FB9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.53Å | 1.48Å | |
| C17 | C15 | sing | 1.53Å | 1.48Å | |
| O2 | C8 | sing | 1.43Å | 1.42Å | |
| C16 | C15 | sing | 1.53Å | 1.48Å | |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
| C | O | sing | 1.43Å | 1.43Å | |
| C19 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | O4 | sing | 1.43Å | 1.44Å | |
| O4 | C14 | sing | 1.36Å | 1.37Å | |
| C8 | C9 | sing | 1.52Å | 1.53Å | |
| C8 | C7 | sing | 1.56Å | 1.53Å | |
| C14 | C13 | doub | 1.39Å | 1.38Å | Aromatic |
| O1 | C7 | sing | 1.43Å | 1.43Å | |
| O3 | C10 | doub | 1.22Å | 1.21Å | |
| C2 | C3 | sing | 1.56Å | 1.56Å | |
| C2 | N1 | sing | 1.43Å | 1.49Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C11 | N2 | sing | 1.40Å | 1.42Å | |
| C11 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | N1 | sing | 1.42Å | 1.50Å | |
| C4 | C3 | sing | 1.51Å | 1.55Å | |
| C4 | N1 | sing | 1.49Å | 1.49Å | |
| C4 | C5 | sing | 1.56Å | 1.51Å | |
| N2 | C10 | sing | 1.35Å | 1.35Å | |
| C3 | C20 | sing | 1.51Å | 1.52Å | |
| C10 | N | sing | 1.35Å | 1.36Å | |
| O | C1 | sing | 1.43Å | 1.42Å | |
| C7 | C6 | sing | 1.53Å | 1.50Å | |
| C13 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| N | C5 | sing | 1.45Å | 1.48Å | |
| N | C6 | sing | 1.46Å | 1.50Å | |
| C20 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C23 | doub | 1.40Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.40Å | 1.38Å | Aromatic |
| C23 | C26 | sing | 1.43Å | 1.43Å | |
| C26 | C27 | trip | 1.17Å | 1.19Å | |
| C27 | C28 | sing | 1.43Å | 1.43Å | |
| C28 | C29 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | C33 | sing | 1.40Å | 1.39Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.37Å | Aromatic |
| C32 | C31 | sing | 1.38Å | 1.37Å | Aromatic |
| N2 | H18 | sing | 0.97Å | 1.00Å | |
| C19 | H27 | sing | 1.08Å | 1.08Å | |
| C18 | H26 | sing | 1.08Å | 1.08Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C5 | H11 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H12 | sing | 1.09Å | 1.10Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| O1 | H14 | sing | 0.97Å | 0.95Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| O2 | H15 | sing | 0.97Å | 0.95Å | |
| C9 | H16 | sing | 1.09Å | 1.10Å | |
| C9 | H17 | sing | 1.09Å | 1.10Å | |
| C2 | H | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C | H6 | sing | 1.09Å | 1.10Å | |
| C | H5 | sing | 1.09Å | 1.10Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C25 | H31 | sing | 1.08Å | 1.08Å | |
| C24 | H30 | sing | 1.08Å | 1.08Å | |
| C22 | H29 | sing | 1.08Å | 1.08Å | |
| C21 | H28 | sing | 1.08Å | 1.08Å | |
| C33 | H36 | sing | 1.08Å | 1.08Å | |
| C32 | H35 | sing | 1.08Å | 1.08Å | |
| C31 | H34 | sing | 1.08Å | 1.08Å | |
| C30 | H33 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C17 | C15 | 60.1° | 60.0° |
| C17 | C16 | C15 | 60.1° | 60.0° |
| C16 | C17 | H25 | 120.0° | 117.5° |
| C16 | C17 | H24 | 120.0° | 117.5° |
| C17 | C16 | H23 | 120.0° | 117.5° |
| C17 | C16 | H22 | 120.0° | 117.5° |
| C17 | C15 | C16 | 59.7° | 60.0° |
| C17 | C15 | O4 | 114.2° | 117.5° |
| C17 | C15 | H21 | 118.0° | 117.5° |
| C15 | C17 | H25 | 120.0° | 117.5° |
| C15 | C17 | H24 | 120.0° | 117.5° |
| O2 | C8 | C9 | 100.5° | 109.6° |
| O2 | C8 | C7 | 108.3° | 109.6° |
| O2 | C8 | H4 | 109.0° | 109.7° |
| C8 | O2 | H15 | 109.5° | 114.0° |
| C16 | C15 | O4 | 114.3° | 117.5° |
| C16 | C15 | H21 | 118.0° | 117.5° |
| C15 | C16 | H23 | 120.0° | 117.6° |
| C15 | C16 | H22 | 120.0° | 117.5° |
| C19 | C18 | C14 | 119.8° | 120.0° |
| C18 | C19 | C11 | 120.5° | 120.0° |
| C18 | C19 | H27 | 119.7° | 120.0° |
| C19 | C18 | H26 | 120.1° | 120.0° |
| C18 | C14 | O4 | 120.1° | 120.0° |
| C18 | C14 | C13 | 120.2° | 120.0° |
| C14 | C18 | H26 | 120.1° | 120.0° |
| C | O | C1 | 114.9° | 114.0° |
| O | C | H6 | 109.5° | 109.4° |
| O | C | H5 | 109.5° | 109.5° |
| O | C | H7 | 109.5° | 109.4° |
| C19 | C11 | N2 | 121.7° | 120.0° |
| C19 | C11 | C12 | 119.1° | 120.0° |
| C11 | C19 | H27 | 119.7° | 120.0° |
| C15 | O4 | C14 | 118.9° | 117.0° |
| O4 | C15 | H21 | 119.0° | 115.5° |
| O4 | C14 | C13 | 119.7° | 120.0° |
| C9 | C8 | C7 | 123.0° | 108.9° |
| C8 | C9 | N1 | 118.8° | 107.5° |
| C9 | C8 | H4 | 107.7° | 109.6° |
| C8 | C9 | H16 | 107.1° | 109.8° |
| C8 | C9 | H17 | 107.1° | 109.9° |
| C8 | C7 | O1 | 109.0° | 109.1° |
| C8 | C7 | C6 | 115.9° | 110.9° |
| C8 | C7 | H3 | 107.1° | 109.1° |
| C7 | C8 | H4 | 107.6° | 109.5° |
| C14 | C13 | C12 | 119.9° | 120.1° |
| C14 | C13 | H20 | 120.1° | 120.0° |
| O1 | C7 | C6 | 108.6° | 109.2° |
| O1 | C7 | H3 | 108.5° | 109.2° |
| C7 | O1 | H14 | 109.5° | 114.0° |
| O3 | C10 | N2 | 122.4° | 120.0° |
| O3 | C10 | N | 120.8° | 120.0° |
| C3 | C2 | N1 | 86.8° | 82.4° |
| C3 | C2 | C1 | 112.7° | 114.4° |
| C2 | C3 | C4 | 86.8° | 84.8° |
| C2 | C3 | C20 | 120.5° | 113.9° |
| C3 | C2 | H | 111.7° | 114.4° |
| C2 | C3 | H1 | 109.9° | 114.0° |
| N1 | C2 | C1 | 118.0° | 114.4° |
| C2 | N1 | C9 | 125.9° | 128.3° |
| C2 | N1 | C4 | 91.7° | 90.3° |
| N1 | C2 | H | 112.8° | 114.4° |
| C2 | C1 | O | 113.8° | 109.5° |
| C1 | C2 | H | 112.4° | 113.4° |
| C2 | C1 | H8 | 108.4° | 109.5° |
| C2 | C1 | H9 | 108.4° | 109.5° |
| N2 | C11 | C12 | 119.2° | 120.0° |
| C11 | N2 | C10 | 119.9° | 120.0° |
| C11 | N2 | H18 | 120.0° | 119.9° |
| C11 | C12 | C13 | 120.4° | 120.0° |
| C11 | C12 | H19 | 119.8° | 120.0° |
| C9 | N1 | C4 | 129.0° | 114.2° |
| N1 | C9 | H16 | 107.1° | 109.8° |
| N1 | C9 | H17 | 107.1° | 109.9° |
| C3 | C4 | N1 | 87.1° | 82.2° |
| C3 | C4 | C5 | 114.2° | 118.4° |
| C4 | C3 | C20 | 117.1° | 113.9° |
| C3 | C4 | H2 | 112.6° | 116.4° |
| C4 | C3 | H1 | 110.0° | 114.0° |
| N1 | C4 | C5 | 113.2° | 100.2° |
| N1 | C4 | H2 | 113.7° | 118.0° |
| C4 | C5 | N | 109.5° | 104.6° |
| C4 | C5 | H11 | 109.5° | 110.4° |
| C4 | C5 | H10 | 109.4° | 110.5° |
| C5 | C4 | H2 | 113.4° | 115.8° |
| N2 | C10 | N | 116.7° | 120.0° |
| C10 | N2 | H18 | 120.1° | 120.0° |
| C3 | C20 | C25 | 121.2° | 119.9° |
| C3 | C20 | C21 | 120.9° | 119.9° |
| C20 | C3 | H1 | 110.5° | 113.2° |
| C10 | N | C5 | 120.2° | 115.3° |
| C10 | N | C6 | 120.8° | 115.3° |
| O | C1 | H8 | 108.4° | 109.5° |
| O | C1 | H9 | 108.4° | 109.5° |
| C7 | C6 | N | 116.0° | 113.5° |
| C7 | C6 | H12 | 107.8° | 108.7° |
| C7 | C6 | H13 | 107.8° | 108.6° |
| C6 | C7 | H3 | 107.5° | 109.2° |
| C12 | C13 | H20 | 120.1° | 120.0° |
| C13 | C12 | H19 | 119.8° | 120.0° |
| C5 | N | C6 | 119.0° | 129.4° |
| N | C5 | H11 | 109.5° | 110.4° |
| N | C5 | H10 | 109.5° | 110.4° |
| N | C6 | H12 | 107.8° | 108.7° |
| N | C6 | H13 | 107.8° | 108.7° |
| C25 | C20 | C21 | 117.9° | 120.3° |
| C20 | C25 | C24 | 121.2° | 120.2° |
| C20 | C25 | H31 | 119.4° | 119.8° |
| C20 | C21 | C22 | 121.3° | 120.2° |
| C20 | C21 | H28 | 119.3° | 119.8° |
| C25 | C24 | C23 | 120.1° | 119.8° |
| C24 | C25 | H31 | 119.4° | 120.0° |
| C25 | C24 | H30 | 119.9° | 120.1° |
| C21 | C22 | C23 | 120.3° | 119.8° |
| C21 | C22 | H29 | 119.8° | 120.1° |
| C22 | C21 | H28 | 119.4° | 120.0° |
| C24 | C23 | C22 | 119.1° | 119.7° |
| C24 | C23 | C26 | 120.8° | 120.2° |
| C23 | C24 | H30 | 119.9° | 120.1° |
| C22 | C23 | C26 | 120.1° | 120.1° |
| C23 | C22 | H29 | 119.9° | 120.1° |
| C23 | C26 | C27 | 176.1° | 179.9° |
| C26 | C27 | C28 | 177.0° | 179.9° |
| C27 | C28 | C29 | 120.4° | 120.2° |
| C27 | C28 | C33 | 120.4° | 120.1° |
| C29 | C28 | C33 | 119.2° | 119.7° |
| C28 | C29 | C30 | 120.0° | 119.8° |
| C28 | C29 | H32 | 120.0° | 120.1° |
| C28 | C33 | C32 | 120.0° | 119.9° |
| C28 | C33 | H36 | 120.0° | 120.1° |
| C29 | C30 | C31 | 120.4° | 120.2° |
| C29 | C30 | H33 | 119.8° | 119.9° |
| C30 | C29 | H32 | 120.0° | 120.1° |
| C33 | C32 | C31 | 120.5° | 120.1° |
| C32 | C33 | H36 | 120.0° | 120.1° |
| C33 | C32 | H35 | 119.7° | 120.0° |
| C30 | C31 | C32 | 120.0° | 120.3° |
| C30 | C31 | H34 | 120.0° | 119.9° |
| C31 | C30 | H33 | 119.8° | 119.9° |
| C31 | C32 | H35 | 119.8° | 119.9° |
| C32 | C31 | H34 | 120.0° | 119.8° |
| H25 | C17 | H24 | 109.5° | 115.6° |
| H23 | C16 | H22 | 109.5° | 115.5° |
| H11 | C5 | H10 | 109.5° | 110.3° |
| H12 | C6 | H13 | 109.5° | 108.6° |
| H16 | C9 | H17 | 109.4° | 109.9° |
| H8 | C1 | H9 | 109.4° | 109.5° |
| H6 | C | H5 | 109.5° | 109.5° |
| H6 | C | H7 | 109.5° | 109.4° |
| H5 | C | H7 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C17 | C15 | H25 | 109.5° | 107.5° |
| C16 | C17 | C15 | H24 | 109.5° | 107.5° |
| C17 | C16 | C15 | H23 | 109.5° | 107.5° |
| C17 | C16 | C15 | H22 | 109.5° | 107.4° |
| C16 | C17 | C15 | O4 | 105.1° | 107.5° |
| C16 | C17 | C15 | H21 | 107.8° | 107.5° |
| C16 | C17 | H25 | H24 | 144.7° | 145.7° |
| C17 | C16 | H23 | H22 | 144.7° | 145.6° |
| C17 | C15 | O4 | H21 | 146.8° | 145.7° |
| C17 | C15 | O4 | C14 | 99.7° | 146.0° |
| C15 | C17 | H25 | H24 | 144.7° | 145.6° |
| O2 | C8 | C9 | C7 | 120.1° | 119.8° |
| O2 | C8 | C9 | H4 | 114.0° | 120.4° |
| O2 | C8 | C7 | H4 | 117.7° | 120.4° |
| O2 | C8 | C7 | O1 | 48.8° | 61.5° |
| O2 | C8 | C9 | N1 | 42.5° | 179.3° |
| O2 | C8 | C7 | C6 | 74.1° | 178.2° |
| O2 | C8 | C7 | H3 | 165.9° | 57.8° |
| O2 | C8 | C9 | H16 | 163.8° | 61.3° |
| O2 | C8 | C9 | H17 | 78.9° | 59.7° |
| C16 | C15 | O4 | H21 | 147.0° | 145.6° |
| C16 | C15 | O4 | C14 | 165.9° | 145.4° |
| C15 | C16 | H23 | H22 | 144.6° | 145.7° |
| C19 | C18 | C14 | H26 | 180.0° | 180.0° |
| C18 | C19 | C11 | H27 | 180.0° | 179.9° |
| C19 | C18 | C14 | O4 | 179.0° | 180.0° |
| C19 | C18 | C14 | C13 | 0.4° | 0.0° |
| C18 | C19 | C11 | N2 | 176.7° | 180.0° |
| C18 | C19 | C11 | C12 | 0.4° | 0.2° |
| C14 | C18 | C19 | C11 | 0.6° | 0.0° |
| C18 | C14 | O4 | C15 | 47.2° | 173.7° |
| C18 | C14 | O4 | C13 | 179.4° | 180.0° |
| C18 | C14 | C13 | C12 | 0.8° | 0.2° |
| C14 | C18 | C19 | H27 | 179.5° | 180.0° |
| C18 | C14 | C13 | H20 | 179.2° | 180.0° |
| C | O | C1 | C2 | 58.1° | 180.0° |
| C | O | C1 | H8 | 62.5° | 60.0° |
| C | O | C1 | H9 | 178.8° | 60.0° |
| O | C | H6 | H5 | 120.0° | 120.1° |
| O | C | H6 | H7 | 120.0° | 119.9° |
| O | C | H5 | H7 | 120.0° | 120.0° |
| C19 | C11 | N2 | C12 | 177.1° | 179.7° |
| C19 | C11 | N2 | C10 | 133.9° | 35.2° |
| C19 | C11 | C12 | C13 | 1.6° | 0.4° |
| C19 | C11 | N2 | H18 | 46.1° | 144.8° |
| C11 | C19 | C18 | H26 | 179.5° | 180.0° |
| C19 | C11 | C12 | H19 | 178.3° | 179.7° |
| C15 | O4 | C14 | C13 | 133.5° | 6.3° |
| O4 | C15 | C17 | H25 | 145.4° | 0.0° |
| O4 | C15 | C17 | H24 | 4.4° | 145.0° |
| O4 | C15 | C16 | H23 | 4.7° | 145.0° |
| O4 | C15 | C16 | H22 | 145.6° | 0.1° |
| O4 | C14 | C13 | C12 | 179.8° | 179.8° |
| O4 | C14 | C18 | H26 | 1.0° | 0.1° |
| C14 | O4 | C15 | H21 | 47.1° | 0.3° |
| O4 | C14 | C13 | H20 | 0.2° | 0.0° |
| C9 | C8 | C7 | H4 | 125.9° | 119.8° |
| C9 | C8 | C7 | O1 | 165.1° | 58.3° |
| C8 | C9 | N1 | C2 | 134.6° | 112.2° |
| C8 | C9 | N1 | H16 | 121.3° | 119.5° |
| C8 | C9 | N1 | H17 | 121.3° | 119.6° |
| C8 | C9 | N1 | C4 | 5.3° | 136.6° |
| C9 | C8 | C7 | C6 | 42.2° | 62.0° |
| C9 | C8 | C7 | H3 | 77.7° | 177.6° |
| C9 | C8 | O2 | H15 | 180.0° | 179.9° |
| C8 | C9 | H16 | H17 | 115.8° | 121.0° |
| C8 | C7 | O1 | C6 | 127.1° | 121.4° |
| C8 | C7 | O1 | H3 | 116.3° | 119.2° |
| C7 | C8 | C9 | N1 | 77.6° | 59.5° |
| C8 | C7 | C6 | H3 | 119.7° | 120.3° |
| C8 | C7 | C6 | N | 55.1° | 98.9° |
| C8 | C7 | C6 | H12 | 176.0° | 22.2° |
| C8 | C7 | C6 | H13 | 65.8° | 140.1° |
| C8 | C7 | O1 | H14 | 180.0° | 178.6° |
| C7 | C8 | O2 | H15 | 49.8° | 60.6° |
| C7 | C8 | C9 | H16 | 43.7° | 178.9° |
| C7 | C8 | C9 | H17 | 161.1° | 60.1° |
| C14 | C13 | C12 | C11 | 1.8° | 0.4° |
| C14 | C13 | C12 | H20 | 180.0° | 179.8° |
| C13 | C14 | C18 | H26 | 179.6° | 180.0° |
| C14 | C13 | C12 | H19 | 178.1° | 179.8° |
| O1 | C7 | C6 | H3 | 117.2° | 119.3° |
| O1 | C7 | C6 | N | 68.0° | 21.5° |
| O1 | C7 | C6 | H12 | 52.9° | 142.5° |
| O1 | C7 | C6 | H13 | 171.1° | 99.5° |
| O1 | C7 | C8 | H4 | 69.0° | 178.2° |
| O3 | C10 | N2 | C11 | 24.9° | 5.7° |
| O3 | C10 | N2 | N | 175.9° | 179.7° |
| O3 | C10 | N | C5 | 2.3° | 172.4° |
| O3 | C10 | N | C6 | 180.0° | 7.8° |
| O3 | C10 | N2 | H18 | 155.1° | 174.4° |
| C3 | C2 | N1 | C1 | 114.0° | 113.4° |
| C3 | C2 | N1 | H | 112.3° | 113.4° |
| C3 | C2 | C1 | H | 127.3° | 133.7° |
| C3 | C2 | N1 | C9 | 164.1° | 155.2° |
| C2 | C3 | C4 | C20 | 122.8° | 113.9° |
| C2 | C3 | C4 | H1 | 110.0° | 114.0° |
| C3 | C2 | N1 | C4 | 21.1° | 33.4° |
| C2 | C3 | C4 | C5 | 134.4° | 129.0° |
| C2 | C3 | C20 | H1 | 129.9° | 132.4° |
| C3 | C2 | C1 | O | 168.4° | 131.9° |
| C2 | C3 | C20 | C25 | 137.3° | 8.3° |
| C2 | C3 | C20 | C21 | 45.4° | 171.4° |
| C3 | C2 | C1 | H8 | 47.8° | 12.0° |
| C3 | C2 | C1 | H9 | 70.9° | 108.1° |
| C2 | C3 | C4 | H2 | 94.3° | 85.8° |
| N1 | C2 | C1 | H | 133.9° | 133.7° |
| C2 | N1 | C9 | C4 | 129.3° | 111.3° |
| C2 | N1 | C4 | C5 | 136.3° | 152.1° |
| N1 | C2 | C3 | C20 | 99.5° | 81.0° |
| N1 | C2 | C1 | O | 92.7° | 135.4° |
| C2 | N1 | C9 | H16 | 104.1° | 7.3° |
| C2 | N1 | C9 | H17 | 13.2° | 128.2° |
| N1 | C2 | C1 | H8 | 146.6° | 104.6° |
| N1 | C2 | C1 | H9 | 27.9° | 15.4° |
| C2 | N1 | C4 | H2 | 92.3° | 81.3° |
| N1 | C2 | C3 | H1 | 130.3° | 146.9° |
| C1 | C2 | N1 | C9 | 81.8° | 91.4° |
| C1 | C2 | C3 | C4 | 139.3° | 146.3° |
| C1 | C2 | N1 | C4 | 135.1° | 146.8° |
| C1 | C2 | C3 | C20 | 19.6° | 32.4° |
| C2 | C1 | O | H8 | 120.7° | 120.0° |
| C2 | C1 | O | H9 | 120.7° | 120.0° |
| C2 | C1 | H8 | H9 | 118.0° | 120.0° |
| C1 | C2 | C3 | H1 | 110.6° | 99.7° |
| C11 | N2 | C10 | H18 | 180.0° | 179.9° |
| C11 | N2 | C10 | N | 151.1° | 174.6° |
| N2 | C11 | C12 | C13 | 175.6° | 179.8° |
| N2 | C11 | C19 | H27 | 3.3° | 0.1° |
| N2 | C11 | C12 | H19 | 4.5° | 0.0° |
| C12 | C11 | N2 | C10 | 43.3° | 144.5° |
| C11 | C12 | C13 | H19 | 180.0° | 179.8° |
| C12 | C11 | N2 | H18 | 136.7° | 35.5° |
| C12 | C11 | C19 | H27 | 179.5° | 179.8° |
| C11 | C12 | C13 | H20 | 178.2° | 179.8° |
| C9 | N1 | C4 | C3 | 162.3° | 167.5° |
| C9 | N1 | C4 | C5 | 82.5° | 74.9° |
| N1 | C9 | C8 | H4 | 156.5° | 60.3° |
| N1 | C9 | H16 | H17 | 115.8° | 120.9° |
| C9 | N1 | C2 | H | 51.9° | 41.8° |
| C9 | N1 | C4 | H2 | 48.8° | 51.8° |
| C3 | C4 | N1 | C5 | 115.2° | 117.6° |
| C3 | C4 | N1 | H2 | 113.5° | 115.8° |
| C3 | C4 | C5 | H2 | 130.9° | 145.4° |
| C4 | C3 | C20 | H1 | 126.9° | 132.5° |
| C3 | C4 | C5 | N | 179.6° | 38.0° |
| C4 | C3 | C20 | C25 | 119.6° | 86.9° |
| C4 | C3 | C20 | C21 | 57.7° | 93.5° |
| C3 | C4 | C5 | H11 | 60.4° | 156.8° |
| C3 | C4 | C5 | H10 | 59.6° | 80.8° |
| C4 | C3 | C2 | H | 93.1° | 80.5° |
| N1 | C4 | C5 | H2 | 131.5° | 128.1° |
| N1 | C4 | C3 | C20 | 102.6° | 82.3° |
| N1 | C4 | C5 | N | 82.7° | 48.5° |
| N1 | C4 | C5 | H11 | 37.3° | 70.3° |
| N1 | C4 | C5 | H10 | 157.3° | 167.4° |
| C4 | N1 | C9 | H16 | 126.6° | 104.0° |
| C4 | N1 | C9 | H17 | 116.1° | 17.0° |
| C4 | N1 | C2 | H | 91.2° | 80.0° |
| N1 | C4 | C3 | H1 | 130.2° | 145.6° |
| C5 | C4 | C3 | C20 | 11.6° | 15.0° |
| C4 | C5 | N | C10 | 91.2° | 109.4° |
| C4 | C5 | N | H11 | 120.0° | 118.8° |
| C4 | C5 | N | H10 | 120.0° | 118.9° |
| C4 | C5 | N | C6 | 86.5° | 70.4° |
| C4 | C5 | H11 | H10 | 120.0° | 122.5° |
| C5 | C4 | C3 | H1 | 115.6° | 117.0° |
| N2 | C10 | N | C5 | 178.3° | 7.9° |
| N2 | C10 | N | C6 | 4.0° | 171.9° |
| C3 | C20 | C25 | C21 | 177.4° | 179.7° |
| C3 | C20 | C25 | C24 | 176.4° | 180.0° |
| C3 | C20 | C21 | C22 | 175.6° | 179.8° |
| C20 | C3 | C2 | H | 147.2° | 165.6° |
| C20 | C3 | C4 | H2 | 142.9° | 160.2° |
| C3 | C20 | C25 | H31 | 3.6° | 0.0° |
| C3 | C20 | C21 | H28 | 4.4° | 0.0° |
| C10 | N | C6 | C7 | 70.1° | 143.7° |
| C10 | N | C5 | C6 | 177.7° | 179.8° |
| N | C10 | N2 | H18 | 29.0° | 5.3° |
| C10 | N | C5 | H11 | 148.8° | 131.8° |
| C10 | N | C5 | H10 | 28.8° | 9.6° |
| C10 | N | C6 | H12 | 50.9° | 95.3° |
| C10 | N | C6 | H13 | 169.0° | 22.7° |
| O | C1 | C2 | H | 41.2° | 1.7° |
| O | C1 | H8 | H9 | 118.0° | 120.0° |
| C1 | O | C | H6 | 180.0° | 180.0° |
| C1 | O | C | H5 | 60.0° | 60.0° |
| C1 | O | C | H7 | 60.0° | 60.1° |
| C7 | C6 | N | C5 | 107.6° | 36.5° |
| C7 | C6 | N | H12 | 121.0° | 121.0° |
| C7 | C6 | N | H13 | 121.0° | 121.0° |
| C7 | C6 | H12 | H13 | 117.1° | 118.0° |
| C6 | C7 | O1 | H14 | 52.9° | 60.0° |
| C6 | C7 | C8 | H4 | 168.2° | 57.8° |
| N | C5 | H11 | H10 | 120.0° | 122.3° |
| C5 | N | C6 | H12 | 131.4° | 84.5° |
| C5 | N | C6 | H13 | 13.3° | 157.5° |
| N | C5 | C4 | H2 | 48.7° | 176.6° |
| C6 | N | C5 | H11 | 33.5° | 48.4° |
| C6 | N | C5 | H10 | 153.5° | 170.7° |
| N | C6 | H12 | H13 | 117.0° | 118.0° |
| N | C6 | C7 | H3 | 174.8° | 140.8° |
| C20 | C25 | C24 | H31 | 180.0° | 180.0° |
| C25 | C20 | C21 | C22 | 1.8° | 0.5° |
| C20 | C25 | C24 | C23 | 0.1° | 0.0° |
| C25 | C20 | C3 | H1 | 7.3° | 140.7° |
| C20 | C25 | C24 | H30 | 179.9° | 180.0° |
| C25 | C20 | C21 | H28 | 178.2° | 179.7° |
| C21 | C20 | C25 | C24 | 1.0° | 0.3° |
| C20 | C21 | C22 | H28 | 180.0° | 179.7° |
| C20 | C21 | C22 | C23 | 1.4° | 0.5° |
| C21 | C20 | C3 | H1 | 175.3° | 39.0° |
| C21 | C20 | C25 | H31 | 179.0° | 179.7° |
| C20 | C21 | C22 | H29 | 178.6° | 179.7° |
| C25 | C24 | C23 | H30 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 0.4° | 0.0° |
| C25 | C24 | C23 | C26 | 178.8° | 180.0° |
| C21 | C22 | C23 | C24 | 0.3° | 0.2° |
| C21 | C22 | C23 | H29 | 180.0° | 179.8° |
| C21 | C22 | C23 | C26 | 178.0° | 179.8° |
| C24 | C23 | C22 | C26 | 178.3° | 180.0° |
| C24 | C23 | C26 | C27 | 178.1° | 24.4° |
| C23 | C24 | C25 | H31 | 179.9° | 180.0° |
| C24 | C23 | C22 | H29 | 179.7° | 180.0° |
| C22 | C23 | C26 | C27 | 0.2° | 155.6° |
| C22 | C23 | C24 | H30 | 179.6° | 180.0° |
| C23 | C22 | C21 | H28 | 178.6° | 179.7° |
| C23 | C26 | C27 | C28 | 179.6° | 174.4° |
| C26 | C23 | C24 | H30 | 1.2° | 0.0° |
| C26 | C23 | C22 | H29 | 1.9° | 0.0° |
| C26 | C27 | C28 | C29 | 5.0° | 30.0° |
| C26 | C27 | C28 | C33 | 174.7° | 150.3° |
| C27 | C28 | C29 | C33 | 179.6° | 179.8° |
| C27 | C28 | C29 | C30 | 179.7° | 179.7° |
| C27 | C28 | C33 | C32 | 179.7° | 180.0° |
| C27 | C28 | C33 | H36 | 0.3° | 0.0° |
| C27 | C28 | C29 | H32 | 0.3° | 0.0° |
| C28 | C29 | C30 | H32 | 180.0° | 179.7° |
| C29 | C28 | C33 | C32 | 0.0° | 0.3° |
| C28 | C29 | C30 | C31 | 0.0° | 0.6° |
| C29 | C28 | C33 | H36 | 180.0° | 179.7° |
| C28 | C29 | C30 | H33 | 179.9° | 179.7° |
| C33 | C28 | C29 | C30 | 0.1° | 0.6° |
| C28 | C33 | C32 | H36 | 180.0° | 180.0° |
| C28 | C33 | C32 | C31 | 0.0° | 0.0° |
| C28 | C33 | C32 | H35 | 179.9° | 180.0° |
| C33 | C28 | C29 | H32 | 179.9° | 179.8° |
| C29 | C30 | C31 | H33 | 180.0° | 179.7° |
| C29 | C30 | C31 | C32 | 0.0° | 0.3° |
| C29 | C30 | C31 | H34 | 179.9° | 179.7° |
| C33 | C32 | C31 | C30 | 0.1° | 0.0° |
| C33 | C32 | C31 | H35 | 180.0° | 180.0° |
| C33 | C32 | C31 | H34 | 179.9° | 180.0° |
| C30 | C31 | C32 | H34 | 180.0° | 180.0° |
| C30 | C31 | C32 | H35 | 179.9° | 180.0° |
| C31 | C30 | C29 | H32 | 180.0° | 179.7° |
| C31 | C32 | C33 | H36 | 180.0° | 180.0° |
| C32 | C31 | C30 | H33 | 180.0° | 180.0° |
| H27 | C19 | C18 | H26 | 0.5° | 0.1° |
| H21 | C15 | C17 | H25 | 1.8° | 145.0° |
| H21 | C15 | C17 | H24 | 142.7° | 0.0° |
| H21 | C15 | C16 | H23 | 142.7° | 0.0° |
| H21 | C15 | C16 | H22 | 1.7° | 145.0° |
| H25 | C17 | C16 | H23 | 141.0° | 145.0° |
| H25 | C17 | C16 | H22 | 0.0° | 0.0° |
| H24 | C17 | C16 | H23 | 0.0° | 0.1° |
| H24 | C17 | C16 | H22 | 141.0° | 145.1° |
| H20 | C13 | C12 | H19 | 1.8° | 0.0° |
| H11 | C5 | C4 | H2 | 168.7° | 57.8° |
| H10 | C5 | C4 | H2 | 71.3° | 64.5° |
| H12 | C6 | C7 | H3 | 64.2° | 98.2° |
| H13 | C6 | C7 | H3 | 53.9° | 19.8° |
| H3 | C7 | O1 | H14 | 63.7° | 59.4° |
| H3 | C7 | C8 | H4 | 48.2° | 62.6° |
| H4 | C8 | O2 | H15 | 67.0° | 59.7° |
| H4 | C8 | C9 | H16 | 82.2° | 59.1° |
| H4 | C8 | C9 | H17 | 35.1° | 179.9° |
| H | C2 | C1 | H8 | 79.5° | 121.7° |
| H | C2 | C1 | H9 | 161.8° | 118.3° |
| H | C2 | C3 | H1 | 17.0° | 33.6° |
| H6 | C | H5 | H7 | 120.0° | 120.0° |
| H2 | C4 | C3 | H1 | 15.7° | 28.1° |
| H31 | C25 | C24 | H30 | 0.1° | 0.0° |
| H29 | C22 | C21 | H28 | 1.4° | 0.1° |
| H36 | C33 | C32 | H35 | 0.0° | 0.0° |
| H35 | C32 | C31 | H34 | 0.1° | 0.0° |
| H34 | C31 | C30 | H33 | 0.1° | 0.0° |
| H33 | C30 | C29 | H32 | 0.0° | 0.0° |
