WB0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N5 | C30 | trip | 1.14Å | 1.15Å | |
| C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.40Å | 1.39Å | Aromatic |
| C30 | C25 | sing | 1.43Å | 1.49Å | |
| C27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C24 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.51Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.51Å | |
| C1 | N1 | sing | 1.47Å | 1.46Å | |
| N1 | C2 | sing | 1.35Å | 1.33Å | |
| C2 | O3 | doub | 1.21Å | 1.23Å | |
| C2 | C3 | sing | 1.51Å | 1.50Å | |
| C22 | N4 | sing | 1.47Å | 1.48Å | |
| C22 | C21 | sing | 1.51Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.51Å | |
| O1 | C21 | doub | 1.21Å | 1.23Å | |
| C21 | N3 | sing | 1.35Å | 1.34Å | |
| C4 | N2 | sing | 1.47Å | 1.46Å | |
| C4 | C5 | sing | 1.53Å | 1.50Å | |
| N3 | C13 | sing | 1.46Å | 1.46Å | |
| N2 | C12 | sing | 1.35Å | 1.33Å | |
| O2 | C12 | doub | 1.21Å | 1.24Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C12 | C13 | sing | 1.51Å | 1.50Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.50Å | |
| C7 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.50Å | Aromatic |
| C16 | CL2 | sing | 1.74Å | 1.73Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | CL1 | sing | 1.74Å | 1.73Å | |
| C8 | C9 | doub | 1.38Å | 1.50Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | F1 | sing | 1.35Å | 1.35Å | |
| C27 | H1 | sing | 1.08Å | 1.08Å | |
| C26 | H2 | sing | 1.08Å | 1.08Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C23 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.08Å | 1.08Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.08Å | 1.08Å | |
| C7 | H11 | sing | 1.08Å | 1.08Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.08Å | 1.08Å | |
| C10 | H14 | sing | 1.08Å | 1.08Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| C5 | H19 | sing | 1.09Å | 1.10Å | |
| C5 | H20 | sing | 1.09Å | 1.10Å | |
| C4 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.08Å | 1.08Å | |
| C29 | H25 | sing | 1.08Å | 1.08Å | |
| N1 | H26 | sing | 0.97Å | 1.00Å | |
| N2 | H27 | sing | 0.97Å | 1.00Å | |
| N3 | H28 | sing | 0.97Å | 1.00Å | |
| N4 | H29 | sing | 1.01Å | 1.00Å | |
| N4 | H30 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N5 | C30 | C25 | 179.2° | 179.9° |
| C27 | C26 | C25 | 119.1° | 119.8° |
| C26 | C27 | C28 | 119.9° | 120.2° |
| C26 | C27 | H1 | 120.0° | 119.9° |
| C27 | C26 | H2 | 120.5° | 120.1° |
| C26 | C25 | C30 | 120.5° | 120.1° |
| C26 | C25 | C24 | 121.5° | 119.7° |
| C25 | C26 | H2 | 120.4° | 120.1° |
| C30 | C25 | C24 | 118.0° | 120.2° |
| C27 | C28 | C29 | 120.4° | 120.3° |
| C28 | C27 | H1 | 120.0° | 120.0° |
| C27 | C28 | H24 | 119.8° | 119.8° |
| C25 | C24 | C29 | 119.1° | 119.8° |
| C25 | C24 | C23 | 119.1° | 120.1° |
| C28 | C29 | C24 | 119.9° | 120.2° |
| C29 | C28 | H24 | 119.8° | 119.9° |
| C28 | C29 | H25 | 120.0° | 120.0° |
| C29 | C24 | C23 | 121.8° | 120.1° |
| C24 | C29 | H25 | 120.0° | 119.9° |
| C24 | C23 | C22 | 112.0° | 109.5° |
| C24 | C23 | H3 | 108.9° | 109.4° |
| C24 | C23 | H4 | 108.8° | 109.4° |
| C23 | C22 | N4 | 110.3° | 109.5° |
| C23 | C22 | C21 | 108.5° | 109.4° |
| C22 | C23 | H3 | 108.8° | 109.5° |
| C22 | C23 | H4 | 108.8° | 109.5° |
| C23 | C22 | H5 | 107.2° | 109.5° |
| C1 | N1 | C2 | 120.8° | 120.0° |
| N1 | C1 | H15 | 109.5° | 109.5° |
| N1 | C1 | H16 | 109.5° | 109.4° |
| N1 | C1 | H17 | 109.5° | 109.5° |
| C1 | N1 | H26 | 119.6° | 120.0° |
| N1 | C2 | O3 | 121.0° | 120.0° |
| N1 | C2 | C3 | 119.4° | 120.0° |
| C2 | N1 | H26 | 119.6° | 120.0° |
| O3 | C2 | C3 | 119.6° | 120.0° |
| C2 | C3 | C4 | 109.6° | 109.5° |
| C2 | C3 | H22 | 109.4° | 109.4° |
| C2 | C3 | H23 | 109.5° | 109.4° |
| N4 | C22 | C21 | 115.7° | 109.5° |
| N4 | C22 | H5 | 107.6° | 109.5° |
| C22 | N4 | H29 | 109.5° | 111.0° |
| C22 | N4 | H30 | 109.4° | 111.0° |
| C22 | C21 | O1 | 120.1° | 120.0° |
| C22 | C21 | N3 | 119.4° | 120.0° |
| C21 | C22 | H5 | 107.2° | 109.5° |
| C3 | C4 | N2 | 109.3° | 109.5° |
| C3 | C4 | C5 | 109.7° | 109.4° |
| C3 | C4 | H21 | 109.5° | 109.5° |
| C4 | C3 | H22 | 109.4° | 109.5° |
| C4 | C3 | H23 | 109.4° | 109.5° |
| O1 | C21 | N3 | 120.5° | 120.0° |
| C21 | N3 | C13 | 121.9° | 120.0° |
| C21 | N3 | H28 | 119.1° | 120.0° |
| N2 | C4 | C5 | 108.7° | 109.5° |
| C4 | N2 | C12 | 121.6° | 120.0° |
| N2 | C4 | H21 | 110.1° | 109.5° |
| C4 | N2 | H27 | 119.2° | 120.0° |
| C4 | C5 | C6 | 109.6° | 109.4° |
| C4 | C5 | H19 | 109.5° | 109.5° |
| C4 | C5 | H20 | 109.4° | 109.5° |
| C5 | C4 | H21 | 109.6° | 109.5° |
| N3 | C13 | C12 | 109.4° | 109.5° |
| N3 | C13 | C14 | 110.6° | 109.5° |
| N3 | C13 | H12 | 109.7° | 109.5° |
| C13 | N3 | H28 | 119.0° | 120.0° |
| N2 | C12 | O2 | 120.9° | 120.0° |
| N2 | C12 | C13 | 118.9° | 120.0° |
| C12 | N2 | H27 | 119.2° | 120.1° |
| O2 | C12 | C13 | 120.2° | 120.0° |
| C5 | C6 | C7 | 119.6° | 120.0° |
| C5 | C6 | C11 | 119.6° | 120.0° |
| C6 | C5 | H19 | 109.4° | 109.4° |
| C6 | C5 | H20 | 109.5° | 109.5° |
| C12 | C13 | C14 | 108.9° | 109.5° |
| C12 | C13 | H12 | 109.2° | 109.5° |
| C13 | C14 | C15 | 108.6° | 109.5° |
| C13 | C14 | H8 | 109.7° | 109.5° |
| C13 | C14 | H9 | 109.7° | 109.5° |
| C14 | C13 | H12 | 109.1° | 109.4° |
| C7 | C6 | C11 | 120.7° | 120.0° |
| C6 | C7 | C8 | 120.0° | 120.0° |
| C6 | C7 | H11 | 120.0° | 120.0° |
| C6 | C11 | C10 | 121.9° | 120.0° |
| C6 | C11 | H13 | 119.0° | 119.9° |
| C14 | C15 | C20 | 118.6° | 120.0° |
| C14 | C15 | C16 | 120.4° | 120.0° |
| C15 | C14 | H8 | 109.7° | 109.5° |
| C15 | C14 | H9 | 109.7° | 109.4° |
| C7 | C8 | C9 | 118.9° | 120.0° |
| C7 | C8 | H10 | 120.5° | 120.0° |
| C8 | C7 | H11 | 120.0° | 120.0° |
| C11 | C10 | C9 | 119.4° | 120.0° |
| C10 | C11 | H13 | 119.0° | 120.1° |
| C11 | C10 | H14 | 120.3° | 120.0° |
| C15 | C20 | C19 | 120.4° | 120.0° |
| C20 | C15 | C16 | 121.0° | 120.0° |
| C15 | C20 | H6 | 119.8° | 120.0° |
| C20 | C19 | C18 | 118.1° | 120.0° |
| C19 | C20 | H6 | 119.8° | 120.0° |
| C20 | C19 | H18 | 121.0° | 120.0° |
| C15 | C16 | CL2 | 121.6° | 120.0° |
| C15 | C16 | C17 | 121.0° | 120.0° |
| C19 | C18 | C17 | 119.5° | 120.0° |
| C19 | C18 | CL1 | 121.5° | 120.0° |
| C18 | C19 | H18 | 120.9° | 120.0° |
| CL2 | C16 | C17 | 117.4° | 120.0° |
| C16 | C17 | C18 | 120.1° | 120.0° |
| C16 | C17 | H7 | 120.0° | 119.9° |
| C17 | C18 | CL1 | 119.1° | 120.0° |
| C18 | C17 | H7 | 119.9° | 120.1° |
| C8 | C9 | C10 | 119.1° | 119.9° |
| C8 | C9 | F1 | 120.5° | 120.0° |
| C9 | C8 | H10 | 120.6° | 120.0° |
| C10 | C9 | F1 | 120.4° | 120.0° |
| C9 | C10 | H14 | 120.3° | 120.0° |
| H3 | C23 | H4 | 109.5° | 109.5° |
| H8 | C14 | H9 | 109.5° | 109.5° |
| H15 | C1 | H16 | 109.4° | 109.5° |
| H15 | C1 | H17 | 109.5° | 109.5° |
| H16 | C1 | H17 | 109.5° | 109.5° |
| H19 | C5 | H20 | 109.4° | 109.5° |
| H22 | C3 | H23 | 109.5° | 109.5° |
| H29 | N4 | H30 | 109.5° | 111.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N5 | C30 | C25 | C26 | 145.4° | 171.5° |
| N5 | C30 | C25 | C24 | 34.0° | 7.7° |
| C27 | C26 | C25 | H2 | 180.0° | 180.0° |
| C27 | C26 | C25 | C30 | 179.7° | 179.8° |
| C26 | C27 | C28 | H1 | 180.0° | 179.7° |
| C27 | C26 | C25 | C24 | 0.3° | 0.5° |
| C26 | C27 | C28 | C29 | 0.1° | 0.2° |
| C26 | C27 | C28 | H24 | 179.9° | 179.7° |
| C26 | C25 | C30 | C24 | 179.4° | 179.2° |
| C25 | C26 | C27 | C28 | 0.1° | 0.0° |
| C26 | C25 | C24 | C29 | 0.6° | 0.8° |
| C26 | C25 | C24 | C23 | 179.5° | 180.0° |
| C25 | C26 | C27 | H1 | 179.9° | 179.7° |
| C30 | C25 | C24 | C29 | 179.9° | 180.0° |
| C30 | C25 | C24 | C23 | 1.1° | 0.8° |
| C30 | C25 | C26 | H2 | 0.4° | 0.3° |
| C27 | C28 | C29 | H24 | 180.0° | 180.0° |
| C27 | C28 | C29 | C24 | 0.3° | 0.0° |
| C28 | C27 | C26 | H2 | 179.9° | 180.0° |
| C27 | C28 | C29 | H25 | 179.7° | 179.5° |
| C25 | C24 | C29 | C28 | 0.6° | 0.5° |
| C25 | C24 | C29 | C23 | 179.0° | 179.2° |
| C25 | C24 | C23 | C22 | 138.5° | 85.0° |
| C24 | C25 | C26 | H2 | 179.7° | 179.5° |
| C25 | C24 | C23 | H3 | 101.1° | 155.0° |
| C25 | C24 | C23 | H4 | 18.2° | 35.0° |
| C25 | C24 | C29 | H25 | 179.4° | 180.0° |
| C28 | C29 | C24 | H25 | 180.0° | 179.5° |
| C28 | C29 | C24 | C23 | 179.5° | 179.7° |
| C29 | C28 | C27 | H1 | 179.9° | 179.9° |
| C29 | C24 | C23 | C22 | 42.5° | 94.3° |
| C29 | C24 | C23 | H3 | 77.9° | 25.7° |
| C29 | C24 | C23 | H4 | 162.9° | 145.8° |
| C24 | C29 | C28 | H24 | 179.7° | 180.0° |
| C24 | C23 | C22 | H3 | 120.4° | 120.0° |
| C24 | C23 | C22 | H4 | 120.4° | 119.9° |
| C24 | C23 | C22 | N4 | 171.2° | 65.1° |
| C24 | C23 | C22 | C21 | 61.1° | 175.0° |
| C24 | C23 | H3 | H4 | 118.9° | 120.0° |
| C24 | C23 | C22 | H5 | 54.4° | 55.0° |
| C23 | C24 | C29 | H25 | 0.5° | 0.8° |
| C23 | C22 | N4 | C21 | 123.7° | 119.9° |
| C23 | C22 | N4 | H5 | 116.6° | 120.1° |
| C23 | C22 | C21 | H5 | 115.5° | 120.0° |
| C23 | C22 | C21 | O1 | 46.1° | 100.0° |
| C23 | C22 | C21 | N3 | 131.9° | 80.1° |
| C22 | C23 | H3 | H4 | 118.8° | 120.0° |
| C23 | C22 | N4 | H29 | 180.0° | 60.0° |
| C23 | C22 | N4 | H30 | 60.0° | 176.0° |
| C1 | N1 | C2 | H26 | 180.0° | 179.9° |
| C1 | N1 | C2 | O3 | 0.1° | 0.0° |
| C1 | N1 | C2 | C3 | 179.8° | 180.0° |
| N1 | C1 | H15 | H16 | 120.0° | 120.0° |
| N1 | C1 | H15 | H17 | 120.0° | 120.0° |
| N1 | C1 | H16 | H17 | 120.0° | 120.0° |
| N1 | C2 | O3 | C3 | 180.0° | 180.0° |
| N1 | C2 | C3 | C4 | 109.5° | 173.9° |
| C2 | N1 | C1 | H15 | 180.0° | 180.0° |
| C2 | N1 | C1 | H16 | 60.0° | 60.1° |
| C2 | N1 | C1 | H17 | 60.0° | 60.0° |
| N1 | C2 | C3 | H22 | 130.6° | 53.9° |
| N1 | C2 | C3 | H23 | 10.6° | 66.1° |
| O3 | C2 | C3 | C4 | 70.5° | 6.1° |
| O3 | C2 | C3 | H22 | 49.5° | 126.1° |
| O3 | C2 | C3 | H23 | 169.5° | 114.0° |
| O3 | C2 | N1 | H26 | 179.8° | 179.9° |
| C2 | C3 | C4 | H22 | 120.0° | 120.0° |
| C2 | C3 | C4 | H23 | 120.0° | 120.0° |
| C2 | C3 | C4 | N2 | 173.3° | 173.5° |
| C2 | C3 | C4 | C5 | 67.7° | 66.5° |
| C2 | C3 | C4 | H21 | 52.6° | 53.5° |
| C2 | C3 | H22 | H23 | 120.0° | 119.9° |
| C3 | C2 | N1 | H26 | 0.2° | 0.0° |
| N4 | C22 | C21 | H5 | 119.9° | 120.1° |
| N4 | C22 | C21 | O1 | 78.4° | 19.9° |
| N4 | C22 | C21 | N3 | 103.5° | 160.0° |
| N4 | C22 | C23 | H3 | 50.8° | 54.9° |
| N4 | C22 | C23 | H4 | 68.4° | 175.0° |
| C22 | N4 | H29 | H30 | 120.0° | 124.0° |
| C22 | C21 | O1 | N3 | 178.0° | 179.9° |
| C22 | C21 | N3 | C13 | 178.9° | 180.0° |
| C21 | C22 | C23 | H3 | 178.5° | 65.0° |
| C21 | C22 | C23 | H4 | 59.3° | 55.1° |
| C22 | C21 | N3 | H28 | 1.1° | 0.1° |
| C21 | C22 | N4 | H29 | 56.3° | 60.0° |
| C21 | C22 | N4 | H30 | 176.4° | 64.1° |
| C3 | C4 | N2 | C5 | 119.7° | 120.0° |
| C3 | C4 | N2 | H21 | 120.3° | 120.0° |
| C3 | C4 | C5 | H21 | 120.2° | 120.0° |
| C3 | C4 | N2 | C12 | 97.2° | 81.3° |
| C3 | C4 | C5 | C6 | 176.3° | 175.0° |
| C3 | C4 | C5 | H19 | 63.7° | 55.1° |
| C3 | C4 | C5 | H20 | 56.2° | 65.0° |
| C4 | C3 | H22 | H23 | 119.9° | 120.1° |
| C3 | C4 | N2 | H27 | 82.8° | 98.7° |
| O1 | C21 | N3 | C13 | 0.8° | 0.0° |
| O1 | C21 | C22 | H5 | 161.6° | 140.0° |
| O1 | C21 | N3 | H28 | 179.2° | 180.0° |
| C21 | N3 | C13 | H28 | 180.0° | 180.0° |
| C21 | N3 | C13 | C12 | 105.2° | 155.0° |
| C21 | N3 | C13 | C14 | 134.9° | 85.0° |
| N3 | C21 | C22 | H5 | 16.4° | 39.9° |
| C21 | N3 | C13 | H12 | 14.5° | 35.0° |
| N2 | C4 | C5 | H21 | 120.4° | 120.0° |
| C4 | N2 | C12 | H27 | 180.0° | 180.0° |
| C4 | N2 | C12 | O2 | 0.5° | 4.9° |
| N2 | C4 | C5 | C6 | 64.3° | 65.0° |
| C4 | N2 | C12 | C13 | 179.4° | 175.1° |
| N2 | C4 | C5 | H19 | 55.7° | 175.0° |
| N2 | C4 | C5 | H20 | 175.6° | 55.0° |
| N2 | C4 | C3 | H22 | 53.3° | 66.5° |
| N2 | C4 | C3 | H23 | 66.6° | 53.5° |
| C5 | C4 | N2 | C12 | 143.2° | 158.7° |
| C4 | C5 | C6 | H19 | 120.0° | 120.0° |
| C4 | C5 | C6 | H20 | 120.0° | 120.0° |
| C4 | C5 | C6 | C7 | 83.6° | 90.0° |
| C4 | C5 | C6 | C11 | 96.3° | 90.0° |
| C4 | C5 | H19 | H20 | 119.9° | 120.0° |
| C5 | C4 | C3 | H22 | 172.3° | 53.4° |
| C5 | C4 | C3 | H23 | 52.4° | 173.5° |
| C5 | C4 | N2 | H27 | 36.8° | 21.3° |
| N3 | C13 | C12 | N2 | 128.4° | 180.0° |
| N3 | C13 | C12 | O2 | 51.8° | 0.0° |
| N3 | C13 | C12 | C14 | 121.0° | 120.0° |
| N3 | C13 | C12 | H12 | 120.0° | 120.0° |
| N3 | C13 | C14 | H12 | 120.7° | 120.0° |
| N3 | C13 | C14 | C15 | 76.9° | 65.0° |
| N3 | C13 | C14 | H8 | 163.3° | 55.0° |
| N3 | C13 | C14 | H9 | 43.0° | 175.0° |
| N2 | C12 | O2 | C13 | 179.9° | 179.9° |
| N2 | C12 | C13 | C14 | 110.7° | 59.9° |
| N2 | C12 | C13 | H12 | 8.4° | 60.0° |
| C12 | N2 | C4 | H21 | 23.2° | 38.7° |
| O2 | C12 | C13 | C14 | 69.2° | 120.0° |
| O2 | C12 | C13 | H12 | 171.8° | 120.0° |
| O2 | C12 | N2 | H27 | 179.5° | 175.1° |
| C5 | C6 | C7 | C11 | 179.9° | 180.0° |
| C5 | C6 | C7 | C8 | 179.9° | 179.9° |
| C5 | C6 | C11 | C10 | 179.7° | 180.0° |
| C5 | C6 | C7 | H11 | 0.2° | 0.0° |
| C5 | C6 | C11 | H13 | 0.2° | 0.0° |
| C6 | C5 | H19 | H20 | 119.9° | 120.0° |
| C6 | C5 | C4 | H21 | 56.0° | 55.0° |
| C12 | C13 | C14 | H12 | 119.1° | 120.0° |
| C12 | C13 | C14 | C15 | 162.9° | 175.0° |
| C12 | C13 | C14 | H8 | 43.0° | 65.0° |
| C12 | C13 | C14 | H9 | 77.3° | 55.0° |
| C13 | C12 | N2 | H27 | 0.6° | 4.9° |
| C12 | C13 | N3 | H28 | 74.8° | 25.0° |
| C13 | C14 | C15 | H8 | 119.9° | 120.0° |
| C13 | C14 | C15 | H9 | 119.8° | 120.0° |
| C13 | C14 | C15 | C20 | 91.9° | 100.0° |
| C13 | C14 | C15 | C16 | 87.7° | 80.0° |
| C13 | C14 | H8 | H9 | 120.4° | 120.0° |
| C14 | C13 | N3 | H28 | 45.1° | 95.0° |
| C6 | C7 | C8 | H11 | 180.0° | 179.9° |
| C7 | C6 | C11 | C10 | 0.2° | 0.0° |
| C6 | C7 | C8 | C9 | 0.0° | 0.1° |
| C6 | C7 | C8 | H10 | 180.0° | 179.8° |
| C7 | C6 | C11 | H13 | 179.8° | 180.0° |
| C7 | C6 | C5 | H19 | 156.3° | 150.0° |
| C7 | C6 | C5 | H20 | 36.4° | 30.0° |
| C11 | C6 | C7 | C8 | 0.1° | 0.0° |
| C6 | C11 | C10 | H13 | 180.0° | 180.0° |
| C6 | C11 | C10 | C9 | 0.3° | 0.0° |
| C11 | C6 | C7 | H11 | 179.9° | 180.0° |
| C6 | C11 | C10 | H14 | 179.7° | 180.0° |
| C11 | C6 | C5 | H19 | 23.8° | 30.0° |
| C11 | C6 | C5 | H20 | 143.7° | 150.0° |
| C14 | C15 | C20 | C16 | 179.6° | 180.0° |
| C14 | C15 | C20 | C19 | 179.4° | 180.0° |
| C14 | C15 | C16 | CL2 | 0.2° | 0.0° |
| C14 | C15 | C16 | C17 | 179.6° | 180.0° |
| C14 | C15 | C20 | H6 | 0.6° | 0.3° |
| C15 | C14 | H8 | H9 | 120.4° | 120.0° |
| C15 | C14 | C13 | H12 | 43.8° | 55.0° |
| C7 | C8 | C9 | H10 | 180.0° | 179.7° |
| C7 | C8 | C9 | C10 | 0.1° | 0.0° |
| C7 | C8 | C9 | F1 | 180.0° | 179.6° |
| C11 | C10 | C9 | C8 | 0.2° | 0.0° |
| C11 | C10 | C9 | H14 | 180.0° | 180.0° |
| C11 | C10 | C9 | F1 | 179.8° | 179.7° |
| C15 | C20 | C19 | H6 | 180.0° | 179.7° |
| C15 | C20 | C19 | C18 | 0.3° | 0.0° |
| C20 | C15 | C16 | CL2 | 179.4° | 180.0° |
| C20 | C15 | C16 | C17 | 0.1° | 0.1° |
| C20 | C15 | C14 | H8 | 148.2° | 140.0° |
| C20 | C15 | C14 | H9 | 27.9° | 20.0° |
| C15 | C20 | C19 | H18 | 179.8° | 179.9° |
| C19 | C20 | C15 | C16 | 0.2° | 0.1° |
| C20 | C19 | C18 | H18 | 180.0° | 179.9° |
| C20 | C19 | C18 | C17 | 0.1° | 0.0° |
| C20 | C19 | C18 | CL1 | 180.0° | 180.0° |
| C15 | C16 | CL2 | C17 | 179.4° | 179.9° |
| C15 | C16 | C17 | C18 | 0.3° | 0.0° |
| C16 | C15 | C20 | H6 | 179.8° | 179.7° |
| C15 | C16 | C17 | H7 | 179.7° | 180.0° |
| C16 | C15 | C14 | H8 | 32.2° | 40.0° |
| C16 | C15 | C14 | H9 | 152.5° | 160.0° |
| C19 | C18 | C17 | C16 | 0.2° | 0.0° |
| C19 | C18 | C17 | CL1 | 180.0° | 179.9° |
| C18 | C19 | C20 | H6 | 179.7° | 179.7° |
| C19 | C18 | C17 | H7 | 179.8° | 179.9° |
| CL2 | C16 | C17 | C18 | 179.2° | 180.0° |
| CL2 | C16 | C17 | H7 | 0.8° | 0.1° |
| C16 | C17 | C18 | H7 | 180.0° | 179.9° |
| C16 | C17 | C18 | CL1 | 179.8° | 179.9° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| CL1 | C18 | C17 | H7 | 0.2° | 0.0° |
| CL1 | C18 | C19 | H18 | 0.0° | 0.1° |
| C8 | C9 | C10 | F1 | 180.0° | 179.7° |
| C9 | C8 | C7 | H11 | 180.0° | 180.0° |
| C8 | C9 | C10 | H14 | 179.8° | 180.0° |
| C10 | C9 | C8 | H10 | 179.9° | 179.7° |
| C9 | C10 | C11 | H13 | 179.8° | 180.0° |
| F1 | C9 | C8 | H10 | 0.0° | 0.0° |
| F1 | C9 | C10 | H14 | 0.2° | 0.3° |
| H1 | C27 | C26 | H2 | 0.1° | 0.3° |
| H1 | C27 | C28 | H24 | 0.1° | 0.0° |
| H3 | C23 | C22 | H5 | 66.0° | 175.0° |
| H4 | C23 | C22 | H5 | 174.8° | 64.9° |
| H5 | C22 | N4 | H29 | 63.4° | 180.0° |
| H5 | C22 | N4 | H30 | 56.6° | 56.0° |
| H6 | C20 | C19 | H18 | 0.3° | 0.2° |
| H8 | C14 | C13 | H12 | 76.0° | 175.0° |
| H9 | C14 | C13 | H12 | 163.7° | 65.0° |
| H10 | C8 | C7 | H11 | 0.0° | 0.3° |
| H12 | C13 | N3 | H28 | 165.5° | 145.0° |
| H13 | C11 | C10 | H14 | 0.3° | 0.0° |
| H15 | C1 | H16 | H17 | 120.0° | 120.0° |
| H15 | C1 | N1 | H26 | 0.0° | 0.0° |
| H16 | C1 | N1 | H26 | 120.0° | 120.0° |
| H17 | C1 | N1 | H26 | 120.0° | 119.9° |
| H19 | C5 | C4 | H21 | 176.0° | 65.0° |
| H20 | C5 | C4 | H21 | 64.0° | 175.0° |
| H21 | C4 | C3 | H22 | 67.4° | 173.4° |
| H21 | C4 | C3 | H23 | 172.6° | 66.5° |
| H21 | C4 | N2 | H27 | 156.8° | 141.3° |
| H24 | C28 | C29 | H25 | 0.3° | 0.5° |
