C1 | N4 | C6 | N6 | 175.7° | 180.0° |
| C1 | N4 | C6 | N3 | 3.2° | 0.0° |
| N4 | C1 | C4 | N2 | 176.5° | 180.0° |
| N4 | C1 | C4 | C5 | 2.0° | 0.1° |
| C4 | C1 | N4 | C6 | 2.1° | 0.1° |
| C1 | C4 | N2 | C3 | 1.8° | 0.0° |
| C1 | C4 | N2 | C5 | 178.4° | 180.0° |
| C1 | C4 | C5 | N3 | 2.9° | 0.0° |
| C1 | C4 | C5 | N8 | 174.1° | 180.0° |
| N4 | C6 | N6 | C13 | 9.3° | 0.0° |
| N4 | C6 | N6 | N3 | 173.1° | 180.0° |
| N4 | C6 | N6 | C11 | 159.1° | 180.0° |
| N4 | C6 | N3 | C5 | 4.2° | 0.0° |
| N6 | C13 | C14 | H7 | 120.4° | 120.0° |
| N6 | C13 | C14 | H8 | 120.4° | 120.0° |
| C13 | N6 | C6 | C11 | 168.3° | 180.0° |
| C13 | N6 | C6 | N3 | 177.6° | 180.0° |
| C13 | N6 | C11 | C12 | 97.1° | 90.0° |
| N6 | C13 | C14 | O4 | 130.1° | 65.0° |
| N6 | C13 | H7 | H8 | 118.7° | 120.0° |
| C13 | N6 | C11 | H25 | 142.0° | 30.0° |
| C13 | N6 | C11 | H26 | 23.9° | 149.9° |
| N6 | C13 | C14 | H30 | 9.8° | 175.0° |
| N6 | C13 | C14 | H31 | 109.7° | 55.0° |
| C14 | C13 | N6 | C6 | 103.8° | 90.0° |
| C14 | C13 | N6 | C11 | 65.0° | 90.0° |
| C13 | C14 | O4 | H30 | 120.2° | 119.9° |
| C13 | C14 | O4 | H31 | 120.2° | 120.0° |
| C14 | C13 | H7 | H8 | 118.7° | 120.0° |
| C13 | C14 | H30 | H31 | 119.3° | 120.0° |
| C13 | C14 | O4 | H32 | 180.0° | 180.0° |
| N6 | C6 | N3 | C5 | 176.8° | 180.0° |
| C6 | N6 | C11 | C12 | 71.9° | 90.0° |
| C6 | N6 | C13 | H7 | 135.7° | 150.0° |
| C6 | N6 | C13 | H8 | 16.6° | 30.0° |
| C6 | N6 | C11 | H25 | 49.1° | 150.0° |
| C6 | N6 | C11 | H26 | 167.1° | 30.1° |
| C6 | N3 | C5 | C4 | 3.9° | 0.0° |
| N3 | C6 | N6 | C11 | 14.0° | 0.1° |
| C6 | N3 | C5 | N8 | 173.3° | 180.0° |
| C3 | N2 | C4 | C5 | 176.6° | 180.0° |
| N2 | C3 | N5 | C7 | 29.6° | 0.1° |
| N5 | C3 | N2 | C4 | 178.6° | 180.0° |
| C3 | N5 | C7 | C8 | 46.0° | 90.0° |
| C3 | N5 | C7 | H1 | 167.2° | 30.0° |
| C3 | N5 | C7 | H2 | 75.2° | 150.0° |
| C3 | N5 | C9 | H22 | 148.6° | 30.1° |
| C3 | N5 | C9 | H23 | 31.0° | 150.0° |
| N2 | C4 | C5 | N3 | 175.6° | 180.0° |
| N2 | C4 | C5 | N8 | 7.5° | 0.0° |
| C4 | C5 | N8 | C24 | 164.6° | 180.0° |
| C4 | C5 | N3 | N8 | 177.2° | 180.0° |
| C4 | C5 | N8 | C20 | 3.6° | 55.8° |
| C24 | N8 | C5 | N3 | 12.4° | 0.0° |
| C24 | N8 | C5 | C20 | 168.2° | 124.2° |
| C24 | N8 | C20 | H13 | 176.3° | 58.3° |
| C24 | N8 | C20 | H14 | 56.7° | 178.2° |
| N8 | C24 | H19 | H20 | 118.8° | 119.9° |
| N8 | C24 | C23 | H39 | 114.6° | 60.7° |
| N8 | C24 | C23 | H40 | 126.4° | 179.1° |
| N5 | C7 | C8 | H1 | 121.2° | 120.0° |
| N5 | C7 | C8 | H2 | 121.2° | 120.0° |
| N5 | C7 | C8 | O1 | 70.8° | 65.0° |
| N5 | C7 | H1 | H2 | 116.2° | 120.0° |
| N5 | C7 | C8 | H3 | 168.8° | 175.0° |
| N5 | C7 | C8 | H4 | 49.6° | 55.0° |
| C7 | N5 | C9 | H22 | 19.3° | 150.0° |
| C7 | N5 | C9 | H23 | 137.0° | 30.1° |
| N6 | C11 | C12 | H25 | 121.0° | 120.0° |
| N6 | C11 | C12 | H26 | 121.0° | 120.0° |
| N6 | C11 | C12 | O3 | 62.3° | 65.0° |
| C11 | N6 | C13 | H7 | 55.4° | 30.0° |
| C11 | N6 | C13 | H8 | 174.6° | 150.0° |
| N6 | C11 | H25 | H26 | 117.0° | 119.9° |
| N6 | C11 | C12 | H27 | 177.1° | 175.1° |
| N6 | C11 | C12 | H28 | 58.2° | 55.0° |
| N3 | C5 | N8 | C20 | 179.4° | 124.2° |
| C5 | N8 | C20 | H13 | 14.6° | 65.8° |
| C5 | N8 | C20 | H14 | 134.1° | 54.2° |
| C5 | N8 | C24 | H19 | 121.6° | 65.8° |
| C5 | N8 | C24 | H20 | 2.3° | 54.2° |
| N8 | C20 | H13 | H14 | 119.3° | 120.0° |
| N8 | C20 | C21 | H15 | 105.5° | 60.8° |
| N8 | C20 | C21 | H16 | 135.5° | 179.2° |
| C20 | N8 | C24 | H19 | 68.4° | 58.2° |
| C20 | N8 | C24 | H20 | 172.4° | 178.2° |
| C11 | C12 | O3 | H27 | 120.5° | 120.0° |
| C11 | C12 | O3 | H28 | 120.5° | 120.0° |
| C12 | C11 | H25 | H26 | 116.9° | 120.0° |
| C11 | C12 | H27 | H28 | 118.4° | 120.1° |
| C11 | C12 | O3 | H29 | 180.0° | 180.0° |
| C7 | C8 | O1 | H3 | 120.4° | 120.0° |
| C7 | C8 | O1 | H4 | 120.4° | 119.9° |
| C8 | C7 | H1 | H2 | 116.2° | 119.9° |
| C7 | C8 | H3 | H4 | 118.8° | 120.0° |
| C7 | C8 | O1 | H21 | 180.0° | 180.0° |
| O4 | C14 | C13 | H7 | 109.5° | 55.0° |
| O4 | C14 | C13 | H8 | 9.7° | 175.0° |
| O4 | C14 | H30 | H31 | 119.3° | 120.1° |
| O3 | C12 | C11 | H25 | 58.6° | 55.0° |
| O3 | C12 | C11 | H26 | 176.7° | 174.9° |
| O3 | C12 | H27 | H28 | 118.4° | 119.9° |
| O1 | C8 | C7 | H1 | 50.4° | 175.0° |
| O1 | C8 | C7 | H2 | 168.0° | 55.0° |
| O1 | C8 | H3 | H4 | 118.8° | 120.0° |
| H1 | C7 | C8 | H3 | 70.0° | 55.0° |
| H1 | C7 | C8 | H4 | 170.8° | 65.1° |
| H2 | C7 | C8 | H3 | 47.6° | 65.0° |
| H2 | C7 | C8 | H4 | 71.6° | 174.9° |
| H3 | C8 | O1 | H21 | 59.6° | 60.0° |
| H4 | C8 | O1 | H21 | 59.6° | 60.0° |
| H5 | C10 | C9 | H22 | 179.0° | 55.0° |
| H5 | C10 | C9 | H23 | 63.3° | 65.0° |
| H5 | C10 | O2 | H24 | 60.6° | 60.0° |
| H6 | C10 | C9 | H22 | 57.7° | 65.0° |
| H6 | C10 | C9 | H23 | 175.4° | 175.0° |
| H6 | C10 | O2 | H24 | 60.6° | 60.0° |
| H7 | C13 | C14 | H30 | 130.3° | 65.0° |
| H7 | C13 | C14 | H31 | 10.7° | 175.0° |
| H8 | C13 | C14 | H30 | 110.6° | 55.0° |
| H8 | C13 | C14 | H31 | 129.9° | 65.0° |
| H9 | C15 | C16 | H33 | 51.3° | 59.1° |
| H9 | C15 | C16 | H34 | 170.0° | 179.2° |
| H10 | C15 | C16 | H33 | 68.5° | 60.9° |
| H10 | C15 | C16 | H34 | 50.1° | 59.2° |
| H11 | C17 | C16 | H33 | 43.1° | 57.7° |
| H11 | C17 | C16 | H34 | 161.7° | 177.8° |
| H11 | C17 | C18 | H35 | 166.9° | 57.7° |
| H11 | C17 | C18 | H36 | 47.4° | 177.8° |
| H12 | C17 | C16 | H33 | 76.3° | 62.5° |
| H12 | C17 | C16 | H34 | 42.3° | 57.6° |
| H12 | C17 | C18 | H35 | 47.6° | 62.6° |
| H12 | C17 | C18 | H36 | 72.0° | 57.6° |
| H13 | C20 | C21 | H15 | 14.7° | 179.2° |
| H13 | C20 | C21 | H16 | 104.3° | 59.2° |
| H14 | C20 | C21 | H15 | 134.2° | 59.3° |
| H14 | C20 | C21 | H16 | 15.3° | 60.7° |
| H15 | C21 | C22 | H17 | 41.0° | 57.6° |
| H15 | C21 | C22 | H18 | 78.3° | 177.9° |
| H16 | C21 | C22 | H17 | 160.0° | 62.5° |
| H16 | C21 | C22 | H18 | 40.6° | 57.8° |
| H17 | C22 | C23 | H39 | 171.2° | 57.6° |
| H17 | C22 | C23 | H40 | 52.2° | 62.6° |
| H18 | C22 | C23 | H39 | 51.9° | 177.8° |
| H18 | C22 | C23 | H40 | 67.1° | 57.6° |
| H19 | C24 | C23 | H39 | 5.8° | 179.3° |
| H19 | C24 | C23 | H40 | 113.2° | 59.1° |
| H20 | C24 | C23 | H39 | 125.0° | 59.3° |
| H20 | C24 | C23 | H40 | 6.0° | 60.9° |
| H25 | C11 | C12 | H27 | 61.9° | 65.0° |
| H25 | C11 | C12 | H28 | 179.2° | 174.9° |
| H26 | C11 | C12 | H27 | 56.2° | 55.0° |
| H26 | C11 | C12 | H28 | 62.8° | 65.1° |
| H27 | C12 | O3 | H29 | 59.5° | 60.0° |
| H28 | C12 | O3 | H29 | 59.5° | 60.0° |
| H30 | C14 | O4 | H32 | 59.8° | 60.1° |
| H31 | C14 | O4 | H32 | 59.8° | 60.0° |
| H35 | C18 | C19 | H37 | 60.8° | 60.9° |
| H35 | C18 | C19 | H38 | 178.9° | 59.1° |
| H36 | C18 | C19 | H37 | 58.7° | 59.2° |
| H36 | C18 | C19 | H38 | 61.6° | 179.2° |
