UE6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N8 | C28 | sing | 1.47Å | 1.46Å | |
| C28 | C15 | sing | 1.51Å | 1.52Å | |
| N6 | C15 | sing | 1.34Å | 1.32Å | Aromatic |
| N6 | N5 | doub | 1.29Å | 1.38Å | Aromatic |
| C15 | C16 | doub | 1.35Å | 1.39Å | Aromatic |
| N5 | N4 | sing | 1.29Å | 1.33Å | Aromatic |
| C16 | N4 | sing | 1.35Å | 1.37Å | Aromatic |
| N4 | C14 | sing | 1.47Å | 1.46Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C13 | N3 | sing | 1.46Å | 1.46Å | |
| C20 | C18 | sing | 1.53Å | 1.54Å | |
| O4 | C11 | doub | 1.21Å | 1.23Å | |
| N3 | C11 | sing | 1.35Å | 1.33Å | |
| C11 | C10 | sing | 1.51Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.53Å | 1.55Å | |
| C10 | C9 | sing | 1.53Å | 1.56Å | |
| C9 | C17 | sing | 1.53Å | 1.56Å | |
| C9 | C8 | sing | 1.51Å | 1.53Å | |
| C17 | O5 | sing | 1.45Å | 1.43Å | |
| O5 | C21 | sing | 1.34Å | 1.34Å | |
| C8 | C7 | doub | 1.33Å | 1.35Å | |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C21 | O7 | doub | 1.21Å | 1.23Å | |
| C22 | C24 | sing | 1.53Å | 1.55Å | |
| C22 | N7 | sing | 1.46Å | 1.48Å | |
| C24 | C25 | sing | 1.54Å | 1.51Å | |
| C7 | C1 | sing | 1.47Å | 1.44Å | |
| O6 | C27 | doub | 1.22Å | 1.23Å | |
| C25 | C26 | sing | 1.53Å | 1.51Å | |
| N7 | C27 | sing | 1.33Å | 1.37Å | |
| N7 | C26 | sing | 1.46Å | 1.47Å | |
| C27 | C5 | sing | 1.46Å | 1.44Å | |
| C1 | N1 | sing | 1.33Å | 1.33Å | |
| C1 | O1 | doub | 1.22Å | 1.23Å | |
| N1 | C12 | sing | 1.46Å | 1.46Å | |
| C5 | C6 | doub | 1.35Å | 1.39Å | Aromatic |
| C5 | N2 | sing | 1.37Å | 1.32Å | Aromatic |
| C6 | O2 | sing | 1.35Å | 1.36Å | Aromatic |
| C12 | C23 | sing | 1.51Å | 1.51Å | |
| C23 | C29 | doub | 1.33Å | 1.35Å | |
| N2 | C4 | doub | 1.29Å | 1.30Å | Aromatic |
| O2 | C4 | sing | 1.34Å | 1.35Å | Aromatic |
| C31 | C30 | sing | 1.51Å | 1.52Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C29 | C30 | sing | 1.47Å | 1.46Å | |
| C30 | C32 | doub | 1.33Å | 1.35Å | |
| F1 | C2 | sing | 1.40Å | 1.33Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C2 | C34 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | sing | 1.51Å | 1.52Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C33 | O3 | sing | 1.43Å | 1.40Å | |
| N1 | H43 | sing | 0.97Å | 1.00Å | |
| N3 | H44 | sing | 0.97Å | 1.00Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C26 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| O3 | H47 | sing | 0.97Å | 0.95Å | |
| N8 | H45 | sing | 1.01Å | 1.00Å | |
| N8 | H46 | sing | 1.01Å | 1.00Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.08Å | 1.08Å | |
| C31 | H37 | sing | 1.09Å | 1.10Å | |
| C31 | H36 | sing | 1.09Å | 1.10Å | |
| C31 | H38 | sing | 1.09Å | 1.10Å | |
| C32 | H39 | sing | 1.08Å | 1.08Å | |
| C33 | H40 | sing | 1.09Å | 1.10Å | |
| C34 | H41 | sing | 1.09Å | 1.10Å | |
| C34 | H42 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N8 | C28 | C15 | 111.8° | 109.5° |
| N8 | C28 | H33 | 108.9° | 109.4° |
| N8 | C28 | H34 | 108.9° | 109.4° |
| C28 | N8 | H45 | 109.5° | 111.0° |
| C28 | N8 | H46 | 109.5° | 111.1° |
| C28 | C15 | N6 | 121.6° | 126.8° |
| C28 | C15 | C16 | 129.6° | 126.7° |
| C15 | C28 | H33 | 108.9° | 109.5° |
| C15 | C28 | H34 | 108.9° | 109.5° |
| C15 | N6 | N5 | 109.0° | 108.9° |
| N6 | C15 | C16 | 108.8° | 106.5° |
| N6 | N5 | N4 | 106.5° | 110.1° |
| C15 | C16 | N4 | 105.4° | 106.2° |
| C15 | C16 | H16 | 127.3° | 126.9° |
| N5 | N4 | C16 | 110.2° | 108.3° |
| N5 | N4 | C14 | 122.2° | 125.8° |
| C16 | N4 | C14 | 127.6° | 125.9° |
| N4 | C16 | H16 | 127.3° | 126.9° |
| N4 | C14 | C13 | 114.8° | 109.5° |
| N4 | C14 | H15 | 108.1° | 109.5° |
| N4 | C14 | H14 | 108.1° | 109.4° |
| C14 | C13 | N3 | 113.5° | 109.4° |
| C14 | C13 | H12 | 108.5° | 109.4° |
| C14 | C13 | H13 | 108.4° | 109.4° |
| C13 | C14 | H15 | 108.1° | 109.5° |
| C13 | C14 | H14 | 108.1° | 109.5° |
| C13 | N3 | C11 | 123.4° | 120.0° |
| C13 | N3 | H44 | 118.3° | 120.1° |
| N3 | C13 | H12 | 108.4° | 109.5° |
| N3 | C13 | H13 | 108.4° | 109.5° |
| C20 | C18 | C19 | 109.5° | 109.5° |
| C20 | C18 | C17 | 113.4° | 109.5° |
| C18 | C20 | H22 | 109.5° | 109.5° |
| C18 | C20 | H24 | 109.5° | 109.5° |
| C18 | C20 | H23 | 109.5° | 109.5° |
| C20 | C18 | H18 | 107.5° | 109.5° |
| O4 | C11 | N3 | 122.7° | 120.0° |
| O4 | C11 | C10 | 120.0° | 120.0° |
| N3 | C11 | C10 | 117.3° | 120.0° |
| C11 | N3 | H44 | 118.3° | 120.0° |
| C11 | C10 | C9 | 114.3° | 109.5° |
| C11 | C10 | H9 | 108.3° | 109.5° |
| C11 | C10 | H8 | 108.3° | 109.5° |
| C19 | C18 | C17 | 111.4° | 109.5° |
| C19 | C18 | H18 | 107.5° | 109.4° |
| C18 | C19 | H21 | 109.5° | 109.5° |
| C18 | C19 | H20 | 109.5° | 109.4° |
| C18 | C19 | H19 | 109.4° | 109.5° |
| C18 | C17 | C9 | 116.8° | 109.5° |
| C18 | C17 | O5 | 107.5° | 109.5° |
| C18 | C17 | H17 | 107.4° | 109.4° |
| C17 | C18 | H18 | 107.3° | 109.5° |
| C10 | C9 | C17 | 112.8° | 109.6° |
| C10 | C9 | C8 | 115.1° | 109.5° |
| C9 | C10 | H9 | 108.2° | 109.4° |
| C9 | C10 | H8 | 108.3° | 109.4° |
| C10 | C9 | H7 | 105.6° | 109.5° |
| C17 | C9 | C8 | 110.9° | 109.2° |
| C9 | C17 | O5 | 108.4° | 109.7° |
| C9 | C17 | H17 | 107.4° | 109.4° |
| C17 | C9 | H7 | 105.6° | 109.5° |
| C9 | C8 | C7 | 127.1° | 120.9° |
| C9 | C8 | H6 | 116.4° | 119.3° |
| C8 | C9 | H7 | 106.0° | 109.5° |
| C17 | O5 | C21 | 121.6° | 116.2° |
| O5 | C17 | H17 | 109.1° | 109.4° |
| O5 | C21 | C22 | 111.1° | 120.6° |
| O5 | C21 | O7 | 125.2° | 119.7° |
| C8 | C7 | C1 | 121.8° | 119.3° |
| C8 | C7 | H5 | 119.1° | 119.5° |
| C7 | C8 | H6 | 116.4° | 119.8° |
| C22 | C21 | O7 | 123.7° | 119.7° |
| C21 | C22 | C24 | 110.6° | 109.5° |
| C21 | C22 | N7 | 116.6° | 109.3° |
| C21 | C22 | H25 | 108.5° | 110.1° |
| C24 | C22 | N7 | 103.7° | 107.8° |
| C22 | C24 | C25 | 105.6° | 105.7° |
| C24 | C22 | H25 | 108.2° | 109.5° |
| C22 | C24 | H27 | 110.4° | 110.2° |
| C22 | C24 | H28 | 110.4° | 110.2° |
| C22 | N7 | C27 | 122.9° | 123.6° |
| C22 | N7 | C26 | 109.8° | 108.9° |
| N7 | C22 | H25 | 109.0° | 110.6° |
| C24 | C25 | C26 | 101.9° | 106.3° |
| C25 | C24 | H27 | 110.4° | 110.2° |
| C25 | C24 | H28 | 110.4° | 110.2° |
| C24 | C25 | H29 | 111.3° | 110.1° |
| C24 | C25 | H30 | 111.3° | 110.1° |
| C7 | C1 | N1 | 113.4° | 122.7° |
| C7 | C1 | O1 | 123.6° | 118.6° |
| C1 | C7 | H5 | 119.1° | 121.2° |
| O6 | C27 | N7 | 122.3° | 117.1° |
| O6 | C27 | C5 | 119.0° | 119.0° |
| C25 | C26 | N7 | 105.0° | 108.0° |
| C25 | C26 | H31 | 110.6° | 109.7° |
| C25 | C26 | H32 | 110.6° | 109.7° |
| C26 | C25 | H29 | 111.4° | 110.1° |
| C26 | C25 | H30 | 111.3° | 110.1° |
| C27 | N7 | C26 | 127.3° | 127.5° |
| N7 | C27 | C5 | 118.6° | 123.9° |
| N7 | C26 | H31 | 110.6° | 109.8° |
| N7 | C26 | H32 | 110.6° | 109.8° |
| C27 | C5 | C6 | 126.5° | 129.7° |
| C27 | C5 | N2 | 125.1° | 123.2° |
| N1 | C1 | O1 | 123.0° | 118.7° |
| C1 | N1 | C12 | 125.0° | 123.5° |
| C1 | N1 | H43 | 117.5° | 118.3° |
| N1 | C12 | C23 | 111.7° | 109.7° |
| C12 | N1 | H43 | 117.5° | 118.2° |
| N1 | C12 | H11 | 108.9° | 109.4° |
| N1 | C12 | H10 | 108.9° | 109.4° |
| C6 | C5 | N2 | 108.0° | 107.0° |
| C5 | C6 | O2 | 108.2° | 107.1° |
| C5 | C6 | H4 | 125.9° | 126.4° |
| C5 | N2 | C4 | 106.3° | 108.2° |
| C6 | O2 | C4 | 103.1° | 108.0° |
| O2 | C6 | H4 | 125.9° | 126.5° |
| C12 | C23 | C29 | 124.8° | 120.5° |
| C23 | C12 | H11 | 108.9° | 109.5° |
| C23 | C12 | H10 | 108.9° | 109.4° |
| C12 | C23 | H26 | 117.6° | 120.3° |
| C23 | C29 | C30 | 124.8° | 119.6° |
| C29 | C23 | H26 | 117.6° | 119.2° |
| C23 | C29 | H35 | 117.6° | 120.1° |
| N2 | C4 | O2 | 113.8° | 109.5° |
| N2 | C4 | C3 | 126.3° | 124.1° |
| O2 | C4 | C3 | 119.9° | 126.4° |
| C31 | C30 | C29 | 119.8° | 119.5° |
| C31 | C30 | C32 | 122.5° | 120.0° |
| C30 | C31 | H37 | 109.5° | 109.5° |
| C30 | C31 | H36 | 109.5° | 109.5° |
| C30 | C31 | H38 | 109.5° | 109.5° |
| C4 | C3 | C2 | 111.2° | 109.0° |
| C4 | C3 | H3 | 109.0° | 109.6° |
| C4 | C3 | H2 | 109.0° | 109.5° |
| C29 | C30 | C32 | 117.6° | 120.5° |
| C30 | C29 | H35 | 117.6° | 120.3° |
| C30 | C32 | C33 | 128.2° | 120.4° |
| C30 | C32 | H39 | 115.9° | 119.3° |
| F1 | C2 | C3 | 110.0° | 109.3° |
| F1 | C2 | C34 | 110.5° | 109.4° |
| F1 | C2 | H1 | 108.9° | 109.4° |
| C3 | C2 | C34 | 114.6° | 110.0° |
| C3 | C2 | H1 | 106.3° | 109.4° |
| C2 | C3 | H3 | 109.0° | 109.6° |
| C2 | C3 | H2 | 109.1° | 109.5° |
| C2 | C34 | C33 | 112.6° | 109.8° |
| C34 | C2 | H1 | 106.3° | 109.4° |
| C2 | C34 | H41 | 108.7° | 109.4° |
| C2 | C34 | H42 | 108.7° | 109.5° |
| C32 | C33 | C34 | 113.5° | 110.2° |
| C32 | C33 | O3 | 106.8° | 109.3° |
| C33 | C32 | H39 | 115.9° | 120.3° |
| C32 | C33 | H40 | 109.1° | 109.3° |
| C34 | C33 | O3 | 107.8° | 109.3° |
| C34 | C33 | H40 | 108.9° | 109.4° |
| C33 | C34 | H41 | 108.7° | 109.4° |
| C33 | C34 | H42 | 108.7° | 109.4° |
| C33 | O3 | H47 | 109.5° | 114.0° |
| O3 | C33 | H40 | 110.7° | 109.3° |
| H9 | C10 | H8 | 109.5° | 109.4° |
| H12 | C13 | H13 | 109.5° | 109.5° |
| H22 | C20 | H24 | 109.5° | 109.5° |
| H22 | C20 | H23 | 109.4° | 109.5° |
| H24 | C20 | H23 | 109.5° | 109.4° |
| H27 | C24 | H28 | 109.5° | 110.3° |
| H31 | C26 | H32 | 109.5° | 109.7° |
| H33 | C28 | H34 | 109.5° | 109.5° |
| H3 | C3 | H2 | 109.5° | 109.6° |
| H45 | N8 | H46 | 109.5° | 110.9° |
| H11 | C12 | H10 | 109.5° | 109.4° |
| H15 | C14 | H14 | 109.5° | 109.5° |
| H21 | C19 | H20 | 109.5° | 109.4° |
| H21 | C19 | H19 | 109.5° | 109.5° |
| H20 | C19 | H19 | 109.5° | 109.5° |
| H29 | C25 | H30 | 109.4° | 110.0° |
| H37 | C31 | H36 | 109.4° | 109.5° |
| H37 | C31 | H38 | 109.5° | 109.5° |
| H36 | C31 | H38 | 109.5° | 109.5° |
| H41 | C34 | H42 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N8 | C28 | C15 | H33 | 120.3° | 119.9° |
| N8 | C28 | C15 | H34 | 120.4° | 120.0° |
| N8 | C28 | C15 | N6 | 60.1° | 84.7° |
| N8 | C28 | C15 | C16 | 120.3° | 95.0° |
| N8 | C28 | H33 | H34 | 119.0° | 119.9° |
| C28 | N8 | H45 | H46 | 120.0° | 124.0° |
| C28 | C15 | N6 | C16 | 179.7° | 179.8° |
| C28 | C15 | N6 | N5 | 179.9° | 179.7° |
| C28 | C15 | C16 | N4 | 178.5° | 180.0° |
| C15 | C28 | H33 | H34 | 118.9° | 120.1° |
| C15 | C28 | N8 | H45 | 180.0° | 56.0° |
| C15 | C28 | N8 | H46 | 60.0° | 180.0° |
| C28 | C15 | C16 | H16 | 1.5° | 0.0° |
| C15 | N6 | N5 | N4 | 1.6° | 0.4° |
| N6 | C15 | C16 | N4 | 1.1° | 0.3° |
| N6 | C15 | C28 | H33 | 60.2° | 35.2° |
| N6 | C15 | C28 | H34 | 179.5° | 155.3° |
| N6 | C15 | C16 | H16 | 178.8° | 179.8° |
| N5 | N6 | C15 | C16 | 0.3° | 0.0° |
| N6 | N5 | N4 | C16 | 2.3° | 0.5° |
| N6 | N5 | N4 | C14 | 178.7° | 180.0° |
| C15 | C16 | N4 | N5 | 2.2° | 0.5° |
| C15 | C16 | N4 | H16 | 180.0° | 180.0° |
| C15 | C16 | N4 | C14 | 179.0° | 180.0° |
| C16 | C15 | C28 | H33 | 119.4° | 145.1° |
| C16 | C15 | C28 | H34 | 0.1° | 25.0° |
| N5 | N4 | C16 | C14 | 178.9° | 179.5° |
| N5 | N4 | C14 | C13 | 28.3° | 55.0° |
| N5 | N4 | C14 | H15 | 149.0° | 175.0° |
| N5 | N4 | C14 | H14 | 92.5° | 65.0° |
| N5 | N4 | C16 | H16 | 177.8° | 179.6° |
| C16 | N4 | C14 | C13 | 153.0° | 125.5° |
| C16 | N4 | C14 | H15 | 32.2° | 5.5° |
| C16 | N4 | C14 | H14 | 86.2° | 114.5° |
| N4 | C14 | C13 | H15 | 120.8° | 120.0° |
| N4 | C14 | C13 | H14 | 120.8° | 120.0° |
| N4 | C14 | C13 | N3 | 56.3° | 180.0° |
| N4 | C14 | C13 | H12 | 176.9° | 60.0° |
| N4 | C14 | C13 | H13 | 64.2° | 60.0° |
| N4 | C14 | H15 | H14 | 117.6° | 120.0° |
| C14 | N4 | C16 | H16 | 1.1° | 0.0° |
| C14 | C13 | N3 | H12 | 120.6° | 119.9° |
| C14 | C13 | N3 | H13 | 120.6° | 120.0° |
| C14 | C13 | N3 | C11 | 146.9° | 180.0° |
| C14 | C13 | N3 | H44 | 33.1° | 0.0° |
| C14 | C13 | H12 | H13 | 118.2° | 119.9° |
| C13 | C14 | H15 | H14 | 117.6° | 120.0° |
| C13 | N3 | C11 | O4 | 5.5° | 0.0° |
| C13 | N3 | C11 | H44 | 180.0° | 179.9° |
| C13 | N3 | C11 | C10 | 172.9° | 180.0° |
| N3 | C13 | H12 | H13 | 118.2° | 120.1° |
| N3 | C13 | C14 | H15 | 64.4° | 60.0° |
| N3 | C13 | C14 | H14 | 177.1° | 60.0° |
| C20 | C18 | C19 | C17 | 126.2° | 120.0° |
| C20 | C18 | C19 | H18 | 116.5° | 120.0° |
| C20 | C18 | C17 | H18 | 118.6° | 120.0° |
| C20 | C18 | C17 | C9 | 52.1° | 64.5° |
| C20 | C18 | C17 | O5 | 174.1° | 175.3° |
| C20 | C18 | C17 | H17 | 68.6° | 55.4° |
| C18 | C20 | H22 | H24 | 120.0° | 120.0° |
| C18 | C20 | H22 | H23 | 120.0° | 120.0° |
| C18 | C20 | H24 | H23 | 120.0° | 120.0° |
| C20 | C18 | C19 | H21 | 180.0° | 53.9° |
| C20 | C18 | C19 | H20 | 60.0° | 173.9° |
| C20 | C18 | C19 | H19 | 60.0° | 66.1° |
| O4 | C11 | N3 | C10 | 178.5° | 180.0° |
| O4 | C11 | C10 | C9 | 49.2° | 0.0° |
| O4 | C11 | N3 | H44 | 174.5° | 180.0° |
| O4 | C11 | C10 | H9 | 71.5° | 120.0° |
| O4 | C11 | C10 | H8 | 169.9° | 120.0° |
| N3 | C11 | C10 | C9 | 132.3° | 180.0° |
| N3 | C11 | C10 | H9 | 107.0° | 60.0° |
| N3 | C11 | C10 | H8 | 11.6° | 60.0° |
| C11 | N3 | C13 | H12 | 92.5° | 60.1° |
| C11 | N3 | C13 | H13 | 26.3° | 60.0° |
| C11 | C10 | C9 | H9 | 120.7° | 120.1° |
| C11 | C10 | C9 | H8 | 120.7° | 120.0° |
| C11 | C10 | C9 | C17 | 164.7° | 175.0° |
| C11 | C10 | C9 | C8 | 66.7° | 65.3° |
| C10 | C11 | N3 | H44 | 7.0° | 0.0° |
| C11 | C10 | H9 | H8 | 117.8° | 120.1° |
| C11 | C10 | C9 | H7 | 49.8° | 54.8° |
| C19 | C18 | C17 | H18 | 117.4° | 120.0° |
| C19 | C18 | C17 | C9 | 176.1° | 55.5° |
| C19 | C18 | C17 | O5 | 61.8° | 64.7° |
| C19 | C18 | C17 | H17 | 55.4° | 175.4° |
| C19 | C18 | C20 | H22 | 180.0° | 82.7° |
| C19 | C18 | C20 | H24 | 60.0° | 157.2° |
| C19 | C18 | C20 | H23 | 60.0° | 37.3° |
| C18 | C19 | H21 | H20 | 120.0° | 119.9° |
| C18 | C19 | H21 | H19 | 120.0° | 120.0° |
| C18 | C19 | H20 | H19 | 120.0° | 120.0° |
| C18 | C17 | C9 | C10 | 62.3° | 171.9° |
| C18 | C17 | C9 | O5 | 121.6° | 120.1° |
| C18 | C17 | C9 | H17 | 120.7° | 119.8° |
| C18 | C17 | C9 | C8 | 166.9° | 52.0° |
| C18 | C17 | O5 | H17 | 116.2° | 119.8° |
| C18 | C17 | O5 | C21 | 136.9° | 44.4° |
| C17 | C18 | C20 | H22 | 54.9° | 157.3° |
| C17 | C18 | C20 | H24 | 175.0° | 37.2° |
| C17 | C18 | C20 | H23 | 65.1° | 82.7° |
| C18 | C17 | C9 | H7 | 52.6° | 67.9° |
| C17 | C18 | C19 | H21 | 53.8° | 66.1° |
| C17 | C18 | C19 | H20 | 66.2° | 53.9° |
| C17 | C18 | C19 | H19 | 173.8° | 173.9° |
| C10 | C9 | C17 | C8 | 130.7° | 119.9° |
| C10 | C9 | C17 | H7 | 114.9° | 120.2° |
| C10 | C9 | C8 | H7 | 116.3° | 120.1° |
| C10 | C9 | C17 | O5 | 59.2° | 68.0° |
| C10 | C9 | C8 | C7 | 16.5° | 114.0° |
| C10 | C9 | C8 | H6 | 163.5° | 67.4° |
| C9 | C10 | H9 | H8 | 117.8° | 119.9° |
| C10 | C9 | C17 | H17 | 177.0° | 52.1° |
| C17 | C9 | C8 | H7 | 114.1° | 119.9° |
| C9 | C17 | O5 | H17 | 116.7° | 120.0° |
| C9 | C17 | O5 | C21 | 96.0° | 164.5° |
| C17 | C9 | C8 | C7 | 113.1° | 126.0° |
| C17 | C9 | C8 | H6 | 66.9° | 52.5° |
| C17 | C9 | C10 | H9 | 44.0° | 64.9° |
| C17 | C9 | C10 | H8 | 74.6° | 55.0° |
| C9 | C17 | C18 | H18 | 66.6° | 175.5° |
| C8 | C9 | C17 | O5 | 71.5° | 172.1° |
| C9 | C8 | C7 | H6 | 180.0° | 178.6° |
| C9 | C8 | C7 | C1 | 174.1° | 176.6° |
| C9 | C8 | C7 | H5 | 5.9° | 3.0° |
| C8 | C9 | C10 | H9 | 172.6° | 54.8° |
| C8 | C9 | C10 | H8 | 54.0° | 174.7° |
| C8 | C9 | C17 | H17 | 46.3° | 67.9° |
| C17 | O5 | C21 | C22 | 171.1° | 179.4° |
| C17 | O5 | C21 | O7 | 5.6° | 0.6° |
| O5 | C17 | C9 | H7 | 174.2° | 52.2° |
| O5 | C17 | C18 | H18 | 55.5° | 55.2° |
| O5 | C21 | C22 | O7 | 176.7° | 180.0° |
| O5 | C21 | C22 | C24 | 79.2° | 110.7° |
| O5 | C21 | C22 | N7 | 162.8° | 131.4° |
| C21 | O5 | C17 | H17 | 20.7° | 75.4° |
| O5 | C21 | C22 | H25 | 39.4° | 9.7° |
| C8 | C7 | C1 | H5 | 180.0° | 179.6° |
| C8 | C7 | C1 | N1 | 161.5° | 162.3° |
| C8 | C7 | C1 | O1 | 16.5° | 17.6° |
| C7 | C8 | C9 | H7 | 132.8° | 6.1° |
| C21 | C22 | C24 | N7 | 125.6° | 118.8° |
| C21 | C22 | C24 | H25 | 118.7° | 120.8° |
| C21 | C22 | N7 | H25 | 123.2° | 121.4° |
| C21 | C22 | C24 | C25 | 147.2° | 104.2° |
| C21 | C22 | N7 | C27 | 62.0° | 81.4° |
| C21 | C22 | N7 | C26 | 120.3° | 100.0° |
| C21 | C22 | C24 | H27 | 93.4° | 136.8° |
| C21 | C22 | C24 | H28 | 27.8° | 14.9° |
| O7 | C21 | C22 | C24 | 97.6° | 69.3° |
| O7 | C21 | C22 | N7 | 20.4° | 48.6° |
| O7 | C21 | C22 | H25 | 143.9° | 170.3° |
| C24 | C22 | N7 | H25 | 115.1° | 119.7° |
| C22 | C24 | C25 | H27 | 119.4° | 119.0° |
| C22 | C24 | C25 | H28 | 119.4° | 119.1° |
| C22 | C24 | C25 | C26 | 35.4° | 5.1° |
| C24 | C22 | N7 | C27 | 176.3° | 159.7° |
| C24 | C22 | N7 | C26 | 1.5° | 19.0° |
| C22 | C24 | H27 | H28 | 121.8° | 121.9° |
| C22 | C24 | C25 | H29 | 83.4° | 124.3° |
| C22 | C24 | C25 | H30 | 154.2° | 114.2° |
| N7 | C22 | C24 | C25 | 21.5° | 14.6° |
| C22 | N7 | C27 | O6 | 9.1° | 25.7° |
| C22 | N7 | C26 | C25 | 23.8° | 15.7° |
| C22 | N7 | C27 | C26 | 177.4° | 178.4° |
| C22 | N7 | C27 | C5 | 169.9° | 155.0° |
| N7 | C22 | C24 | H27 | 140.9° | 104.4° |
| N7 | C22 | C24 | H28 | 97.9° | 133.7° |
| C22 | N7 | C26 | H31 | 143.1° | 104.0° |
| C22 | N7 | C26 | H32 | 95.4° | 135.3° |
| C24 | C25 | C26 | H29 | 118.8° | 119.2° |
| C24 | C25 | C26 | H30 | 118.8° | 119.3° |
| C24 | C25 | C26 | N7 | 36.2° | 6.1° |
| C25 | C24 | C22 | H25 | 94.1° | 135.0° |
| C25 | C24 | H27 | H28 | 121.8° | 121.9° |
| C24 | C25 | C26 | H31 | 155.5° | 113.5° |
| C24 | C25 | C26 | H32 | 83.1° | 125.9° |
| C24 | C25 | H29 | H30 | 123.5° | 121.6° |
| C7 | C1 | N1 | O1 | 178.1° | 179.9° |
| C7 | C1 | N1 | C12 | 177.5° | 0.8° |
| C7 | C1 | N1 | H43 | 2.5° | 179.0° |
| C1 | C7 | C8 | H6 | 5.9° | 2.0° |
| O6 | C27 | N7 | C5 | 178.9° | 179.3° |
| O6 | C27 | N7 | C26 | 168.3° | 152.7° |
| O6 | C27 | C5 | C6 | 20.8° | 140.3° |
| O6 | C27 | C5 | N2 | 151.2° | 43.8° |
| C25 | C26 | N7 | C27 | 153.8° | 162.9° |
| C25 | C26 | N7 | H31 | 119.3° | 119.6° |
| C25 | C26 | N7 | H32 | 119.3° | 119.7° |
| C26 | C25 | C24 | H27 | 154.8° | 113.9° |
| C26 | C25 | C24 | H28 | 84.0° | 124.2° |
| C25 | C26 | H31 | H32 | 122.0° | 120.6° |
| C26 | C25 | H29 | H30 | 123.5° | 121.6° |
| N7 | C27 | C5 | C6 | 160.3° | 39.0° |
| N7 | C27 | C5 | N2 | 27.8° | 136.9° |
| C27 | N7 | C22 | H25 | 61.3° | 40.0° |
| C27 | N7 | C26 | H31 | 34.6° | 77.4° |
| C27 | N7 | C26 | H32 | 86.9° | 43.2° |
| C26 | N7 | C27 | C5 | 12.8° | 26.6° |
| C26 | N7 | C22 | H25 | 116.5° | 138.7° |
| N7 | C26 | H31 | H32 | 122.1° | 120.8° |
| N7 | C26 | C25 | H29 | 82.6° | 113.1° |
| N7 | C26 | C25 | H30 | 154.9° | 125.4° |
| C27 | C5 | C6 | N2 | 173.1° | 176.4° |
| C27 | C5 | C6 | O2 | 178.8° | 175.1° |
| C27 | C5 | N2 | C4 | 179.6° | 173.4° |
| C27 | C5 | C6 | H4 | 1.2° | 4.9° |
| C1 | N1 | C12 | H43 | 180.0° | 179.8° |
| C1 | N1 | C12 | C23 | 123.1° | 93.4° |
| N1 | C1 | C7 | H5 | 18.5° | 17.3° |
| C1 | N1 | C12 | H11 | 116.6° | 146.6° |
| C1 | N1 | C12 | H10 | 2.8° | 26.7° |
| O1 | C1 | N1 | C12 | 0.6° | 179.3° |
| O1 | C1 | N1 | H43 | 179.4° | 0.9° |
| O1 | C1 | C7 | H5 | 163.5° | 162.8° |
| N1 | C12 | C23 | H11 | 120.4° | 120.0° |
| N1 | C12 | C23 | H10 | 120.3° | 120.1° |
| N1 | C12 | C23 | C29 | 130.4° | 161.4° |
| N1 | C12 | H11 | H10 | 119.0° | 119.9° |
| N1 | C12 | C23 | H26 | 49.6° | 19.2° |
| C5 | C6 | O2 | H4 | 180.0° | 179.9° |
| C6 | C5 | N2 | C4 | 7.2° | 3.3° |
| C5 | C6 | O2 | C4 | 1.8° | 1.0° |
| N2 | C5 | C6 | O2 | 5.8° | 1.4° |
| C5 | N2 | C4 | O2 | 6.5° | 3.9° |
| C5 | N2 | C4 | C3 | 173.3° | 176.8° |
| N2 | C5 | C6 | H4 | 174.2° | 178.7° |
| C6 | O2 | C4 | N2 | 2.8° | 3.1° |
| C6 | O2 | C4 | C3 | 177.0° | 177.7° |
| C12 | C23 | C29 | H26 | 180.0° | 179.4° |
| C12 | C23 | C29 | C30 | 176.4° | 178.6° |
| C23 | C12 | N1 | H43 | 56.9° | 86.4° |
| C23 | C12 | H11 | H10 | 119.0° | 119.9° |
| C12 | C23 | C29 | H35 | 3.6° | 2.0° |
| C23 | C29 | C30 | C31 | 4.1° | 12.8° |
| C23 | C29 | C30 | H35 | 180.0° | 179.4° |
| C23 | C29 | C30 | C32 | 177.6° | 167.3° |
| C29 | C23 | C12 | H11 | 109.3° | 78.6° |
| C29 | C23 | C12 | H10 | 10.0° | 41.3° |
| N2 | C4 | O2 | C3 | 179.8° | 179.2° |
| N2 | C4 | C3 | C2 | 26.0° | 42.8° |
| N2 | C4 | C3 | H3 | 94.2° | 77.1° |
| N2 | C4 | C3 | H2 | 146.3° | 162.6° |
| O2 | C4 | C3 | C2 | 153.8° | 138.1° |
| C4 | O2 | C6 | H4 | 178.2° | 179.0° |
| O2 | C4 | C3 | H3 | 86.0° | 102.0° |
| O2 | C4 | C3 | H2 | 33.5° | 18.3° |
| C31 | C30 | C29 | C32 | 178.2° | 179.9° |
| C31 | C30 | C32 | C33 | 0.9° | 1.0° |
| C31 | C30 | C29 | H35 | 175.8° | 166.6° |
| C30 | C31 | H37 | H36 | 120.0° | 120.0° |
| C30 | C31 | H37 | H38 | 120.0° | 120.0° |
| C30 | C31 | H36 | H38 | 120.0° | 120.0° |
| C31 | C30 | C32 | H39 | 179.1° | 178.7° |
| C4 | C3 | C2 | F1 | 71.6° | 103.9° |
| C4 | C3 | C2 | H3 | 120.2° | 119.9° |
| C4 | C3 | C2 | H2 | 120.3° | 119.8° |
| C4 | C3 | C2 | C34 | 163.3° | 136.0° |
| C4 | C3 | C2 | H1 | 46.2° | 15.8° |
| C4 | C3 | H3 | H2 | 119.2° | 120.2° |
| C29 | C30 | C32 | C33 | 177.2° | 179.1° |
| C30 | C29 | C23 | H26 | 3.6° | 2.0° |
| C29 | C30 | C31 | H37 | 180.0° | 25.2° |
| C29 | C30 | C31 | H36 | 60.0° | 145.2° |
| C29 | C30 | C31 | H38 | 60.0° | 94.8° |
| C29 | C30 | C32 | H39 | 2.7° | 1.2° |
| C30 | C32 | C33 | H39 | 180.0° | 179.7° |
| C30 | C32 | C33 | C34 | 102.9° | 139.8° |
| C30 | C32 | C33 | O3 | 138.4° | 100.0° |
| C32 | C30 | C29 | H35 | 2.4° | 13.3° |
| C32 | C30 | C31 | H37 | 1.9° | 154.7° |
| C32 | C30 | C31 | H36 | 118.1° | 34.7° |
| C32 | C30 | C31 | H38 | 121.9° | 85.3° |
| C30 | C32 | C33 | H40 | 18.7° | 19.6° |
| F1 | C2 | C3 | C34 | 125.1° | 120.1° |
| F1 | C2 | C3 | H1 | 117.8° | 119.7° |
| F1 | C2 | C34 | H1 | 118.0° | 119.8° |
| F1 | C2 | C34 | C33 | 63.6° | 38.9° |
| F1 | C2 | C3 | H3 | 168.2° | 136.2° |
| F1 | C2 | C3 | H2 | 48.7° | 16.0° |
| F1 | C2 | C34 | H41 | 176.0° | 159.0° |
| F1 | C2 | C34 | H42 | 56.9° | 81.1° |
| C3 | C2 | C34 | H1 | 117.1° | 120.1° |
| C3 | C2 | C34 | C33 | 171.5° | 159.0° |
| C2 | C3 | H3 | H2 | 119.2° | 120.2° |
| C3 | C2 | C34 | H41 | 51.1° | 81.0° |
| C3 | C2 | C34 | H42 | 68.0° | 38.9° |
| C2 | C34 | C33 | C32 | 59.5° | 95.7° |
| C2 | C34 | C33 | H41 | 120.5° | 120.1° |
| C2 | C34 | C33 | H42 | 120.5° | 120.1° |
| C2 | C34 | C33 | O3 | 177.6° | 144.2° |
| C34 | C2 | C3 | H3 | 43.0° | 16.1° |
| C34 | C2 | C3 | H2 | 76.4° | 104.2° |
| C2 | C34 | C33 | H40 | 62.2° | 24.5° |
| C2 | C34 | H41 | H42 | 118.6° | 119.9° |
| C32 | C33 | C34 | O3 | 118.1° | 120.2° |
| C32 | C33 | C34 | H40 | 121.7° | 120.2° |
| C32 | C33 | O3 | H40 | 118.7° | 119.6° |
| C32 | C33 | O3 | H47 | 180.0° | 60.0° |
| C32 | C33 | C34 | H41 | 61.0° | 24.4° |
| C32 | C33 | C34 | H42 | 180.0° | 144.2° |
| C34 | C33 | O3 | H40 | 119.0° | 119.7° |
| C33 | C34 | C2 | H1 | 54.5° | 80.9° |
| C34 | C33 | O3 | H47 | 57.7° | 179.3° |
| C34 | C33 | C32 | H39 | 77.1° | 40.5° |
| C33 | C34 | H41 | H42 | 118.6° | 119.8° |
| O3 | C33 | C32 | H39 | 41.6° | 79.7° |
| O3 | C33 | C34 | H41 | 57.2° | 95.8° |
| O3 | C33 | C34 | H42 | 61.9° | 24.0° |
| H43 | N1 | C12 | H11 | 63.4° | 33.6° |
| H43 | N1 | C12 | H10 | 177.2° | 153.5° |
| H44 | N3 | C13 | H12 | 87.5° | 120.0° |
| H44 | N3 | C13 | H13 | 153.6° | 119.9° |
| H5 | C7 | C8 | H6 | 174.1° | 178.4° |
| H6 | C8 | C9 | H7 | 47.2° | 172.4° |
| H9 | C10 | C9 | H7 | 70.9° | 174.9° |
| H8 | C10 | C9 | H7 | 170.5° | 65.2° |
| H12 | C13 | C14 | H15 | 56.1° | 180.0° |
| H12 | C13 | C14 | H14 | 62.3° | 60.0° |
| H13 | C13 | C14 | H15 | 175.0° | 60.0° |
| H13 | C13 | C14 | H14 | 56.6° | 180.0° |
| H17 | C17 | C9 | H7 | 68.1° | 172.2° |
| H17 | C17 | C18 | H18 | 172.8° | 64.6° |
| H22 | C20 | H24 | H23 | 120.0° | 120.0° |
| H22 | C20 | C18 | H18 | 63.6° | 37.2° |
| H24 | C20 | C18 | H18 | 56.4° | 82.8° |
| H23 | C20 | C18 | H18 | 176.4° | 157.2° |
| H25 | C22 | C24 | H27 | 25.3° | 16.0° |
| H25 | C22 | C24 | H28 | 146.5° | 105.9° |
| H27 | C24 | C25 | H29 | 36.0° | 5.3° |
| H27 | C24 | C25 | H30 | 86.4° | 126.8° |
| H28 | C24 | C25 | H29 | 157.2° | 116.6° |
| H28 | C24 | C25 | H30 | 34.8° | 4.9° |
| H31 | C26 | C25 | H29 | 36.7° | 127.2° |
| H31 | C26 | C25 | H30 | 85.8° | 5.7° |
| H32 | C26 | C25 | H29 | 158.1° | 6.6° |
| H32 | C26 | C25 | H30 | 35.6° | 114.9° |
| H33 | C28 | N8 | H45 | 59.7° | 63.9° |
| H33 | C28 | N8 | H46 | 60.3° | 60.0° |
| H34 | C28 | N8 | H45 | 59.6° | 176.1° |
| H34 | C28 | N8 | H46 | 179.6° | 60.0° |
| H1 | C2 | C3 | H3 | 74.1° | 104.0° |
| H1 | C2 | C3 | H2 | 166.4° | 135.7° |
| H1 | C2 | C34 | H41 | 66.0° | 39.2° |
| H1 | C2 | C34 | H42 | 174.9° | 159.1° |
| H47 | O3 | C33 | H40 | 61.3° | 59.6° |
| H11 | C12 | C23 | H26 | 70.7° | 100.9° |
| H10 | C12 | C23 | H26 | 170.0° | 139.2° |
| H18 | C18 | C19 | H21 | 63.5° | 173.9° |
| H18 | C18 | C19 | H20 | 176.5° | 66.2° |
| H18 | C18 | C19 | H19 | 56.5° | 53.8° |
| H21 | C19 | H20 | H19 | 120.0° | 120.1° |
| H26 | C23 | C29 | H35 | 176.4° | 177.5° |
| H37 | C31 | H36 | H38 | 120.0° | 120.0° |
| H39 | C32 | C33 | H40 | 161.3° | 160.8° |
| H40 | C33 | C34 | H41 | 177.3° | 144.6° |
| H40 | C33 | C34 | H42 | 58.3° | 95.6° |
