99W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | C4 | sing | 1.53Å | 1.51Å | |
| C16 | N4 | doub | 1.28Å | 1.31Å | |
| C16 | C15 | sing | 1.51Å | 1.52Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| N3 | C15 | sing | 1.47Å | 1.46Å | |
| N3 | C1 | sing | 1.35Å | 1.33Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| C15 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.51Å | 1.53Å | |
| C2 | N1 | sing | 1.46Å | 1.46Å | |
| O3 | C21 | doub | 1.21Å | 1.22Å | |
| C1 | O1 | doub | 1.21Å | 1.23Å | |
| O2 | C7 | doub | 1.21Å | 1.23Å | |
| C21 | C18 | sing | 1.52Å | 1.52Å | |
| C21 | N5 | sing | 1.34Å | 1.33Å | |
| C18 | C19 | sing | 1.55Å | 1.53Å | |
| F3 | C14 | sing | 1.35Å | 1.35Å | |
| N1 | C7 | sing | 1.35Å | 1.34Å | |
| C7 | C8 | sing | 1.51Å | 1.53Å | |
| N5 | C20 | sing | 1.47Å | 1.47Å | |
| C14 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.37Å | Aromatic |
| C19 | C20 | sing | 1.55Å | 1.53Å | |
| C8 | N2 | sing | 1.47Å | 1.45Å | |
| N2 | C9 | sing | 1.40Å | 1.39Å | |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | F2 | sing | 1.35Å | 1.35Å | |
| C12 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | F1 | sing | 1.35Å | 1.35Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N3 | H2 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C2 | H18 | sing | 1.09Å | 1.10Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| N2 | H21 | sing | 1.01Å | 1.00Å | |
| C11 | H22 | sing | 1.08Å | 1.08Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| N4 | H24 | sing | 0.97Å | 1.00Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| N5 | H28 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C6 | C4 | C5 | 110.1° | 109.5° |
| C6 | C4 | C3 | 111.8° | 109.4° |
| C6 | C4 | H3 | 107.8° | 109.5° |
| C4 | C6 | H7 | 109.5° | 109.5° |
| C4 | C6 | H8 | 109.4° | 109.5° |
| C4 | C6 | H9 | 109.5° | 109.5° |
| N4 | C16 | C15 | 119.7° | 120.0° |
| N4 | C16 | H23 | 120.2° | 120.0° |
| C16 | N4 | H24 | 112.0° | 120.0° |
| C16 | C15 | N3 | 110.4° | 109.5° |
| C16 | C15 | C17 | 109.0° | 109.5° |
| C16 | C15 | H13 | 107.9° | 109.5° |
| C15 | C16 | H23 | 120.2° | 120.0° |
| C5 | C4 | C3 | 111.5° | 109.5° |
| C5 | C4 | H3 | 107.8° | 109.5° |
| C4 | C5 | H4 | 109.5° | 109.5° |
| C4 | C5 | H5 | 109.5° | 109.5° |
| C4 | C5 | H6 | 109.5° | 109.4° |
| C4 | C3 | C2 | 115.7° | 109.5° |
| C3 | C4 | H3 | 107.6° | 109.4° |
| C4 | C3 | H19 | 107.9° | 109.5° |
| C4 | C3 | H20 | 107.9° | 109.5° |
| C15 | N3 | C1 | 122.1° | 120.0° |
| N3 | C15 | C17 | 113.0° | 109.5° |
| C15 | N3 | H2 | 118.9° | 120.0° |
| N3 | C15 | H13 | 108.7° | 109.4° |
| N3 | C1 | C2 | 117.5° | 120.0° |
| N3 | C1 | O1 | 122.8° | 120.0° |
| C1 | N3 | H2 | 118.9° | 120.0° |
| C3 | C2 | C1 | 112.0° | 109.4° |
| C3 | C2 | N1 | 113.5° | 109.5° |
| C3 | C2 | H18 | 107.7° | 109.4° |
| C2 | C3 | H19 | 107.9° | 109.5° |
| C2 | C3 | H20 | 107.9° | 109.5° |
| C15 | C17 | C18 | 116.0° | 109.4° |
| C17 | C15 | H13 | 107.7° | 109.5° |
| C15 | C17 | H14 | 107.8° | 109.5° |
| C15 | C17 | H15 | 107.8° | 109.5° |
| C17 | C18 | C21 | 110.5° | 110.5° |
| C17 | C18 | C19 | 118.0° | 110.5° |
| C18 | C17 | H14 | 107.8° | 109.5° |
| C18 | C17 | H15 | 107.8° | 109.5° |
| C17 | C18 | H25 | 108.0° | 110.4° |
| C1 | C2 | N1 | 107.1° | 109.5° |
| C2 | C1 | O1 | 119.3° | 120.0° |
| C1 | C2 | H18 | 107.7° | 109.5° |
| C2 | N1 | C7 | 121.2° | 120.0° |
| C2 | N1 | H1 | 119.4° | 120.0° |
| N1 | C2 | H18 | 108.6° | 109.5° |
| O3 | C21 | C18 | 124.9° | 124.9° |
| O3 | C21 | N5 | 126.1° | 125.0° |
| O2 | C7 | N1 | 122.4° | 120.1° |
| O2 | C7 | C8 | 119.3° | 120.0° |
| C18 | C21 | N5 | 109.0° | 110.1° |
| C21 | C18 | C19 | 104.3° | 104.1° |
| C21 | C18 | H25 | 107.9° | 110.5° |
| C21 | N5 | C20 | 113.9° | 111.3° |
| C21 | N5 | H28 | 123.1° | 124.4° |
| C18 | C19 | C20 | 105.0° | 101.8° |
| C19 | C18 | H25 | 107.8° | 110.6° |
| C18 | C19 | H26 | 110.6° | 111.0° |
| C18 | C19 | H27 | 110.6° | 111.0° |
| F3 | C14 | C13 | 118.8° | 120.0° |
| F3 | C14 | C9 | 118.1° | 120.0° |
| N1 | C7 | C8 | 118.2° | 120.0° |
| C7 | N1 | H1 | 119.4° | 120.0° |
| C7 | C8 | N2 | 115.4° | 109.5° |
| C7 | C8 | H10 | 107.9° | 109.5° |
| C7 | C8 | H11 | 107.9° | 109.5° |
| N5 | C20 | C19 | 103.7° | 105.5° |
| N5 | C20 | H16 | 110.9° | 110.2° |
| N5 | C20 | H17 | 110.9° | 110.2° |
| C20 | N5 | H28 | 123.0° | 124.4° |
| C13 | C14 | C9 | 123.1° | 120.0° |
| C14 | C13 | C12 | 117.0° | 120.0° |
| C14 | C13 | H12 | 121.5° | 120.0° |
| C14 | C9 | N2 | 120.5° | 120.1° |
| C14 | C9 | C10 | 116.6° | 119.9° |
| C13 | C12 | F2 | 117.4° | 120.0° |
| C13 | C12 | C11 | 123.7° | 120.1° |
| C12 | C13 | H12 | 121.5° | 119.9° |
| C19 | C20 | H16 | 110.9° | 110.3° |
| C19 | C20 | H17 | 110.9° | 110.2° |
| C20 | C19 | H26 | 110.6° | 111.0° |
| C20 | C19 | H27 | 110.6° | 110.9° |
| C8 | N2 | C9 | 122.1° | 111.0° |
| N2 | C8 | H10 | 108.0° | 109.5° |
| N2 | C8 | H11 | 108.0° | 109.5° |
| C8 | N2 | H21 | 106.2° | 111.1° |
| N2 | C9 | C10 | 122.9° | 120.0° |
| C9 | N2 | H21 | 106.2° | 111.0° |
| C9 | C10 | C11 | 122.0° | 119.9° |
| C9 | C10 | F1 | 118.2° | 120.1° |
| F2 | C12 | C11 | 118.9° | 119.9° |
| C12 | C11 | C10 | 117.5° | 120.0° |
| C12 | C11 | H22 | 121.2° | 120.0° |
| C11 | C10 | F1 | 119.8° | 120.0° |
| C10 | C11 | H22 | 121.2° | 120.0° |
| H4 | C5 | H5 | 109.4° | 109.5° |
| H4 | C5 | H6 | 109.5° | 109.5° |
| H5 | C5 | H6 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.5° | 109.5° |
| H7 | C6 | H9 | 109.4° | 109.5° |
| H8 | C6 | H9 | 109.5° | 109.4° |
| H10 | C8 | H11 | 109.5° | 109.5° |
| H14 | C17 | H15 | 109.5° | 109.5° |
| H16 | C20 | H17 | 109.5° | 110.3° |
| H19 | C3 | H20 | 109.5° | 109.4° |
| H26 | C19 | H27 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C6 | C4 | C5 | C3 | 124.7° | 120.0° |
| C6 | C4 | C5 | H3 | 117.4° | 120.0° |
| C6 | C4 | C3 | H3 | 118.3° | 120.0° |
| C6 | C4 | C3 | C2 | 64.3° | 65.0° |
| C6 | C4 | C5 | H4 | 180.0° | 60.0° |
| C6 | C4 | C5 | H5 | 60.0° | 60.0° |
| C6 | C4 | C5 | H6 | 60.0° | 180.0° |
| C4 | C6 | H7 | H8 | 120.0° | 120.0° |
| C4 | C6 | H7 | H9 | 120.0° | 120.0° |
| C4 | C6 | H8 | H9 | 120.0° | 120.0° |
| C6 | C4 | C3 | H19 | 56.7° | 55.1° |
| C6 | C4 | C3 | H20 | 174.8° | 175.0° |
| N4 | C16 | C15 | H23 | 180.0° | 180.0° |
| N4 | C16 | C15 | N3 | 148.4° | 0.0° |
| N4 | C16 | C15 | C17 | 87.0° | 120.0° |
| N4 | C16 | C15 | H13 | 29.7° | 120.0° |
| C16 | C15 | N3 | C17 | 122.4° | 120.0° |
| C16 | C15 | N3 | H13 | 118.2° | 120.0° |
| C16 | C15 | N3 | C1 | 122.2° | 85.0° |
| C16 | C15 | C17 | H13 | 116.8° | 120.0° |
| C16 | C15 | C17 | C18 | 169.1° | 175.0° |
| C16 | C15 | N3 | H2 | 57.8° | 95.0° |
| C16 | C15 | C17 | H14 | 69.9° | 65.0° |
| C16 | C15 | C17 | H15 | 48.1° | 55.0° |
| C15 | C16 | N4 | H24 | 180.0° | 180.0° |
| C5 | C4 | C3 | H3 | 118.0° | 120.0° |
| C5 | C4 | C3 | C2 | 172.0° | 175.0° |
| C4 | C5 | H4 | H5 | 120.0° | 120.0° |
| C4 | C5 | H4 | H6 | 120.0° | 119.9° |
| C4 | C5 | H5 | H6 | 120.0° | 120.0° |
| C5 | C4 | C6 | H7 | 180.0° | 180.0° |
| C5 | C4 | C6 | H8 | 60.0° | 60.0° |
| C5 | C4 | C6 | H9 | 60.0° | 60.0° |
| C5 | C4 | C3 | H19 | 67.1° | 64.9° |
| C5 | C4 | C3 | H20 | 51.1° | 55.0° |
| C4 | C3 | C2 | H19 | 120.9° | 120.0° |
| C4 | C3 | C2 | H20 | 120.9° | 120.0° |
| C4 | C3 | C2 | C1 | 178.7° | 175.0° |
| C4 | C3 | C2 | N1 | 57.2° | 65.0° |
| C3 | C4 | C5 | H4 | 55.3° | 59.9° |
| C3 | C4 | C5 | H5 | 64.7° | 180.0° |
| C3 | C4 | C5 | H6 | 175.3° | 60.0° |
| C3 | C4 | C6 | H7 | 55.5° | 60.0° |
| C3 | C4 | C6 | H8 | 175.5° | 180.0° |
| C3 | C4 | C6 | H9 | 64.5° | 60.0° |
| C4 | C3 | C2 | H18 | 63.0° | 55.1° |
| C4 | C3 | H19 | H20 | 117.2° | 119.9° |
| C15 | N3 | C1 | H2 | 180.0° | 180.0° |
| N3 | C15 | C17 | H13 | 120.0° | 120.0° |
| N3 | C15 | C17 | C18 | 67.7° | 65.0° |
| C15 | N3 | C1 | C2 | 174.5° | 179.9° |
| C15 | N3 | C1 | O1 | 1.6° | 0.0° |
| N3 | C15 | C17 | H14 | 53.2° | 55.0° |
| N3 | C15 | C17 | H15 | 171.3° | 175.0° |
| N3 | C15 | C16 | H23 | 31.6° | 180.0° |
| N3 | C1 | C2 | C3 | 106.4° | 60.0° |
| C1 | N3 | C15 | C17 | 115.4° | 155.0° |
| N3 | C1 | C2 | O1 | 173.2° | 179.9° |
| N3 | C1 | C2 | N1 | 128.6° | 180.0° |
| C1 | N3 | C15 | H13 | 4.0° | 35.0° |
| N3 | C1 | C2 | H18 | 11.9° | 59.9° |
| C3 | C2 | C1 | N1 | 125.0° | 120.0° |
| C3 | C2 | C1 | H18 | 118.3° | 119.9° |
| C3 | C2 | N1 | H18 | 119.8° | 120.0° |
| C3 | C2 | C1 | O1 | 80.4° | 120.1° |
| C3 | C2 | N1 | C7 | 169.9° | 85.0° |
| C3 | C2 | N1 | H1 | 10.1° | 94.7° |
| C2 | C3 | C4 | H3 | 54.0° | 55.0° |
| C2 | C3 | H19 | H20 | 117.1° | 120.0° |
| C15 | C17 | C18 | H14 | 121.0° | 120.0° |
| C15 | C17 | C18 | H15 | 120.9° | 120.0° |
| C15 | C17 | C18 | C21 | 177.7° | 66.5° |
| C15 | C17 | C18 | C19 | 62.5° | 178.8° |
| C17 | C15 | N3 | H2 | 64.5° | 25.0° |
| C15 | C17 | H14 | H15 | 117.0° | 120.0° |
| C17 | C15 | C16 | H23 | 93.0° | 60.0° |
| C15 | C17 | C18 | H25 | 60.0° | 56.1° |
| C17 | C18 | C21 | O3 | 42.3° | 77.7° |
| C17 | C18 | C21 | C19 | 127.8° | 118.6° |
| C17 | C18 | C21 | H25 | 117.8° | 122.5° |
| C17 | C18 | C21 | N5 | 138.2° | 102.4° |
| C17 | C18 | C19 | H25 | 122.5° | 122.6° |
| C17 | C18 | C19 | C20 | 141.5° | 93.8° |
| C18 | C17 | C15 | H13 | 52.3° | 54.9° |
| C18 | C17 | H14 | H15 | 117.0° | 120.0° |
| C17 | C18 | C19 | H26 | 22.2° | 148.0° |
| C17 | C18 | C19 | H27 | 99.2° | 24.2° |
| C1 | C2 | N1 | H18 | 116.1° | 120.1° |
| C1 | C2 | N1 | C7 | 66.0° | 155.0° |
| C1 | C2 | N1 | H1 | 114.0° | 25.2° |
| C2 | C1 | N3 | H2 | 5.4° | 0.1° |
| C1 | C2 | C3 | H19 | 60.4° | 55.0° |
| C1 | C2 | C3 | H20 | 57.8° | 65.0° |
| N1 | C2 | C1 | O1 | 44.6° | 0.1° |
| C2 | N1 | C7 | O2 | 4.7° | 0.3° |
| C2 | N1 | C7 | H1 | 180.0° | 179.7° |
| C2 | N1 | C7 | C8 | 172.1° | 179.8° |
| N1 | C2 | C3 | H19 | 178.2° | 175.0° |
| N1 | C2 | C3 | H20 | 63.7° | 55.0° |
| O3 | C21 | C18 | N5 | 179.5° | 179.9° |
| O3 | C21 | C18 | C19 | 170.1° | 163.7° |
| O3 | C21 | N5 | C20 | 176.8° | 179.6° |
| O3 | C21 | C18 | H25 | 75.5° | 44.8° |
| O3 | C21 | N5 | H28 | 3.2° | 0.3° |
| O1 | C1 | N3 | H2 | 178.4° | 180.0° |
| O1 | C1 | C2 | H18 | 161.3° | 120.0° |
| O2 | C7 | N1 | C8 | 176.8° | 180.0° |
| O2 | C7 | C8 | N2 | 151.9° | 0.0° |
| O2 | C7 | N1 | H1 | 175.3° | 180.0° |
| O2 | C7 | C8 | H10 | 31.0° | 120.0° |
| O2 | C7 | C8 | H11 | 87.2° | 120.0° |
| C21 | C18 | C19 | H25 | 114.5° | 118.8° |
| C18 | C21 | N5 | C20 | 2.6° | 0.5° |
| C21 | C18 | C19 | C20 | 18.5° | 24.8° |
| C21 | C18 | C17 | H14 | 56.8° | 53.5° |
| C21 | C18 | C17 | H15 | 61.3° | 173.5° |
| C21 | C18 | C19 | H26 | 100.7° | 93.4° |
| C21 | C18 | C19 | H27 | 137.8° | 142.9° |
| C18 | C21 | N5 | H28 | 177.3° | 179.6° |
| N5 | C21 | C18 | C19 | 10.4° | 16.2° |
| C21 | N5 | C20 | H28 | 180.0° | 179.9° |
| C21 | N5 | C20 | C19 | 14.5° | 17.1° |
| C21 | N5 | C20 | H16 | 104.6° | 101.9° |
| C21 | N5 | C20 | H17 | 133.6° | 136.1° |
| N5 | C21 | C18 | H25 | 104.0° | 135.0° |
| C18 | C19 | C20 | N5 | 19.8° | 25.5° |
| C18 | C19 | C20 | H26 | 119.2° | 118.2° |
| C18 | C19 | C20 | H27 | 119.3° | 118.1° |
| C19 | C18 | C17 | H14 | 176.6° | 61.2° |
| C19 | C18 | C17 | H15 | 58.4° | 58.9° |
| C18 | C19 | C20 | H16 | 99.2° | 93.5° |
| C18 | C19 | C20 | H17 | 138.9° | 144.5° |
| C18 | C19 | H26 | H27 | 122.1° | 123.8° |
| F3 | C14 | C13 | C9 | 179.8° | 179.2° |
| F3 | C14 | C13 | C12 | 179.8° | 180.0° |
| F3 | C14 | C9 | N2 | 2.3° | 0.3° |
| F3 | C14 | C9 | C10 | 179.8° | 179.8° |
| F3 | C14 | C13 | H12 | 0.2° | 0.0° |
| N1 | C7 | C8 | N2 | 31.1° | 180.0° |
| N1 | C7 | C8 | H10 | 152.0° | 60.0° |
| N1 | C7 | C8 | H11 | 89.7° | 60.0° |
| C7 | N1 | C2 | H18 | 50.1° | 35.0° |
| C7 | C8 | N2 | H10 | 120.9° | 120.0° |
| C7 | C8 | N2 | H11 | 120.9° | 120.0° |
| C7 | C8 | N2 | C9 | 110.3° | 180.0° |
| C8 | C7 | N1 | H1 | 7.9° | 0.0° |
| C7 | C8 | H10 | H11 | 117.3° | 120.0° |
| C7 | C8 | N2 | H21 | 127.9° | 56.1° |
| N5 | C20 | C19 | H16 | 119.1° | 119.0° |
| N5 | C20 | C19 | H17 | 119.1° | 119.0° |
| N5 | C20 | H16 | H17 | 122.7° | 121.9° |
| N5 | C20 | C19 | H26 | 99.4° | 92.7° |
| N5 | C20 | C19 | H27 | 139.1° | 143.6° |
| C14 | C13 | C12 | H12 | 180.0° | 180.0° |
| C13 | C14 | C9 | N2 | 177.9° | 179.4° |
| C13 | C14 | C9 | C10 | 0.4° | 0.6° |
| C14 | C13 | C12 | F2 | 179.6° | 180.0° |
| C14 | C13 | C12 | C11 | 0.5° | 0.5° |
| C9 | C14 | C13 | C12 | 0.4° | 0.8° |
| C14 | C9 | N2 | C8 | 56.4° | 60.0° |
| C14 | C9 | N2 | C10 | 177.4° | 180.0° |
| C14 | C9 | C10 | C11 | 0.4° | 0.0° |
| C14 | C9 | C10 | F1 | 179.7° | 179.7° |
| C9 | C14 | C13 | H12 | 179.6° | 179.2° |
| C14 | C9 | N2 | H21 | 178.1° | 176.0° |
| C13 | C12 | F2 | C11 | 179.9° | 179.5° |
| C13 | C12 | C11 | C10 | 0.6° | 0.0° |
| C13 | C12 | C11 | H22 | 179.4° | 180.0° |
| C19 | C20 | H16 | H17 | 122.7° | 122.0° |
| C20 | C19 | C18 | H25 | 96.0° | 143.6° |
| C20 | C19 | H26 | H27 | 122.1° | 123.7° |
| C19 | C20 | N5 | H28 | 165.5° | 163.0° |
| C8 | N2 | C9 | H21 | 121.7° | 124.0° |
| C8 | N2 | C9 | C10 | 121.0° | 120.0° |
| N2 | C8 | H10 | H11 | 117.3° | 120.0° |
| N2 | C9 | C10 | C11 | 177.9° | 180.0° |
| N2 | C9 | C10 | F1 | 2.3° | 0.2° |
| C9 | N2 | C8 | H10 | 10.6° | 60.0° |
| C9 | N2 | C8 | H11 | 128.8° | 60.0° |
| C9 | C10 | C11 | C12 | 0.5° | 0.3° |
| C9 | C10 | C11 | F1 | 179.9° | 179.8° |
| C10 | C9 | N2 | H21 | 0.7° | 3.9° |
| C9 | C10 | C11 | H22 | 179.5° | 179.8° |
| F2 | C12 | C11 | C10 | 179.6° | 179.4° |
| F2 | C12 | C13 | H12 | 0.4° | 0.0° |
| F2 | C12 | C11 | H22 | 0.4° | 0.5° |
| C12 | C11 | C10 | H22 | 180.0° | 180.0° |
| C12 | C11 | C10 | F1 | 179.6° | 180.0° |
| C11 | C12 | C13 | H12 | 179.5° | 179.5° |
| F1 | C10 | C11 | H22 | 0.4° | 0.0° |
| H1 | N1 | C2 | H18 | 129.9° | 145.3° |
| H2 | N3 | C15 | H13 | 176.0° | 145.0° |
| H3 | C4 | C5 | H4 | 62.6° | 179.9° |
| H3 | C4 | C5 | H5 | 177.4° | 60.0° |
| H3 | C4 | C5 | H6 | 57.4° | 60.0° |
| H3 | C4 | C6 | H7 | 62.6° | 60.0° |
| H3 | C4 | C6 | H8 | 57.4° | 60.0° |
| H3 | C4 | C6 | H9 | 177.4° | 180.0° |
| H3 | C4 | C3 | H19 | 174.9° | 175.1° |
| H3 | C4 | C3 | H20 | 66.9° | 65.0° |
| H4 | C5 | H5 | H6 | 120.0° | 120.0° |
| H7 | C6 | H8 | H9 | 120.0° | 120.0° |
| H10 | C8 | N2 | H21 | 111.2° | 176.1° |
| H11 | C8 | N2 | H21 | 7.1° | 63.9° |
| H13 | C15 | C17 | H14 | 173.2° | 174.9° |
| H13 | C15 | C17 | H15 | 68.7° | 65.0° |
| H13 | C15 | C16 | H23 | 150.3° | 60.0° |
| H14 | C17 | C18 | H25 | 61.0° | 176.1° |
| H15 | C17 | C18 | H25 | 179.1° | 63.9° |
| H16 | C20 | C19 | H26 | 141.5° | 148.3° |
| H16 | C20 | C19 | H27 | 20.1° | 24.6° |
| H16 | C20 | N5 | H28 | 75.5° | 78.0° |
| H17 | C20 | C19 | H26 | 19.7° | 26.3° |
| H17 | C20 | C19 | H27 | 101.8° | 97.4° |
| H17 | C20 | N5 | H28 | 46.4° | 44.0° |
| H18 | C2 | C3 | H19 | 57.9° | 65.0° |
| H18 | C2 | C3 | H20 | 176.1° | 175.1° |
| H23 | C16 | N4 | H24 | 0.0° | 0.1° |
| H25 | C18 | C19 | H26 | 144.8° | 25.4° |
| H25 | C18 | C19 | H27 | 23.3° | 98.4° |
