WGF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | O1 | doub | 1.21Å | 1.23Å | |
| C3 | N1 | sing | 1.35Å | 1.35Å | |
| N1 | C4 | sing | 1.47Å | 1.47Å | |
| C4 | C5 | sing | 1.55Å | 1.54Å | |
| C5 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | N3 | sing | 1.40Å | 1.38Å | Aromatic |
| N3 | C6 | doub | 1.31Å | 1.34Å | Aromatic |
| C6 | C7 | sing | 1.43Å | 1.41Å | |
| C7 | C8 | trip | 1.17Å | 1.19Å | |
| C8 | C9 | sing | 1.43Å | 1.43Å | |
| C9 | C10 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | F1 | sing | 1.35Å | 1.34Å | |
| C10 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.41Å | 1.40Å | Aromatic |
| C13 | N4 | sing | 1.36Å | 1.39Å | Aromatic |
| N4 | C14 | doub | 1.30Å | 1.32Å | Aromatic |
| C14 | N5 | sing | 1.36Å | 1.37Å | Aromatic |
| N5 | C15 | sing | 1.47Å | 1.44Å | |
| C15 | C16 | sing | 1.53Å | 1.49Å | |
| C16 | C17 | sing | 1.53Å | 1.49Å | |
| C13 | C18 | doub | 1.40Å | 1.40Å | Aromatic |
| C18 | F2 | sing | 1.35Å | 1.35Å | |
| C6 | C19 | sing | 1.47Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.47Å | 1.47Å | |
| C20 | N6 | sing | 1.35Å | 1.33Å | |
| C20 | O2 | doub | 1.22Å | 1.23Å | |
| C19 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | N7 | sing | 1.38Å | 1.39Å | |
| N7 | C22 | sing | 1.47Å | 1.46Å | |
| C5 | C23 | sing | 1.55Å | 1.53Å | |
| C23 | C24 | sing | 1.54Å | 1.53Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C25 | O3 | sing | 1.43Å | 1.41Å | |
| O3 | C26 | sing | 1.43Å | 1.42Å | |
| N1 | C24 | sing | 1.47Å | 1.49Å | |
| N2 | C21 | sing | 1.35Å | 1.36Å | Aromatic |
| C9 | C18 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | N5 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C17 | sing | 1.53Å | 1.49Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| N6 | H17 | sing | 0.97Å | 1.00Å | |
| N6 | H16 | sing | 0.97Å | 1.00Å | |
| N7 | H18 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 114.0° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C1 | C2 | H4 | 108.3° | 109.4° |
| C1 | C2 | H5 | 108.4° | 109.5° |
| C2 | C3 | O1 | 120.9° | 120.0° |
| C2 | C3 | N1 | 118.4° | 120.0° |
| C3 | C2 | H4 | 108.4° | 109.5° |
| C3 | C2 | H5 | 108.3° | 109.5° |
| O1 | C3 | N1 | 120.7° | 120.0° |
| C3 | N1 | C4 | 123.9° | 125.7° |
| C3 | N1 | C24 | 125.1° | 125.6° |
| N1 | C4 | C5 | 102.9° | 104.8° |
| C4 | N1 | C24 | 110.8° | 108.7° |
| N1 | C4 | H7 | 111.1° | 110.3° |
| N1 | C4 | H6 | 111.1° | 110.5° |
| C4 | C5 | N2 | 114.4° | 110.9° |
| C4 | C5 | C23 | 101.1° | 101.6° |
| C5 | C4 | H7 | 111.1° | 110.4° |
| C5 | C4 | H6 | 111.1° | 110.3° |
| C4 | C5 | H8 | 108.5° | 111.0° |
| C5 | N2 | N3 | 120.9° | 125.2° |
| N2 | C5 | C23 | 114.4° | 111.0° |
| C5 | N2 | C21 | 128.5° | 125.1° |
| N2 | C5 | H8 | 109.4° | 110.9° |
| N2 | N3 | C6 | 107.5° | 109.4° |
| N3 | N2 | C21 | 110.0° | 109.7° |
| N3 | C6 | C7 | 120.9° | 126.4° |
| N3 | C6 | C19 | 108.4° | 107.1° |
| C6 | C7 | C8 | 178.0° | 180.0° |
| C7 | C6 | C19 | 129.3° | 126.5° |
| C7 | C8 | C9 | 178.0° | 180.0° |
| C8 | C9 | C10 | 120.3° | 119.9° |
| C8 | C9 | C18 | 118.2° | 120.0° |
| C9 | C10 | F1 | 119.2° | 119.8° |
| C9 | C10 | C11 | 122.0° | 120.2° |
| C10 | C9 | C18 | 120.0° | 120.1° |
| F1 | C10 | C11 | 117.9° | 119.9° |
| C10 | C11 | C12 | 117.2° | 120.1° |
| C10 | C11 | H9 | 121.4° | 119.9° |
| C11 | C12 | C13 | 121.4° | 120.2° |
| C11 | C12 | N5 | 130.7° | 133.8° |
| C12 | C11 | H9 | 121.4° | 119.9° |
| C12 | C13 | N4 | 109.1° | 107.0° |
| C12 | C13 | C18 | 120.5° | 119.7° |
| C13 | C12 | N5 | 105.0° | 106.0° |
| C13 | N4 | C14 | 104.1° | 109.6° |
| N4 | C13 | C18 | 130.3° | 133.4° |
| N4 | C14 | N5 | 112.9° | 110.1° |
| N4 | C14 | H10 | 123.5° | 125.0° |
| C14 | N5 | C15 | 119.5° | 126.3° |
| C14 | N5 | C12 | 104.0° | 107.4° |
| N5 | C14 | H10 | 123.6° | 125.0° |
| N5 | C15 | C16 | 118.2° | 117.5° |
| C15 | N5 | C12 | 120.0° | 126.3° |
| N5 | C15 | C17 | 118.3° | 117.5° |
| N5 | C15 | H11 | 116.7° | 115.6° |
| C15 | C16 | C17 | 60.0° | 60.0° |
| C16 | C15 | C17 | 59.9° | 60.0° |
| C16 | C15 | H11 | 115.8° | 117.5° |
| C15 | C16 | H13 | 120.0° | 117.5° |
| C15 | C16 | H12 | 120.0° | 117.5° |
| C16 | C17 | C15 | 60.0° | 60.0° |
| C17 | C16 | H13 | 120.0° | 117.5° |
| C17 | C16 | H12 | 120.0° | 117.5° |
| C16 | C17 | H15 | 120.0° | 117.5° |
| C16 | C17 | H14 | 120.0° | 117.5° |
| C13 | C18 | F2 | 121.7° | 120.2° |
| C13 | C18 | C9 | 117.9° | 119.6° |
| F2 | C18 | C9 | 120.3° | 120.2° |
| C6 | C19 | C20 | 127.8° | 126.9° |
| C6 | C19 | C21 | 106.9° | 106.2° |
| C19 | C20 | N6 | 116.2° | 120.0° |
| C19 | C20 | O2 | 120.6° | 120.0° |
| C20 | C19 | C21 | 125.3° | 126.9° |
| N6 | C20 | O2 | 123.2° | 120.0° |
| C20 | N6 | H17 | 120.0° | 120.0° |
| C20 | N6 | H16 | 120.0° | 120.0° |
| C19 | C21 | N7 | 128.1° | 126.2° |
| C19 | C21 | N2 | 106.5° | 107.6° |
| C21 | N7 | C22 | 124.6° | 111.0° |
| N7 | C21 | N2 | 125.3° | 126.2° |
| C21 | N7 | H18 | 105.6° | 111.0° |
| N7 | C22 | H20 | 109.5° | 109.4° |
| N7 | C22 | H21 | 109.4° | 109.4° |
| N7 | C22 | H19 | 109.4° | 109.4° |
| C22 | N7 | H18 | 105.6° | 111.0° |
| C5 | C23 | C24 | 103.5° | 102.9° |
| C23 | C5 | H8 | 108.6° | 111.1° |
| C5 | C23 | H22 | 111.0° | 110.7° |
| C5 | C23 | H23 | 110.9° | 110.7° |
| C23 | C24 | C25 | 112.2° | 109.8° |
| C23 | C24 | N1 | 103.6° | 107.3° |
| C24 | C23 | H22 | 110.9° | 110.8° |
| C24 | C23 | H23 | 111.0° | 110.8° |
| C23 | C24 | H24 | 109.0° | 109.9° |
| C24 | C25 | O3 | 108.3° | 109.5° |
| C25 | C24 | N1 | 113.3° | 109.9° |
| C25 | C24 | H24 | 109.2° | 110.0° |
| C24 | C25 | H26 | 109.8° | 109.5° |
| C24 | C25 | H25 | 109.8° | 109.5° |
| C25 | O3 | C26 | 112.9° | 114.0° |
| O3 | C25 | H26 | 109.7° | 109.5° |
| O3 | C25 | H25 | 109.8° | 109.4° |
| O3 | C26 | H29 | 109.5° | 109.5° |
| O3 | C26 | H28 | 109.5° | 109.5° |
| O3 | C26 | H27 | 109.4° | 109.5° |
| N1 | C24 | H24 | 109.5° | 109.9° |
| C17 | C15 | H11 | 115.8° | 117.5° |
| C15 | C17 | H15 | 120.0° | 117.5° |
| C15 | C17 | H14 | 120.0° | 117.5° |
| H7 | C4 | H6 | 109.4° | 110.4° |
| H3 | C1 | H1 | 109.4° | 109.5° |
| H3 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H13 | C16 | H12 | 109.5° | 115.5° |
| H15 | C17 | H14 | 109.4° | 115.6° |
| H4 | C2 | H5 | 109.4° | 109.5° |
| H20 | C22 | H21 | 109.5° | 109.5° |
| H20 | C22 | H19 | 109.4° | 109.5° |
| H21 | C22 | H19 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 110.8° |
| H26 | C25 | H25 | 109.5° | 109.5° |
| H29 | C26 | H28 | 109.5° | 109.4° |
| H29 | C26 | H27 | 109.5° | 109.5° |
| H28 | C26 | H27 | 109.5° | 109.4° |
| H17 | N6 | H16 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | H4 | 120.7° | 120.0° |
| C1 | C2 | C3 | H5 | 120.7° | 120.0° |
| C1 | C2 | C3 | O1 | 9.5° | 0.0° |
| C1 | C2 | C3 | N1 | 168.7° | 180.0° |
| C2 | C1 | H3 | H1 | 120.0° | 120.0° |
| C2 | C1 | H3 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H4 | H5 | 118.0° | 120.0° |
| C2 | C3 | O1 | N1 | 178.1° | 179.9° |
| C2 | C3 | N1 | C4 | 6.4° | 0.1° |
| C2 | C3 | N1 | C24 | 169.0° | 180.0° |
| C3 | C2 | C1 | H3 | 180.0° | 60.0° |
| C3 | C2 | C1 | H1 | 60.0° | 60.0° |
| C3 | C2 | C1 | H2 | 60.0° | 180.0° |
| C3 | C2 | H4 | H5 | 117.9° | 120.0° |
| O1 | C3 | N1 | C4 | 171.8° | 180.0° |
| O1 | C3 | N1 | C24 | 12.8° | 0.1° |
| O1 | C3 | C2 | H4 | 130.2° | 119.9° |
| O1 | C3 | C2 | H5 | 111.2° | 120.1° |
| C3 | N1 | C4 | C24 | 176.0° | 179.9° |
| C3 | N1 | C4 | C5 | 155.8° | 156.0° |
| C3 | N1 | C24 | C23 | 178.1° | 179.0° |
| C3 | N1 | C24 | C25 | 56.3° | 61.6° |
| C3 | N1 | C4 | H7 | 85.3° | 37.2° |
| C3 | N1 | C4 | H6 | 36.8° | 85.2° |
| N1 | C3 | C2 | H4 | 48.0° | 60.0° |
| N1 | C3 | C2 | H5 | 70.6° | 60.0° |
| C3 | N1 | C24 | H24 | 65.7° | 59.6° |
| N1 | C4 | C5 | H7 | 118.9° | 118.8° |
| N1 | C4 | C5 | H6 | 118.9° | 118.9° |
| N1 | C4 | C5 | N2 | 85.7° | 81.0° |
| N1 | C4 | C5 | C23 | 37.8° | 37.0° |
| C4 | N1 | C24 | C23 | 5.9° | 1.1° |
| C4 | N1 | C24 | C25 | 127.7° | 118.3° |
| N1 | C4 | H7 | H6 | 123.0° | 122.4° |
| N1 | C4 | C5 | H8 | 151.8° | 155.1° |
| C4 | N1 | C24 | H24 | 110.2° | 120.5° |
| C4 | C5 | N2 | C23 | 116.0° | 112.1° |
| C4 | C5 | N2 | H8 | 121.9° | 123.9° |
| C4 | C5 | N2 | N3 | 25.1° | 54.8° |
| C4 | C5 | C23 | H8 | 114.0° | 118.1° |
| C4 | C5 | C23 | C24 | 42.0° | 35.5° |
| C5 | C4 | N1 | C24 | 20.2° | 24.1° |
| C4 | C5 | N2 | C21 | 145.2° | 125.0° |
| C5 | C4 | H7 | H6 | 123.1° | 122.2° |
| C4 | C5 | C23 | H22 | 77.0° | 82.9° |
| C4 | C5 | C23 | H23 | 161.0° | 153.9° |
| C5 | N2 | N3 | C21 | 171.9° | 179.9° |
| C5 | N2 | N3 | C6 | 180.0° | 179.9° |
| C5 | N2 | C21 | C19 | 175.6° | 179.9° |
| C5 | N2 | C21 | N7 | 6.7° | 0.1° |
| N2 | C5 | C23 | H8 | 122.5° | 123.9° |
| N2 | C5 | C23 | C24 | 81.5° | 82.5° |
| N2 | C5 | C4 | H7 | 155.4° | 37.8° |
| N2 | C5 | C4 | H6 | 33.2° | 160.0° |
| N2 | C5 | C23 | H22 | 159.5° | 159.1° |
| N2 | C5 | C23 | H23 | 37.6° | 35.9° |
| N2 | N3 | C6 | C7 | 176.1° | 180.0° |
| N2 | N3 | C6 | C19 | 8.2° | 0.2° |
| N3 | N2 | C21 | C19 | 4.5° | 0.0° |
| N3 | N2 | C21 | N7 | 177.9° | 180.0° |
| N3 | N2 | C5 | C23 | 91.0° | 57.3° |
| N3 | N2 | C5 | H8 | 147.0° | 178.7° |
| N3 | C6 | C7 | C19 | 165.1° | 179.7° |
| N3 | C6 | C7 | C8 | 75.9° | 172.2° |
| N3 | C6 | C19 | C20 | 174.1° | 179.8° |
| N3 | C6 | C19 | C21 | 5.5° | 0.2° |
| C6 | N3 | N2 | C21 | 8.1° | 0.1° |
| C6 | C7 | C8 | C9 | 160.2° | 30.2° |
| C7 | C6 | C19 | C20 | 7.5° | 0.0° |
| C7 | C6 | C19 | C21 | 172.1° | 180.0° |
| C7 | C8 | C9 | C10 | 71.5° | 157.3° |
| C8 | C7 | C6 | C19 | 119.0° | 7.5° |
| C7 | C8 | C9 | C18 | 122.1° | 22.8° |
| C8 | C9 | C10 | C18 | 166.1° | 179.9° |
| C8 | C9 | C10 | F1 | 13.7° | 0.0° |
| C8 | C9 | C10 | C11 | 177.4° | 180.0° |
| C8 | C9 | C18 | C13 | 171.7° | 180.0° |
| C8 | C9 | C18 | F2 | 8.2° | 0.1° |
| C9 | C10 | F1 | C11 | 169.3° | 180.0° |
| C9 | C10 | C11 | C12 | 12.0° | 0.0° |
| C10 | C9 | C18 | C13 | 5.3° | 0.1° |
| C10 | C9 | C18 | F2 | 174.6° | 180.0° |
| C9 | C10 | C11 | H9 | 167.9° | 179.9° |
| F1 | C10 | C11 | C12 | 179.0° | 180.0° |
| F1 | C10 | C9 | C18 | 179.8° | 179.9° |
| F1 | C10 | C11 | H9 | 1.1° | 0.1° |
| C10 | C11 | C12 | H9 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 7.2° | 0.1° |
| C11 | C10 | C9 | C18 | 11.3° | 0.1° |
| C10 | C11 | C12 | N5 | 164.8° | 179.5° |
| C11 | C12 | C13 | N5 | 162.5° | 179.7° |
| C11 | C12 | C13 | N4 | 175.2° | 180.0° |
| C11 | C12 | N5 | C14 | 179.3° | 180.0° |
| C11 | C12 | N5 | C15 | 42.5° | 0.1° |
| C11 | C12 | C13 | C18 | 1.8° | 0.1° |
| C12 | C13 | N4 | C18 | 176.7° | 180.0° |
| C12 | C13 | N4 | C14 | 0.7° | 0.2° |
| C13 | C12 | N5 | C14 | 20.5° | 0.4° |
| C13 | C12 | N5 | C15 | 157.3° | 179.6° |
| C12 | C13 | C18 | F2 | 179.2° | 179.9° |
| C12 | C13 | C18 | C9 | 0.8° | 0.0° |
| C13 | C12 | C11 | H9 | 172.7° | 180.0° |
| C13 | N4 | C14 | N5 | 14.8° | 0.0° |
| N4 | C13 | C18 | F2 | 4.5° | 0.0° |
| N4 | C13 | C18 | C9 | 175.6° | 180.0° |
| N4 | C13 | C12 | N5 | 12.7° | 0.4° |
| C13 | N4 | C14 | H10 | 165.2° | 179.7° |
| N4 | C14 | N5 | H10 | 180.0° | 179.7° |
| N4 | C14 | N5 | C15 | 160.0° | 179.7° |
| C14 | N4 | C13 | C18 | 177.4° | 179.8° |
| N4 | C14 | N5 | C12 | 22.9° | 0.3° |
| C14 | N5 | C15 | C12 | 130.3° | 179.9° |
| C14 | N5 | C15 | C16 | 156.1° | 60.0° |
| C14 | N5 | C15 | C17 | 87.0° | 8.6° |
| C14 | N5 | C15 | H11 | 58.5° | 154.3° |
| N5 | C15 | C16 | C17 | 108.2° | 107.5° |
| N5 | C15 | C16 | H11 | 145.7° | 145.1° |
| N5 | C15 | C17 | H11 | 145.9° | 145.0° |
| C15 | N5 | C14 | H10 | 20.0° | 0.0° |
| N5 | C15 | C16 | H13 | 1.3° | 0.0° |
| N5 | C15 | C16 | H12 | 142.4° | 145.0° |
| N5 | C15 | C17 | H15 | 1.5° | 145.0° |
| N5 | C15 | C17 | H14 | 142.5° | 0.0° |
| C15 | C16 | C17 | H13 | 109.5° | 107.5° |
| C15 | C16 | C17 | H12 | 109.5° | 107.5° |
| C16 | C15 | N5 | C12 | 73.5° | 120.1° |
| C16 | C15 | C17 | H11 | 106.1° | 107.5° |
| C15 | C16 | H13 | H12 | 144.7° | 145.7° |
| C16 | C15 | C17 | H15 | 109.5° | 107.5° |
| C16 | C15 | C17 | H14 | 109.5° | 107.5° |
| C17 | C16 | H13 | H12 | 144.7° | 145.7° |
| C16 | C17 | H15 | H14 | 144.7° | 145.7° |
| C13 | C18 | F2 | C9 | 179.9° | 179.9° |
| C18 | C13 | C12 | N5 | 164.4° | 179.6° |
| C6 | C19 | C20 | C21 | 179.5° | 180.0° |
| C6 | C19 | C20 | N6 | 3.0° | 90.0° |
| C6 | C19 | C20 | O2 | 179.2° | 90.0° |
| C6 | C19 | C21 | N7 | 177.0° | 179.8° |
| C6 | C19 | C21 | N2 | 0.5° | 0.1° |
| C19 | C20 | N6 | O2 | 177.7° | 180.0° |
| C20 | C19 | C21 | N7 | 3.4° | 0.2° |
| C20 | C19 | C21 | N2 | 179.1° | 179.9° |
| C19 | C20 | N6 | H17 | 177.7° | 0.0° |
| C19 | C20 | N6 | H16 | 2.3° | 180.0° |
| N6 | C20 | C19 | C21 | 176.5° | 90.0° |
| C20 | N6 | H17 | H16 | 180.0° | 180.0° |
| O2 | C20 | C19 | C21 | 1.3° | 90.0° |
| O2 | C20 | N6 | H17 | 0.0° | 179.9° |
| O2 | C20 | N6 | H16 | 180.0° | 0.0° |
| C19 | C21 | N7 | N2 | 177.1° | 180.0° |
| C19 | C21 | N7 | C22 | 176.9° | 26.3° |
| C19 | C21 | N7 | H18 | 54.8° | 97.7° |
| C21 | N7 | C22 | H18 | 122.1° | 124.0° |
| C21 | N7 | C22 | H20 | 180.0° | 72.2° |
| C21 | N7 | C22 | H21 | 60.0° | 167.8° |
| C21 | N7 | C22 | H19 | 60.0° | 47.8° |
| C22 | N7 | C21 | N2 | 6.0° | 153.7° |
| N7 | C22 | H20 | H21 | 120.0° | 120.0° |
| N7 | C22 | H20 | H19 | 120.0° | 120.0° |
| N7 | C22 | H21 | H19 | 120.0° | 120.0° |
| C5 | C23 | C24 | H22 | 119.0° | 118.3° |
| C5 | C23 | C24 | H23 | 119.0° | 118.4° |
| C5 | C23 | C24 | C25 | 152.4° | 141.6° |
| C5 | C23 | C24 | N1 | 29.9° | 22.2° |
| C23 | C5 | N2 | C21 | 98.8° | 122.8° |
| C23 | C5 | C4 | H7 | 81.2° | 155.8° |
| C23 | C5 | C4 | H6 | 156.7° | 82.0° |
| C5 | C23 | H22 | H23 | 122.8° | 123.2° |
| C5 | C23 | C24 | H24 | 86.6° | 97.3° |
| C23 | C24 | C25 | N1 | 116.8° | 117.8° |
| C23 | C24 | C25 | H24 | 120.9° | 121.0° |
| C23 | C24 | C25 | O3 | 58.6° | 175.7° |
| C23 | C24 | N1 | H24 | 116.1° | 119.4° |
| C24 | C23 | C5 | H8 | 156.0° | 153.6° |
| C24 | C23 | H22 | H23 | 122.8° | 123.3° |
| C23 | C24 | C25 | H26 | 61.2° | 64.3° |
| C23 | C24 | C25 | H25 | 178.4° | 55.7° |
| C24 | C25 | O3 | H26 | 119.8° | 120.0° |
| C24 | C25 | O3 | H25 | 119.8° | 120.0° |
| C24 | C25 | O3 | C26 | 177.6° | 180.0° |
| C25 | C24 | N1 | H24 | 122.1° | 121.2° |
| C25 | C24 | C23 | H22 | 33.4° | 23.3° |
| C25 | C24 | C23 | H23 | 88.5° | 100.0° |
| C24 | C25 | H26 | H25 | 120.5° | 120.1° |
| O3 | C25 | C24 | N1 | 58.2° | 66.5° |
| O3 | C25 | C24 | H24 | 179.5° | 54.6° |
| O3 | C25 | H26 | H25 | 120.6° | 120.0° |
| C25 | O3 | C26 | H29 | 180.0° | 59.9° |
| C25 | O3 | C26 | H28 | 60.0° | 60.0° |
| C25 | O3 | C26 | H27 | 60.0° | 180.0° |
| C26 | O3 | C25 | H26 | 57.8° | 60.0° |
| C26 | O3 | C25 | H25 | 62.6° | 60.0° |
| O3 | C26 | H29 | H28 | 120.0° | 120.0° |
| O3 | C26 | H29 | H27 | 120.0° | 120.1° |
| O3 | C26 | H28 | H27 | 120.0° | 120.0° |
| C24 | N1 | C4 | H7 | 98.7° | 142.9° |
| C24 | N1 | C4 | H6 | 139.2° | 94.7° |
| N1 | C24 | C23 | H22 | 89.1° | 96.1° |
| N1 | C24 | C23 | H23 | 149.0° | 140.6° |
| N1 | C24 | C25 | H26 | 178.0° | 53.5° |
| N1 | C24 | C25 | H25 | 61.6° | 173.6° |
| C21 | N2 | C5 | H8 | 23.3° | 1.2° |
| N2 | C21 | N7 | H18 | 128.1° | 82.3° |
| C12 | N5 | C15 | C17 | 142.7° | 171.3° |
| C12 | N5 | C14 | H10 | 157.1° | 180.0° |
| N5 | C12 | C11 | H9 | 15.2° | 0.4° |
| C12 | N5 | C15 | H11 | 71.8° | 25.6° |
| C15 | C17 | H15 | H14 | 144.7° | 145.7° |
| H7 | C4 | C5 | H8 | 32.9° | 86.1° |
| H6 | C4 | C5 | H8 | 89.2° | 36.2° |
| H8 | C5 | C23 | H22 | 37.0° | 35.2° |
| H8 | C5 | C23 | H23 | 85.0° | 88.0° |
| H3 | C1 | H1 | H2 | 120.0° | 120.1° |
| H3 | C1 | C2 | H4 | 59.3° | 180.0° |
| H3 | C1 | C2 | H5 | 59.3° | 60.0° |
| H1 | C1 | C2 | H4 | 60.7° | 60.0° |
| H1 | C1 | C2 | H5 | 179.3° | 179.9° |
| H2 | C1 | C2 | H4 | 179.3° | 60.0° |
| H2 | C1 | C2 | H5 | 60.7° | 60.0° |
| H11 | C15 | C16 | H13 | 144.3° | 145.0° |
| H11 | C15 | C16 | H12 | 3.3° | 0.0° |
| H11 | C15 | C17 | H15 | 144.4° | 0.0° |
| H11 | C15 | C17 | H14 | 3.3° | 145.0° |
| H13 | C16 | C17 | H15 | 0.1° | 145.0° |
| H13 | C16 | C17 | H14 | 141.0° | 0.0° |
| H12 | C16 | C17 | H15 | 141.0° | 0.0° |
| H12 | C16 | C17 | H14 | 0.0° | 145.0° |
| H20 | C22 | H21 | H19 | 120.0° | 120.1° |
| H20 | C22 | N7 | H18 | 57.9° | 51.8° |
| H21 | C22 | N7 | H18 | 177.9° | 68.2° |
| H19 | C22 | N7 | H18 | 62.0° | 171.7° |
| H22 | C23 | C24 | H24 | 154.4° | 144.4° |
| H23 | C23 | C24 | H24 | 32.4° | 21.1° |
| H24 | C24 | C25 | H26 | 59.7° | 174.7° |
| H24 | C24 | C25 | H25 | 60.7° | 65.3° |
| H29 | C26 | H28 | H27 | 120.0° | 120.0° |
