A1DI6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C21 | N7 | sing | 1.47Å | 1.48Å | |
| C22 | C14 | sing | 1.54Å | 1.53Å | |
| C22 | N6 | sing | 1.48Å | 1.48Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.51Å | 1.53Å | |
| C14 | N7 | sing | 1.47Å | 1.46Å | |
| C14 | C13 | sing | 1.54Å | 1.53Å | |
| C20 | N8 | sing | 1.47Å | 1.48Å | |
| N6 | C13 | sing | 1.48Å | 1.48Å | |
| N6 | C12 | sing | 1.39Å | 1.34Å | |
| N7 | C15 | sing | 1.47Å | 1.48Å | |
| C17 | N8 | sing | 1.35Å | 1.34Å | |
| C17 | O1 | doub | 1.21Å | 1.23Å | |
| N8 | C16 | sing | 1.47Å | 1.47Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C8 | N3 | sing | 1.47Å | 1.48Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C23 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C23 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | N5 | sing | 1.33Å | 1.34Å | Aromatic |
| N3 | C9 | sing | 1.39Å | 1.36Å | |
| N3 | C24 | sing | 1.47Å | 1.48Å | |
| C9 | N4 | doub | 1.33Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| N5 | C10 | doub | 1.32Å | 1.34Å | Aromatic |
| N4 | C10 | sing | 1.32Å | 1.34Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.39Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| F1 | C11 | sing | 1.40Å | 1.33Å | |
| C6 | C25 | sing | 1.53Å | 1.53Å | |
| C6 | C5 | sing | 1.51Å | 1.56Å | |
| C11 | F2 | sing | 1.40Å | 1.33Å | |
| C11 | F3 | sing | 1.40Å | 1.33Å | |
| C1 | N1 | sing | 1.47Å | 1.48Å | |
| C5 | N1 | sing | 1.35Å | 1.33Å | Aromatic |
| C5 | C3 | doub | 1.35Å | 1.39Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.34Å | Aromatic |
| C3 | C4 | sing | 1.51Å | 1.53Å | |
| C3 | C2 | sing | 1.40Å | 1.39Å | Aromatic |
| N2 | C2 | doub | 1.31Å | 1.33Å | Aromatic |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H12 | sing | 1.08Å | 1.08Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C15 | H28 | sing | 1.09Å | 1.10Å | |
| C15 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H30 | sing | 1.09Å | 1.10Å | |
| C16 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C19 | H34 | sing | 1.09Å | 1.10Å | |
| C19 | H35 | sing | 1.09Å | 1.10Å | |
| C19 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C21 | N7 | 108.4° | 109.3° |
| C21 | C20 | N8 | 114.1° | 108.6° |
| C20 | C21 | H24 | 109.7° | 109.5° |
| C20 | C21 | H25 | 109.7° | 109.6° |
| C21 | C20 | H26 | 108.3° | 109.6° |
| C21 | C20 | H27 | 108.3° | 109.6° |
| C21 | N7 | C14 | 106.6° | 111.0° |
| C21 | N7 | C15 | 106.0° | 111.3° |
| N7 | C21 | H24 | 109.7° | 109.5° |
| N7 | C21 | H25 | 109.7° | 109.4° |
| C14 | C22 | N6 | 91.5° | 86.2° |
| C22 | C14 | N7 | 111.6° | 113.7° |
| C22 | C14 | C13 | 86.6° | 86.3° |
| C22 | C14 | H4 | 112.9° | 113.9° |
| C14 | C22 | H21 | 113.8° | 113.8° |
| C14 | C22 | H22 | 113.8° | 113.7° |
| C22 | N6 | C13 | 89.9° | 90.8° |
| C22 | N6 | C12 | 131.5° | 111.0° |
| N6 | C22 | H21 | 113.7° | 113.8° |
| N6 | C22 | H22 | 113.8° | 113.8° |
| C19 | C18 | C17 | 113.2° | 109.5° |
| C19 | C18 | H32 | 108.6° | 109.5° |
| C19 | C18 | H33 | 108.5° | 109.5° |
| C18 | C19 | H34 | 109.5° | 109.5° |
| C18 | C19 | H35 | 109.5° | 109.5° |
| C18 | C19 | H36 | 109.5° | 109.5° |
| C18 | C17 | N8 | 118.0° | 120.0° |
| C18 | C17 | O1 | 120.1° | 120.0° |
| C17 | C18 | H32 | 108.5° | 109.4° |
| C17 | C18 | H33 | 108.5° | 109.4° |
| N7 | C14 | C13 | 115.6° | 113.7° |
| C14 | N7 | C15 | 105.8° | 111.0° |
| N7 | C14 | H4 | 114.2° | 112.9° |
| C14 | C13 | N6 | 91.6° | 86.2° |
| C13 | C14 | H4 | 113.0° | 113.8° |
| C14 | C13 | H10 | 113.7° | 113.8° |
| C14 | C13 | H11 | 113.7° | 113.8° |
| C20 | N8 | C17 | 126.6° | 120.9° |
| C20 | N8 | C16 | 114.4° | 118.2° |
| N8 | C20 | H26 | 108.3° | 109.6° |
| N8 | C20 | H27 | 108.3° | 109.7° |
| C13 | N6 | C12 | 127.1° | 111.0° |
| N6 | C13 | H10 | 113.7° | 113.8° |
| N6 | C13 | H11 | 113.7° | 113.8° |
| N6 | C12 | C23 | 120.6° | 120.5° |
| N6 | C12 | N5 | 119.9° | 120.5° |
| N7 | C15 | C16 | 112.0° | 109.3° |
| N7 | C15 | H28 | 108.8° | 109.5° |
| N7 | C15 | H29 | 108.8° | 109.5° |
| N8 | C17 | O1 | 121.9° | 120.0° |
| C17 | N8 | C16 | 119.0° | 120.9° |
| N8 | C16 | C15 | 107.1° | 108.5° |
| N8 | C16 | H30 | 110.1° | 109.6° |
| N8 | C16 | H31 | 110.0° | 109.7° |
| C16 | C15 | H28 | 108.8° | 109.5° |
| C16 | C15 | H29 | 108.9° | 109.5° |
| C15 | C16 | H30 | 110.0° | 109.7° |
| C15 | C16 | H31 | 110.1° | 109.6° |
| N3 | C8 | C7 | 106.3° | 109.6° |
| C8 | N3 | C9 | 123.7° | 111.0° |
| C8 | N3 | C24 | 113.2° | 111.2° |
| N3 | C8 | H8 | 110.3° | 109.5° |
| N3 | C8 | H9 | 110.3° | 109.5° |
| C8 | C7 | C6 | 109.9° | 109.3° |
| C8 | C7 | H6 | 109.4° | 109.6° |
| C8 | C7 | H7 | 109.4° | 109.5° |
| C7 | C8 | H8 | 110.2° | 109.4° |
| C7 | C8 | H9 | 110.3° | 109.5° |
| C12 | C23 | C9 | 118.5° | 118.3° |
| C23 | C12 | N5 | 119.5° | 119.0° |
| C12 | C23 | H20 | 120.7° | 120.9° |
| C23 | C9 | N3 | 122.4° | 120.5° |
| C23 | C9 | N4 | 118.4° | 119.1° |
| C9 | C23 | H20 | 120.8° | 120.9° |
| C12 | N5 | C10 | 121.9° | 120.9° |
| C9 | N3 | C24 | 121.6° | 111.0° |
| N3 | C9 | N4 | 119.2° | 120.5° |
| N3 | C24 | C25 | 107.4° | 109.5° |
| N3 | C24 | H18 | 110.0° | 109.5° |
| N3 | C24 | H19 | 110.0° | 109.4° |
| C9 | N4 | C10 | 122.6° | 120.8° |
| C7 | C6 | C25 | 114.0° | 109.2° |
| C7 | C6 | C5 | 109.5° | 109.5° |
| C7 | C6 | H5 | 107.7° | 109.5° |
| C6 | C7 | H6 | 109.4° | 109.5° |
| C6 | C7 | H7 | 109.4° | 109.5° |
| N5 | C10 | N4 | 119.1° | 121.9° |
| N5 | C10 | C11 | 121.3° | 119.1° |
| N4 | C10 | C11 | 119.5° | 119.0° |
| C10 | C11 | F1 | 109.6° | 109.5° |
| C10 | C11 | F2 | 113.2° | 109.5° |
| C10 | C11 | F3 | 112.6° | 109.5° |
| C24 | C25 | C6 | 106.1° | 109.3° |
| C24 | C25 | H16 | 110.3° | 109.5° |
| C24 | C25 | H17 | 110.3° | 109.6° |
| C25 | C24 | H18 | 110.0° | 109.5° |
| C25 | C24 | H19 | 110.0° | 109.4° |
| F1 | C11 | F2 | 106.9° | 109.4° |
| F1 | C11 | F3 | 106.1° | 109.5° |
| C25 | C6 | C5 | 110.4° | 109.5° |
| C25 | C6 | H5 | 107.7° | 109.5° |
| C6 | C25 | H16 | 110.3° | 109.4° |
| C6 | C25 | H17 | 110.3° | 109.5° |
| C6 | C5 | N1 | 124.2° | 126.1° |
| C6 | C5 | C3 | 129.1° | 126.1° |
| C5 | C6 | H5 | 107.4° | 109.5° |
| F2 | C11 | F3 | 108.1° | 109.5° |
| C1 | N1 | C5 | 130.3° | 126.0° |
| C1 | N1 | N2 | 120.3° | 126.1° |
| N1 | C1 | H13 | 109.5° | 109.4° |
| N1 | C1 | H14 | 109.5° | 109.5° |
| N1 | C1 | H15 | 109.5° | 109.5° |
| N1 | C5 | C3 | 106.7° | 107.8° |
| C5 | N1 | N2 | 109.4° | 107.9° |
| C5 | C3 | C4 | 128.8° | 126.0° |
| C5 | C3 | C2 | 107.4° | 107.9° |
| N1 | N2 | C2 | 110.0° | 108.2° |
| C4 | C3 | C2 | 123.8° | 126.0° |
| C3 | C4 | H1 | 109.5° | 109.5° |
| C3 | C4 | H2 | 109.5° | 109.5° |
| C3 | C4 | H3 | 109.5° | 109.5° |
| C3 | C2 | N2 | 106.5° | 108.2° |
| C3 | C2 | H12 | 126.7° | 125.9° |
| N2 | C2 | H12 | 126.7° | 125.9° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H1 | C4 | H3 | 109.4° | 109.4° |
| H2 | C4 | H3 | 109.5° | 109.5° |
| H6 | C7 | H7 | 109.5° | 109.5° |
| H8 | C8 | H9 | 109.5° | 109.4° |
| H10 | C13 | H11 | 109.5° | 112.9° |
| H13 | C1 | H14 | 109.4° | 109.5° |
| H13 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H15 | 109.4° | 109.5° |
| H16 | C25 | H17 | 109.5° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.5° |
| H21 | C22 | H22 | 109.5° | 113.0° |
| H24 | C21 | H25 | 109.5° | 109.5° |
| H26 | C20 | H27 | 109.5° | 109.7° |
| H28 | C15 | H29 | 109.5° | 109.5° |
| H30 | C16 | H31 | 109.5° | 109.6° |
| H32 | C18 | H33 | 109.5° | 109.5° |
| H34 | C19 | H35 | 109.5° | 109.5° |
| H34 | C19 | H36 | 109.5° | 109.5° |
| H35 | C19 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C21 | N7 | H24 | 119.8° | 120.0° |
| C20 | C21 | N7 | H25 | 119.8° | 120.0° |
| C20 | C21 | N7 | C14 | 173.9° | 172.7° |
| C21 | C20 | N8 | H26 | 120.7° | 119.7° |
| C21 | C20 | N8 | H27 | 120.7° | 119.7° |
| C20 | C21 | N7 | C15 | 61.5° | 63.1° |
| C21 | C20 | N8 | C17 | 134.7° | 128.8° |
| C21 | C20 | N8 | C16 | 48.6° | 51.2° |
| C20 | C21 | H24 | H25 | 120.5° | 120.2° |
| C21 | C20 | H26 | H27 | 117.9° | 120.4° |
| C21 | N7 | C14 | C22 | 80.7° | 36.0° |
| C21 | N7 | C14 | C15 | 112.5° | 124.3° |
| C21 | N7 | C14 | C13 | 177.5° | 60.7° |
| N7 | C21 | C20 | N8 | 53.8° | 53.9° |
| C21 | N7 | C15 | C16 | 68.4° | 63.1° |
| C21 | N7 | C14 | H4 | 48.9° | 167.7° |
| N7 | C21 | H24 | H25 | 120.5° | 120.0° |
| N7 | C21 | C20 | H26 | 174.5° | 173.6° |
| N7 | C21 | C20 | H27 | 66.9° | 65.9° |
| C21 | N7 | C15 | H28 | 171.2° | 176.9° |
| C21 | N7 | C15 | H29 | 52.0° | 56.8° |
| C14 | C22 | N6 | H21 | 116.9° | 114.3° |
| C14 | C22 | N6 | H22 | 116.9° | 114.3° |
| C22 | C14 | N7 | C13 | 96.8° | 96.7° |
| C22 | C14 | N7 | H4 | 129.6° | 131.7° |
| C22 | C14 | C13 | H4 | 113.5° | 114.5° |
| C14 | C22 | N6 | C13 | 4.4° | 24.7° |
| C14 | C22 | N6 | C12 | 148.0° | 137.6° |
| C22 | C14 | N7 | C15 | 166.8° | 88.3° |
| C22 | C14 | C13 | H10 | 121.2° | 138.1° |
| C22 | C14 | C13 | H11 | 112.6° | 90.7° |
| C14 | C22 | H21 | H22 | 128.5° | 131.7° |
| N6 | C22 | C14 | N7 | 120.5° | 138.1° |
| C22 | N6 | C13 | C12 | 146.1° | 112.9° |
| C22 | N6 | C12 | C23 | 14.3° | 81.3° |
| C22 | N6 | C12 | N5 | 164.5° | 99.3° |
| N6 | C22 | C14 | H4 | 109.2° | 90.7° |
| C22 | N6 | C13 | H10 | 121.3° | 139.1° |
| C22 | N6 | C13 | H11 | 112.4° | 89.7° |
| N6 | C22 | H21 | H22 | 128.5° | 131.8° |
| C19 | C18 | C17 | H32 | 120.6° | 120.0° |
| C19 | C18 | C17 | H33 | 120.5° | 120.0° |
| C19 | C18 | C17 | N8 | 119.3° | 180.0° |
| C19 | C18 | C17 | O1 | 59.3° | 0.0° |
| C19 | C18 | H32 | H33 | 118.3° | 120.1° |
| C18 | C19 | H34 | H35 | 120.0° | 120.1° |
| C18 | C19 | H34 | H36 | 120.0° | 120.0° |
| C18 | C19 | H35 | H36 | 120.0° | 120.0° |
| C18 | C17 | N8 | C20 | 5.1° | 180.0° |
| C18 | C17 | N8 | O1 | 178.6° | 180.0° |
| C18 | C17 | N8 | C16 | 178.3° | 0.0° |
| C17 | C18 | H32 | H33 | 118.3° | 119.9° |
| C17 | C18 | C19 | H34 | 180.0° | 180.0° |
| C17 | C18 | C19 | H35 | 60.0° | 60.0° |
| C17 | C18 | C19 | H36 | 60.0° | 60.0° |
| N7 | C14 | C13 | H4 | 134.1° | 131.2° |
| N7 | C14 | C13 | N6 | 116.7° | 138.0° |
| C14 | N7 | C15 | C16 | 178.7° | 172.7° |
| N7 | C14 | C13 | H10 | 126.4° | 107.6° |
| N7 | C14 | C13 | H11 | 0.2° | 23.6° |
| N7 | C14 | C22 | H21 | 3.7° | 23.7° |
| N7 | C14 | C22 | H22 | 122.6° | 107.6° |
| C14 | N7 | C21 | H24 | 66.3° | 67.3° |
| C14 | N7 | C21 | H25 | 54.0° | 52.8° |
| C14 | N7 | C15 | H28 | 58.3° | 52.8° |
| C14 | N7 | C15 | H29 | 60.9° | 67.3° |
| C14 | C13 | N6 | H10 | 116.9° | 114.4° |
| C14 | C13 | N6 | H11 | 116.9° | 114.4° |
| C14 | C13 | N6 | C12 | 150.6° | 137.6° |
| C13 | C14 | N7 | C15 | 70.0° | 175.0° |
| C14 | C13 | H10 | H11 | 128.4° | 131.7° |
| C13 | C14 | C22 | H21 | 112.5° | 90.6° |
| C13 | C14 | C22 | H22 | 121.2° | 138.1° |
| C20 | N8 | C17 | C16 | 176.6° | 180.0° |
| C20 | N8 | C17 | O1 | 173.5° | 0.0° |
| C20 | N8 | C16 | C15 | 49.1° | 51.2° |
| N8 | C20 | C21 | H24 | 173.6° | 66.1° |
| N8 | C20 | C21 | H25 | 66.1° | 173.8° |
| N8 | C20 | H26 | H27 | 117.9° | 120.6° |
| C20 | N8 | C16 | H30 | 168.7° | 68.6° |
| C20 | N8 | C16 | H31 | 70.5° | 171.0° |
| C13 | N6 | C12 | C23 | 146.2° | 179.3° |
| C13 | N6 | C12 | N5 | 32.6° | 0.1° |
| N6 | C13 | C14 | H4 | 109.2° | 90.8° |
| N6 | C13 | H10 | H11 | 128.5° | 131.7° |
| C13 | N6 | C22 | H21 | 112.4° | 89.6° |
| C13 | N6 | C22 | H22 | 121.3° | 139.0° |
| N6 | C12 | C23 | N5 | 178.9° | 179.3° |
| N6 | C12 | C23 | C9 | 179.9° | 179.8° |
| N6 | C12 | N5 | C10 | 178.9° | 180.0° |
| C12 | N6 | C13 | H10 | 92.5° | 108.0° |
| C12 | N6 | C13 | H11 | 33.7° | 23.3° |
| N6 | C12 | C23 | H20 | 0.1° | 0.1° |
| C12 | N6 | C22 | H21 | 31.2° | 23.3° |
| C12 | N6 | C22 | H22 | 95.1° | 108.1° |
| N7 | C15 | C16 | N8 | 60.7° | 53.9° |
| N7 | C15 | C16 | H28 | 120.3° | 120.0° |
| N7 | C15 | C16 | H29 | 120.4° | 120.0° |
| C15 | N7 | C14 | H4 | 63.6° | 43.4° |
| C15 | N7 | C21 | H24 | 178.6° | 56.9° |
| C15 | N7 | C21 | H25 | 58.3° | 176.9° |
| N7 | C15 | H28 | H29 | 118.8° | 120.1° |
| N7 | C15 | C16 | H30 | 179.6° | 65.9° |
| N7 | C15 | C16 | H31 | 58.9° | 173.7° |
| C17 | N8 | C16 | C15 | 133.9° | 128.8° |
| C17 | N8 | C20 | H26 | 14.0° | 9.1° |
| C17 | N8 | C20 | H27 | 104.6° | 111.4° |
| C17 | N8 | C16 | H30 | 14.3° | 111.4° |
| C17 | N8 | C16 | H31 | 106.5° | 9.0° |
| N8 | C17 | C18 | H32 | 1.3° | 60.0° |
| N8 | C17 | C18 | H33 | 120.2° | 60.0° |
| O1 | C17 | N8 | C16 | 3.1° | 180.0° |
| O1 | C17 | C18 | H32 | 179.9° | 120.0° |
| O1 | C17 | C18 | H33 | 61.2° | 120.0° |
| N8 | C16 | C15 | H30 | 119.6° | 119.8° |
| N8 | C16 | C15 | H31 | 119.6° | 119.8° |
| C16 | N8 | C20 | H26 | 169.2° | 170.9° |
| C16 | N8 | C20 | H27 | 72.1° | 68.5° |
| N8 | C16 | C15 | H28 | 178.9° | 173.8° |
| N8 | C16 | C15 | H29 | 59.7° | 66.1° |
| N8 | C16 | H30 | H31 | 121.1° | 120.5° |
| C16 | C15 | H28 | H29 | 118.9° | 120.1° |
| C15 | C16 | H30 | H31 | 121.1° | 120.4° |
| N3 | C8 | C7 | H8 | 119.5° | 120.1° |
| N3 | C8 | C7 | H9 | 119.5° | 120.0° |
| C8 | N3 | C9 | C23 | 4.9° | 179.7° |
| C8 | N3 | C9 | C24 | 165.4° | 124.2° |
| C8 | N3 | C9 | N4 | 173.3° | 0.0° |
| N3 | C8 | C7 | C6 | 54.7° | 59.1° |
| C8 | N3 | C24 | C25 | 68.4° | 61.8° |
| N3 | C8 | C7 | H6 | 65.3° | 179.2° |
| N3 | C8 | C7 | H7 | 174.7° | 60.7° |
| N3 | C8 | H8 | H9 | 121.5° | 120.0° |
| C8 | N3 | C24 | H18 | 51.2° | 58.3° |
| C8 | N3 | C24 | H19 | 171.9° | 178.3° |
| C7 | C8 | N3 | C9 | 102.1° | 62.4° |
| C7 | C8 | N3 | C24 | 64.4° | 61.8° |
| C8 | C7 | C6 | H6 | 120.0° | 120.0° |
| C8 | C7 | C6 | H7 | 120.1° | 119.9° |
| C8 | C7 | C6 | C25 | 55.2° | 57.6° |
| C8 | C7 | C6 | C5 | 179.3° | 177.5° |
| C8 | C7 | C6 | H5 | 64.2° | 62.3° |
| C8 | C7 | H6 | H7 | 119.9° | 120.1° |
| C7 | C8 | H8 | H9 | 121.4° | 119.9° |
| C12 | C23 | C9 | H20 | 180.0° | 179.9° |
| C12 | C23 | C9 | N3 | 179.7° | 179.8° |
| C12 | C23 | C9 | N4 | 1.5° | 0.0° |
| C23 | C12 | N5 | C10 | 0.0° | 0.7° |
| C9 | C23 | C12 | N5 | 1.0° | 0.4° |
| C23 | C9 | N3 | N4 | 178.2° | 179.7° |
| C23 | C9 | N3 | C24 | 170.3° | 56.1° |
| C23 | C9 | N4 | C10 | 0.9° | 0.2° |
| C12 | N5 | C10 | N4 | 0.5° | 0.5° |
| C12 | N5 | C10 | C11 | 178.8° | 179.5° |
| N5 | C12 | C23 | H20 | 179.0° | 179.5° |
| N3 | C9 | N4 | C10 | 179.2° | 180.0° |
| C9 | N3 | C24 | C25 | 98.4° | 62.3° |
| C9 | N3 | C8 | H8 | 17.4° | 177.6° |
| C9 | N3 | C8 | H9 | 138.3° | 57.7° |
| C9 | N3 | C24 | H18 | 141.9° | 177.6° |
| C9 | N3 | C24 | H19 | 21.3° | 57.6° |
| N3 | C9 | C23 | H20 | 0.3° | 0.3° |
| C24 | N3 | C9 | N4 | 7.9° | 124.2° |
| N3 | C24 | C25 | H18 | 119.7° | 120.0° |
| N3 | C24 | C25 | H19 | 119.7° | 120.0° |
| N3 | C24 | C25 | C6 | 59.5° | 59.2° |
| C24 | N3 | C8 | H8 | 176.1° | 58.3° |
| C24 | N3 | C8 | H9 | 55.1° | 178.2° |
| N3 | C24 | C25 | H16 | 179.0° | 60.7° |
| N3 | C24 | C25 | H17 | 60.0° | 179.2° |
| N3 | C24 | H18 | H19 | 121.0° | 120.0° |
| C9 | N4 | C10 | N5 | 0.0° | 0.0° |
| C9 | N4 | C10 | C11 | 178.3° | 180.0° |
| N4 | C9 | C23 | H20 | 178.5° | 179.9° |
| C7 | C6 | C25 | C24 | 56.4° | 57.6° |
| C7 | C6 | C25 | C5 | 123.7° | 120.0° |
| C7 | C6 | C25 | H5 | 119.4° | 119.9° |
| C7 | C6 | C5 | H5 | 116.7° | 120.2° |
| C7 | C6 | C5 | N1 | 117.6° | 126.3° |
| C7 | C6 | C5 | C3 | 62.9° | 54.0° |
| C6 | C7 | H6 | H7 | 119.8° | 120.0° |
| C6 | C7 | C8 | H8 | 174.2° | 60.9° |
| C6 | C7 | C8 | H9 | 64.8° | 179.2° |
| C7 | C6 | C25 | H16 | 175.9° | 62.3° |
| C7 | C6 | C25 | H17 | 63.1° | 177.6° |
| N5 | C10 | N4 | C11 | 178.3° | 180.0° |
| N5 | C10 | C11 | F1 | 94.2° | 75.0° |
| N5 | C10 | C11 | F2 | 25.0° | 165.0° |
| N5 | C10 | C11 | F3 | 147.9° | 45.0° |
| N4 | C10 | C11 | F1 | 84.0° | 105.0° |
| N4 | C10 | C11 | F2 | 156.8° | 15.0° |
| N4 | C10 | C11 | F3 | 33.8° | 135.0° |
| C10 | C11 | F1 | F2 | 123.0° | 120.0° |
| C10 | C11 | F1 | F3 | 121.9° | 120.0° |
| C10 | C11 | F2 | F3 | 125.4° | 120.0° |
| C24 | C25 | C6 | H16 | 119.5° | 119.9° |
| C24 | C25 | C6 | H17 | 119.5° | 120.0° |
| C24 | C25 | C6 | C5 | 179.9° | 177.5° |
| C24 | C25 | C6 | H5 | 63.0° | 62.3° |
| C24 | C25 | H16 | H17 | 121.6° | 120.2° |
| C25 | C24 | H18 | H19 | 121.0° | 120.0° |
| F1 | C11 | F2 | F3 | 113.8° | 120.1° |
| C25 | C6 | C5 | H5 | 117.1° | 120.1° |
| C25 | C6 | C5 | N1 | 116.2° | 113.9° |
| C25 | C6 | C5 | C3 | 63.3° | 65.8° |
| C25 | C6 | C7 | H6 | 64.8° | 177.6° |
| C25 | C6 | C7 | H7 | 175.3° | 62.3° |
| C6 | C25 | H16 | H17 | 121.5° | 120.1° |
| C6 | C25 | C24 | H18 | 60.1° | 60.9° |
| C6 | C25 | C24 | H19 | 179.2° | 179.2° |
| C6 | C5 | N1 | C1 | 0.3° | 0.3° |
| C6 | C5 | N1 | C3 | 179.6° | 179.7° |
| C6 | C5 | N1 | N2 | 179.8° | 179.7° |
| C6 | C5 | C3 | C4 | 0.0° | 0.3° |
| C6 | C5 | C3 | C2 | 179.8° | 179.7° |
| C5 | C6 | C7 | H6 | 59.3° | 62.5° |
| C5 | C6 | C7 | H7 | 60.6° | 57.6° |
| C5 | C6 | C25 | H16 | 60.4° | 57.7° |
| C5 | C6 | C25 | H17 | 60.6° | 62.4° |
| C1 | N1 | C5 | N2 | 179.9° | 180.0° |
| C1 | N1 | C5 | C3 | 179.9° | 180.0° |
| C1 | N1 | N2 | C2 | 179.6° | 180.0° |
| N1 | C1 | H13 | H14 | 120.0° | 120.0° |
| N1 | C1 | H13 | H15 | 120.0° | 120.0° |
| N1 | C1 | H14 | H15 | 120.0° | 120.0° |
| N1 | C5 | C3 | C4 | 179.6° | 180.0° |
| N1 | C5 | C3 | C2 | 0.6° | 0.0° |
| C5 | N1 | N2 | C2 | 0.4° | 0.0° |
| N1 | C5 | C6 | H5 | 0.9° | 6.2° |
| C5 | N1 | C1 | H13 | 179.9° | 93.8° |
| C5 | N1 | C1 | H14 | 59.9° | 146.2° |
| C5 | N1 | C1 | H15 | 60.0° | 26.2° |
| C3 | C5 | N1 | N2 | 0.2° | 0.0° |
| C5 | C3 | C4 | C2 | 179.8° | 180.0° |
| C5 | C3 | C2 | N2 | 0.8° | 0.0° |
| C5 | C3 | C4 | H1 | 89.9° | 84.4° |
| C5 | C3 | C4 | H2 | 150.1° | 155.6° |
| C5 | C3 | C4 | H3 | 30.1° | 35.5° |
| C3 | C5 | C6 | H5 | 179.6° | 174.1° |
| C5 | C3 | C2 | H12 | 179.2° | 180.0° |
| N1 | N2 | C2 | C3 | 0.7° | 0.0° |
| N1 | N2 | C2 | H12 | 179.3° | 180.0° |
| N2 | N1 | C1 | H13 | 0.0° | 86.2° |
| N2 | N1 | C1 | H14 | 120.0° | 33.8° |
| N2 | N1 | C1 | H15 | 120.0° | 153.8° |
| C4 | C3 | C2 | N2 | 179.4° | 180.0° |
| C3 | C4 | H1 | H2 | 120.0° | 120.0° |
| C3 | C4 | H1 | H3 | 120.0° | 120.0° |
| C3 | C4 | H2 | H3 | 120.0° | 120.0° |
| C4 | C3 | C2 | H12 | 0.6° | 0.0° |
| C3 | C2 | N2 | H12 | 180.0° | 180.0° |
| C2 | C3 | C4 | H1 | 89.9° | 95.6° |
| C2 | C3 | C4 | H2 | 30.1° | 24.4° |
| C2 | C3 | C4 | H3 | 150.1° | 144.5° |
| H1 | C4 | H2 | H3 | 120.0° | 120.0° |
| H4 | C14 | C13 | H10 | 7.7° | 23.6° |
| H4 | C14 | C13 | H11 | 133.9° | 154.8° |
| H4 | C14 | C22 | H21 | 133.9° | 155.0° |
| H4 | C14 | C22 | H22 | 7.6° | 23.7° |
| H5 | C6 | C7 | H6 | 175.8° | 57.7° |
| H5 | C6 | C7 | H7 | 55.9° | 177.8° |
| H5 | C6 | C25 | H16 | 56.5° | 177.8° |
| H5 | C6 | C25 | H17 | 177.5° | 57.7° |
| H6 | C7 | C8 | H8 | 54.2° | 59.1° |
| H6 | C7 | C8 | H9 | 175.1° | 60.8° |
| H7 | C7 | C8 | H8 | 65.8° | 179.2° |
| H7 | C7 | C8 | H9 | 55.2° | 59.3° |
| H13 | C1 | H14 | H15 | 120.0° | 120.0° |
| H16 | C25 | C24 | H18 | 59.3° | 179.3° |
| H16 | C25 | C24 | H19 | 61.3° | 59.3° |
| H17 | C25 | C24 | H18 | 179.6° | 59.1° |
| H17 | C25 | C24 | H19 | 59.7° | 60.9° |
| H24 | C21 | C20 | H26 | 65.7° | 53.6° |
| H24 | C21 | C20 | H27 | 52.9° | 174.1° |
| H25 | C21 | C20 | H26 | 54.6° | 66.5° |
| H25 | C21 | C20 | H27 | 173.3° | 54.0° |
| H28 | C15 | C16 | H30 | 59.3° | 54.1° |
| H28 | C15 | C16 | H31 | 61.4° | 66.3° |
| H29 | C15 | C16 | H30 | 60.0° | 174.1° |
| H29 | C15 | C16 | H31 | 179.3° | 53.7° |
| H32 | C18 | C19 | H34 | 59.5° | 60.0° |
| H32 | C18 | C19 | H35 | 60.6° | 180.0° |
| H32 | C18 | C19 | H36 | 179.4° | 60.0° |
| H33 | C18 | C19 | H34 | 59.4° | 60.1° |
| H33 | C18 | C19 | H35 | 179.5° | 59.9° |
| H33 | C18 | C19 | H36 | 60.5° | 180.0° |
| H34 | C19 | H35 | H36 | 120.0° | 120.0° |
