9HR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | N3 | sing | 1.47Å | 1.47Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C19 | C18 | sing | 1.53Å | 1.50Å | |
| C19 | C20 | sing | 1.53Å | 1.51Å | |
| N3 | C20 | sing | 1.47Å | 1.46Å | |
| N3 | C22 | sing | 1.47Å | 1.46Å | |
| C18 | C17 | sing | 1.53Å | 1.51Å | |
| C11 | N | sing | 1.47Å | 1.46Å | |
| C11 | C13 | sing | 1.53Å | 1.57Å | |
| C17 | C16 | sing | 1.53Å | 1.50Å | |
| N | C10 | sing | 1.40Å | 1.40Å | |
| C16 | N2 | sing | 1.47Å | 1.45Å | |
| C13 | O1 | sing | 1.43Å | 1.44Å | |
| C | C1 | sing | 1.53Å | 1.61Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C10 | C9 | doub | 1.37Å | 1.38Å | Aromatic |
| C10 | C14 | sing | 1.41Å | 1.43Å | Aromatic |
| N1 | C14 | doub | 1.34Å | 1.36Å | Aromatic |
| N1 | C15 | sing | 1.32Å | 1.34Å | Aromatic |
| N2 | C15 | sing | 1.38Å | 1.35Å | |
| C9 | C8 | sing | 1.40Å | 1.40Å | Aromatic |
| C14 | C24 | sing | 1.42Å | 1.42Å | Aromatic |
| C15 | N4 | doub | 1.33Å | 1.34Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C7 | sing | 1.48Å | 1.49Å | |
| C24 | C25 | sing | 1.40Å | 1.41Å | Aromatic |
| C24 | C23 | doub | 1.41Å | 1.42Å | Aromatic |
| N4 | C23 | sing | 1.32Å | 1.31Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C7 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C4 | O | sing | 1.36Å | 1.35Å | |
| C4 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | F | sing | 1.35Å | 1.35Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| O | H15 | sing | 0.97Å | 0.95Å | |
| C3 | H16 | sing | 1.08Å | 1.08Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C | H20 | sing | 1.09Å | 1.10Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.08Å | 1.08Å | |
| N | H23 | sing | 0.97Å | 1.00Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| O1 | H25 | sing | 0.97Å | 0.95Å | |
| C12 | H26 | sing | 1.09Å | 1.10Å | |
| C12 | H27 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.08Å | 1.08Å | |
| C23 | H30 | sing | 1.08Å | 1.08Å | |
| N2 | H31 | sing | 0.97Å | 1.00Å | |
| C16 | H32 | sing | 1.09Å | 1.10Å | |
| C16 | H33 | sing | 1.09Å | 1.10Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C18 | H35 | sing | 1.09Å | 1.10Å | |
| C19 | H36 | sing | 1.09Å | 1.10Å | |
| C19 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | N3 | C20 | 110.4° | 111.0° |
| C21 | N3 | C22 | 110.3° | 111.0° |
| N3 | C21 | H9 | 109.5° | 109.5° |
| N3 | C21 | H10 | 109.5° | 109.5° |
| N3 | C21 | H11 | 109.5° | 109.5° |
| C12 | C11 | N | 110.5° | 109.4° |
| C12 | C11 | C13 | 108.9° | 109.5° |
| C12 | C11 | H24 | 108.9° | 109.5° |
| C11 | C12 | H26 | 109.5° | 109.5° |
| C11 | C12 | H27 | 109.5° | 109.5° |
| C11 | C12 | H28 | 109.5° | 109.5° |
| C18 | C19 | C20 | 114.0° | 109.5° |
| C19 | C18 | C17 | 114.3° | 109.5° |
| C19 | C18 | H34 | 108.3° | 109.5° |
| C19 | C18 | H35 | 108.2° | 109.5° |
| C18 | C19 | H36 | 108.4° | 109.4° |
| C18 | C19 | H37 | 108.3° | 109.5° |
| C19 | C20 | N3 | 113.7° | 109.5° |
| C19 | C20 | H7 | 108.4° | 109.5° |
| C19 | C20 | H8 | 108.4° | 109.5° |
| C20 | C19 | H36 | 108.3° | 109.5° |
| C20 | C19 | H37 | 108.3° | 109.5° |
| C20 | N3 | C22 | 110.4° | 111.0° |
| N3 | C20 | H7 | 108.4° | 109.5° |
| N3 | C20 | H8 | 108.4° | 109.5° |
| N3 | C22 | H12 | 109.5° | 109.5° |
| N3 | C22 | H13 | 109.5° | 109.5° |
| N3 | C22 | H14 | 109.5° | 109.5° |
| C18 | C17 | C16 | 108.8° | 109.5° |
| C18 | C17 | H5 | 109.7° | 109.5° |
| C18 | C17 | H6 | 109.7° | 109.5° |
| C17 | C18 | H34 | 108.2° | 109.5° |
| C17 | C18 | H35 | 108.3° | 109.5° |
| N | C11 | C13 | 110.7° | 109.5° |
| C11 | N | C10 | 128.5° | 120.0° |
| C11 | N | H23 | 104.5° | 120.0° |
| N | C11 | H24 | 109.6° | 109.5° |
| C11 | C13 | O1 | 110.6° | 109.5° |
| C11 | C13 | H3 | 109.2° | 109.5° |
| C11 | C13 | H4 | 109.2° | 109.5° |
| C13 | C11 | H24 | 108.3° | 109.5° |
| C17 | C16 | N2 | 111.7° | 109.5° |
| C16 | C17 | H5 | 109.6° | 109.5° |
| C16 | C17 | H6 | 109.6° | 109.5° |
| C17 | C16 | H32 | 108.9° | 109.4° |
| C17 | C16 | H33 | 108.9° | 109.5° |
| N | C10 | C9 | 124.0° | 120.1° |
| N | C10 | C14 | 116.9° | 120.1° |
| C10 | N | H23 | 104.5° | 120.0° |
| C16 | N2 | C15 | 120.8° | 120.0° |
| C16 | N2 | H31 | 106.6° | 120.0° |
| N2 | C16 | H32 | 108.9° | 109.5° |
| N2 | C16 | H33 | 108.9° | 109.5° |
| O1 | C13 | H3 | 109.2° | 109.5° |
| O1 | C13 | H4 | 109.2° | 109.4° |
| C13 | O1 | H25 | 109.5° | 114.0° |
| C | C1 | C2 | 110.0° | 109.5° |
| C | C1 | H17 | 109.3° | 109.5° |
| C | C1 | H18 | 109.4° | 109.4° |
| C1 | C | H19 | 109.5° | 109.5° |
| C1 | C | H20 | 109.4° | 109.5° |
| C1 | C | H21 | 109.5° | 109.4° |
| C1 | C2 | C3 | 118.9° | 120.0° |
| C1 | C2 | C7 | 121.4° | 120.1° |
| C2 | C1 | H17 | 109.3° | 109.5° |
| C2 | C1 | H18 | 109.3° | 109.4° |
| C9 | C10 | C14 | 118.9° | 119.8° |
| C10 | C9 | C8 | 122.3° | 120.9° |
| C10 | C9 | H29 | 118.9° | 119.6° |
| C10 | C14 | N1 | 117.3° | 121.8° |
| C10 | C14 | C24 | 119.5° | 119.5° |
| C14 | N1 | C15 | 115.4° | 120.3° |
| N1 | C14 | C24 | 123.2° | 118.7° |
| N1 | C15 | N2 | 116.6° | 118.7° |
| N1 | C15 | N4 | 127.2° | 122.6° |
| N2 | C15 | N4 | 116.1° | 118.7° |
| C15 | N2 | H31 | 106.6° | 120.0° |
| C9 | C8 | C25 | 119.0° | 120.6° |
| C9 | C8 | C7 | 118.1° | 119.7° |
| C8 | C9 | H29 | 118.8° | 119.6° |
| C14 | C24 | C25 | 119.0° | 119.8° |
| C14 | C24 | C23 | 113.5° | 118.4° |
| C15 | N4 | C23 | 116.0° | 121.5° |
| C3 | C2 | C7 | 119.7° | 119.9° |
| C2 | C3 | C4 | 121.5° | 120.1° |
| C2 | C3 | H16 | 119.3° | 119.9° |
| C2 | C7 | C8 | 120.9° | 120.0° |
| C2 | C7 | C6 | 119.2° | 119.9° |
| C25 | C8 | C7 | 122.4° | 119.7° |
| C8 | C25 | C24 | 121.3° | 119.4° |
| C8 | C25 | H22 | 119.4° | 120.3° |
| C8 | C7 | C6 | 119.9° | 120.1° |
| C25 | C24 | C23 | 127.5° | 121.9° |
| C24 | C25 | H22 | 119.4° | 120.3° |
| C24 | C23 | N4 | 124.7° | 118.5° |
| C24 | C23 | H30 | 117.7° | 120.7° |
| N4 | C23 | H30 | 117.6° | 120.8° |
| C3 | C4 | O | 121.4° | 120.0° |
| C3 | C4 | C5 | 117.5° | 120.1° |
| C4 | C3 | H16 | 119.3° | 120.0° |
| C7 | C6 | C5 | 118.8° | 119.9° |
| C7 | C6 | H2 | 120.6° | 120.0° |
| O | C4 | C5 | 121.1° | 119.9° |
| C4 | O | H15 | 109.5° | 114.0° |
| C4 | C5 | C6 | 123.4° | 120.1° |
| C4 | C5 | F | 116.3° | 120.0° |
| C6 | C5 | F | 120.3° | 120.0° |
| C5 | C6 | H2 | 120.6° | 120.1° |
| H3 | C13 | H4 | 109.5° | 109.5° |
| H5 | C17 | H6 | 109.5° | 109.5° |
| H7 | C20 | H8 | 109.5° | 109.4° |
| H9 | C21 | H10 | 109.5° | 109.4° |
| H9 | C21 | H11 | 109.5° | 109.5° |
| H10 | C21 | H11 | 109.4° | 109.5° |
| H12 | C22 | H13 | 109.5° | 109.5° |
| H12 | C22 | H14 | 109.5° | 109.4° |
| H13 | C22 | H14 | 109.5° | 109.5° |
| H17 | C1 | H18 | 109.5° | 109.5° |
| H19 | C | H20 | 109.5° | 109.4° |
| H19 | C | H21 | 109.5° | 109.5° |
| H20 | C | H21 | 109.5° | 109.5° |
| H26 | C12 | H27 | 109.5° | 109.5° |
| H26 | C12 | H28 | 109.5° | 109.4° |
| H27 | C12 | H28 | 109.4° | 109.5° |
| H32 | C16 | H33 | 109.5° | 109.5° |
| H34 | C18 | H35 | 109.5° | 109.4° |
| H36 | C19 | H37 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | N3 | C20 | C19 | 86.4° | 66.0° |
| C21 | N3 | C20 | C22 | 122.3° | 124.0° |
| C21 | N3 | C20 | H7 | 34.2° | 173.9° |
| C21 | N3 | C20 | H8 | 152.9° | 54.0° |
| N3 | C21 | H9 | H10 | 120.0° | 120.0° |
| N3 | C21 | H9 | H11 | 120.0° | 120.0° |
| N3 | C21 | H10 | H11 | 120.0° | 120.1° |
| C21 | N3 | C22 | H12 | 180.0° | 176.1° |
| C21 | N3 | C22 | H13 | 60.0° | 56.0° |
| C21 | N3 | C22 | H14 | 60.0° | 64.0° |
| C12 | C11 | N | C13 | 120.6° | 120.0° |
| C12 | C11 | N | H24 | 120.0° | 120.0° |
| C12 | C11 | C13 | H24 | 118.2° | 120.0° |
| C12 | C11 | N | C10 | 130.6° | 85.0° |
| C12 | C11 | C13 | O1 | 133.1° | 55.0° |
| C12 | C11 | C13 | H3 | 12.9° | 175.0° |
| C12 | C11 | C13 | H4 | 106.7° | 64.9° |
| C12 | C11 | N | H23 | 106.9° | 95.0° |
| C11 | C12 | H26 | H27 | 120.0° | 120.0° |
| C11 | C12 | H26 | H28 | 120.0° | 120.0° |
| C11 | C12 | H27 | H28 | 120.0° | 120.0° |
| C18 | C19 | C20 | H36 | 120.7° | 120.0° |
| C18 | C19 | C20 | H37 | 120.6° | 120.0° |
| C18 | C19 | C20 | N3 | 159.2° | 180.0° |
| C19 | C18 | C17 | H34 | 120.7° | 120.0° |
| C19 | C18 | C17 | H35 | 120.7° | 120.0° |
| C19 | C18 | C17 | C16 | 166.9° | 180.0° |
| C19 | C18 | C17 | H5 | 73.3° | 60.0° |
| C19 | C18 | C17 | H6 | 47.0° | 60.0° |
| C18 | C19 | C20 | H7 | 80.2° | 60.0° |
| C18 | C19 | C20 | H8 | 38.6° | 60.0° |
| C19 | C18 | H34 | H35 | 117.8° | 120.0° |
| C18 | C19 | H36 | H37 | 118.0° | 119.9° |
| C19 | C20 | N3 | H7 | 120.6° | 120.0° |
| C19 | C20 | N3 | H8 | 120.6° | 120.0° |
| C19 | C20 | N3 | C22 | 151.3° | 170.0° |
| C20 | C19 | C18 | C17 | 78.8° | 180.0° |
| C19 | C20 | H7 | H8 | 118.1° | 120.0° |
| C20 | C19 | C18 | H34 | 160.5° | 60.0° |
| C20 | C19 | C18 | H35 | 42.0° | 60.0° |
| C20 | C19 | H36 | H37 | 117.9° | 120.0° |
| N3 | C20 | H7 | H8 | 118.1° | 120.0° |
| C20 | N3 | C21 | H9 | 180.0° | 60.0° |
| C20 | N3 | C21 | H10 | 60.0° | 180.0° |
| C20 | N3 | C21 | H11 | 60.0° | 60.0° |
| C20 | N3 | C22 | H12 | 57.7° | 60.0° |
| C20 | N3 | C22 | H13 | 177.7° | 180.0° |
| C20 | N3 | C22 | H14 | 62.3° | 60.0° |
| N3 | C20 | C19 | H36 | 38.5° | 60.0° |
| N3 | C20 | C19 | H37 | 80.2° | 60.0° |
| C22 | N3 | C20 | H7 | 88.1° | 50.0° |
| C22 | N3 | C20 | H8 | 30.7° | 70.0° |
| C22 | N3 | C21 | H9 | 57.7° | 63.9° |
| C22 | N3 | C21 | H10 | 177.7° | 56.0° |
| C22 | N3 | C21 | H11 | 62.4° | 176.0° |
| N3 | C22 | H12 | H13 | 120.0° | 120.0° |
| N3 | C22 | H12 | H14 | 120.0° | 120.0° |
| N3 | C22 | H13 | H14 | 120.0° | 120.0° |
| C18 | C17 | C16 | H5 | 119.9° | 120.0° |
| C18 | C17 | C16 | H6 | 119.9° | 120.0° |
| C18 | C17 | C16 | N2 | 169.3° | 180.0° |
| C18 | C17 | H5 | H6 | 120.4° | 120.0° |
| C18 | C17 | C16 | H32 | 70.3° | 60.0° |
| C18 | C17 | C16 | H33 | 49.0° | 60.0° |
| C17 | C18 | H34 | H35 | 117.8° | 120.0° |
| C17 | C18 | C19 | H36 | 160.6° | 60.0° |
| C17 | C18 | C19 | H37 | 41.9° | 60.0° |
| N | C11 | C13 | H24 | 120.2° | 120.0° |
| C11 | N | C10 | H23 | 122.5° | 180.0° |
| N | C11 | C13 | O1 | 105.3° | 65.0° |
| C11 | N | C10 | C9 | 11.8° | 0.0° |
| C11 | N | C10 | C14 | 162.3° | 179.9° |
| N | C11 | C13 | H3 | 134.5° | 55.0° |
| N | C11 | C13 | H4 | 14.8° | 175.1° |
| N | C11 | C12 | H26 | 180.0° | 180.0° |
| N | C11 | C12 | H27 | 60.0° | 60.0° |
| N | C11 | C12 | H28 | 60.0° | 60.0° |
| C13 | C11 | N | C10 | 108.8° | 155.0° |
| C11 | C13 | O1 | H3 | 120.2° | 120.1° |
| C11 | C13 | O1 | H4 | 120.2° | 120.0° |
| C11 | C13 | H3 | H4 | 119.5° | 120.1° |
| C13 | C11 | N | H23 | 13.7° | 25.0° |
| C11 | C13 | O1 | H25 | 180.0° | 180.0° |
| C13 | C11 | C12 | H26 | 58.3° | 60.0° |
| C13 | C11 | C12 | H27 | 178.3° | 180.0° |
| C13 | C11 | C12 | H28 | 61.7° | 59.9° |
| C17 | C16 | N2 | H32 | 120.3° | 119.9° |
| C17 | C16 | N2 | H33 | 120.4° | 120.0° |
| C17 | C16 | N2 | C15 | 172.9° | 180.0° |
| C16 | C17 | H5 | H6 | 120.3° | 120.0° |
| C17 | C16 | N2 | H31 | 65.5° | 0.0° |
| C17 | C16 | H32 | H33 | 119.0° | 120.0° |
| C16 | C17 | C18 | H34 | 46.1° | 60.0° |
| C16 | C17 | C18 | H35 | 72.4° | 60.0° |
| N | C10 | C9 | C14 | 173.9° | 179.9° |
| N | C10 | C14 | N1 | 5.6° | 0.1° |
| N | C10 | C9 | C8 | 171.7° | 180.0° |
| N | C10 | C14 | C24 | 172.2° | 180.0° |
| C10 | N | C11 | H24 | 10.6° | 35.0° |
| N | C10 | C9 | H29 | 8.3° | 0.0° |
| C16 | N2 | C15 | N1 | 1.5° | 179.9° |
| C16 | N2 | C15 | H31 | 121.6° | 179.9° |
| C16 | N2 | C15 | N4 | 178.8° | 0.1° |
| N2 | C16 | C17 | H5 | 49.4° | 60.0° |
| N2 | C16 | C17 | H6 | 70.8° | 60.1° |
| N2 | C16 | H32 | H33 | 119.0° | 120.1° |
| O1 | C13 | H3 | H4 | 119.5° | 119.9° |
| O1 | C13 | C11 | H24 | 14.9° | 175.0° |
| C | C1 | C2 | H17 | 120.1° | 120.1° |
| C | C1 | C2 | H18 | 120.1° | 119.9° |
| C | C1 | C2 | C3 | 95.6° | 100.6° |
| C | C1 | C2 | C7 | 84.3° | 79.9° |
| C | C1 | H17 | H18 | 119.8° | 120.0° |
| C1 | C | H19 | H20 | 120.0° | 120.0° |
| C1 | C | H19 | H21 | 120.0° | 120.0° |
| C1 | C | H20 | H21 | 120.0° | 120.0° |
| C1 | C2 | C3 | C7 | 179.9° | 179.5° |
| C1 | C2 | C7 | C8 | 0.1° | 0.3° |
| C1 | C2 | C3 | C4 | 180.0° | 180.0° |
| C1 | C2 | C7 | C6 | 179.9° | 179.7° |
| C1 | C2 | C3 | H16 | 0.0° | 0.3° |
| C2 | C1 | H17 | H18 | 119.7° | 120.0° |
| C2 | C1 | C | H19 | 180.0° | 179.4° |
| C2 | C1 | C | H20 | 60.0° | 60.7° |
| C2 | C1 | C | H21 | 60.0° | 59.4° |
| C9 | C10 | C14 | N1 | 180.0° | 180.0° |
| C10 | C9 | C8 | H29 | 180.0° | 180.0° |
| C9 | C10 | C14 | C24 | 2.2° | 0.1° |
| C10 | C9 | C8 | C25 | 2.4° | 0.1° |
| C10 | C9 | C8 | C7 | 169.5° | 180.0° |
| C9 | C10 | N | H23 | 134.3° | 180.0° |
| C10 | C14 | N1 | C24 | 177.7° | 179.9° |
| C10 | C14 | N1 | C15 | 177.3° | 180.0° |
| C14 | C10 | C9 | C8 | 2.2° | 0.1° |
| C10 | C14 | C24 | C25 | 2.4° | 0.0° |
| C10 | C14 | C24 | C23 | 175.8° | 180.0° |
| C14 | C10 | N | H23 | 39.8° | 0.0° |
| C14 | C10 | C9 | H29 | 177.8° | 180.0° |
| C14 | N1 | C15 | N2 | 177.4° | 179.9° |
| C14 | N1 | C15 | N4 | 0.5° | 0.1° |
| N1 | C14 | C24 | C25 | 180.0° | 180.0° |
| N1 | C14 | C24 | C23 | 1.8° | 0.1° |
| N1 | C15 | N2 | N4 | 177.3° | 180.0° |
| C15 | N1 | C14 | C24 | 0.3° | 0.1° |
| N1 | C15 | N4 | C23 | 0.4° | 0.1° |
| N1 | C15 | N2 | H31 | 120.1° | 0.0° |
| N2 | C15 | N4 | C23 | 176.5° | 179.9° |
| C15 | N2 | C16 | H32 | 52.6° | 60.1° |
| C15 | N2 | C16 | H33 | 66.7° | 60.0° |
| C9 | C8 | C7 | C2 | 66.8° | 123.1° |
| C9 | C8 | C25 | C7 | 171.6° | 179.9° |
| C9 | C8 | C25 | C24 | 2.5° | 0.1° |
| C9 | C8 | C7 | C6 | 113.2° | 56.9° |
| C9 | C8 | C25 | H22 | 177.5° | 180.0° |
| C14 | C24 | C25 | C8 | 2.6° | 0.0° |
| C14 | C24 | C25 | C23 | 177.9° | 180.0° |
| C14 | C24 | C23 | N4 | 2.8° | 0.0° |
| C14 | C24 | C25 | H22 | 177.5° | 180.0° |
| C14 | C24 | C23 | H30 | 177.2° | 179.9° |
| C15 | N4 | C23 | C24 | 2.2° | 0.1° |
| C15 | N4 | C23 | H30 | 177.8° | 179.9° |
| N4 | C15 | N2 | H31 | 57.2° | 180.0° |
| C3 | C2 | C7 | C8 | 180.0° | 179.8° |
| C2 | C3 | C4 | H16 | 180.0° | 179.7° |
| C3 | C2 | C7 | C6 | 0.0° | 0.3° |
| C2 | C3 | C4 | O | 179.8° | 179.8° |
| C2 | C3 | C4 | C5 | 0.1° | 0.6° |
| C3 | C2 | C1 | H17 | 24.5° | 19.4° |
| C3 | C2 | C1 | H18 | 144.3° | 139.4° |
| C2 | C7 | C8 | C25 | 121.6° | 57.0° |
| C2 | C7 | C8 | C6 | 180.0° | 180.0° |
| C7 | C2 | C3 | C4 | 0.1° | 0.6° |
| C2 | C7 | C6 | C5 | 0.1° | 0.0° |
| C2 | C7 | C6 | H2 | 179.9° | 180.0° |
| C7 | C2 | C3 | H16 | 179.9° | 179.8° |
| C7 | C2 | C1 | H17 | 155.7° | 160.1° |
| C7 | C2 | C1 | H18 | 35.8° | 40.1° |
| C8 | C25 | C24 | H22 | 180.0° | 179.9° |
| C8 | C25 | C24 | C23 | 175.3° | 180.0° |
| C25 | C8 | C7 | C6 | 58.4° | 123.0° |
| C25 | C8 | C9 | H29 | 177.6° | 180.0° |
| C7 | C8 | C25 | C24 | 169.0° | 180.0° |
| C8 | C7 | C6 | C5 | 179.9° | 179.9° |
| C8 | C7 | C6 | H2 | 0.1° | 0.0° |
| C7 | C8 | C25 | H22 | 10.9° | 0.1° |
| C7 | C8 | C9 | H29 | 10.4° | 0.1° |
| C25 | C24 | C23 | N4 | 179.2° | 180.0° |
| C25 | C24 | C23 | H30 | 0.8° | 0.1° |
| C24 | C23 | N4 | H30 | 180.0° | 179.9° |
| C23 | C24 | C25 | H22 | 4.7° | 0.0° |
| C3 | C4 | O | C5 | 179.9° | 179.7° |
| C3 | C4 | C5 | C6 | 0.0° | 0.3° |
| C3 | C4 | C5 | F | 180.0° | 179.7° |
| C3 | C4 | O | H15 | 180.0° | 89.7° |
| C7 | C6 | C5 | C4 | 0.1° | 0.0° |
| C7 | C6 | C5 | H2 | 180.0° | 180.0° |
| C7 | C6 | C5 | F | 179.9° | 180.0° |
| O | C4 | C5 | C6 | 179.9° | 179.9° |
| O | C4 | C5 | F | 0.0° | 0.0° |
| O | C4 | C3 | H16 | 0.2° | 0.1° |
| C4 | C5 | C6 | F | 180.0° | 179.9° |
| C4 | C5 | C6 | H2 | 179.9° | 180.0° |
| C5 | C4 | O | H15 | 0.0° | 90.0° |
| C5 | C4 | C3 | H16 | 179.9° | 179.8° |
| F | C5 | C6 | H2 | 0.1° | 0.1° |
| H3 | C13 | C11 | H24 | 105.3° | 65.0° |
| H3 | C13 | O1 | H25 | 59.9° | 60.0° |
| H4 | C13 | C11 | H24 | 135.0° | 55.1° |
| H4 | C13 | O1 | H25 | 59.8° | 60.0° |
| H5 | C17 | C16 | H32 | 169.8° | 59.9° |
| H5 | C17 | C16 | H33 | 70.9° | 180.0° |
| H5 | C17 | C18 | H34 | 166.0° | 180.0° |
| H5 | C17 | C18 | H35 | 47.4° | 60.0° |
| H6 | C17 | C16 | H32 | 49.6° | 180.0° |
| H6 | C17 | C16 | H33 | 168.9° | 59.9° |
| H6 | C17 | C18 | H34 | 73.8° | 60.0° |
| H6 | C17 | C18 | H35 | 167.7° | 180.0° |
| H7 | C20 | C19 | H36 | 159.1° | 180.0° |
| H7 | C20 | C19 | H37 | 40.4° | 60.1° |
| H8 | C20 | C19 | H36 | 82.1° | 60.0° |
| H8 | C20 | C19 | H37 | 159.2° | 180.0° |
| H9 | C21 | H10 | H11 | 120.0° | 119.9° |
| H12 | C22 | H13 | H14 | 120.0° | 120.0° |
| H17 | C1 | C | H19 | 59.9° | 59.3° |
| H17 | C1 | C | H20 | 60.1° | 179.3° |
| H17 | C1 | C | H21 | 179.9° | 60.7° |
| H18 | C1 | C | H19 | 59.9° | 60.7° |
| H18 | C1 | C | H20 | 180.0° | 59.3° |
| H18 | C1 | C | H21 | 60.1° | 179.3° |
| H19 | C | H20 | H21 | 120.0° | 120.0° |
| H23 | N | C11 | H24 | 133.1° | 145.0° |
| H24 | C11 | C12 | H26 | 59.5° | 60.0° |
| H24 | C11 | C12 | H27 | 60.5° | 60.0° |
| H24 | C11 | C12 | H28 | 179.6° | 180.0° |
| H26 | C12 | H27 | H28 | 120.0° | 120.0° |
| H31 | N2 | C16 | H32 | 174.2° | 120.0° |
| H31 | N2 | C16 | H33 | 54.9° | 120.0° |
| H34 | C18 | C19 | H36 | 39.9° | 60.1° |
| H34 | C18 | C19 | H37 | 78.8° | 180.0° |
| H35 | C18 | C19 | H36 | 78.7° | 180.0° |
| H35 | C18 | C19 | H37 | 162.6° | 60.1° |
