E6Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C73 | C68 | sing | 1.53Å | 1.51Å | |
| C69 | C68 | sing | 1.53Å | 1.53Å | |
| C68 | C61 | sing | 1.51Å | 1.53Å | |
| C68 | C77 | sing | 1.53Å | 1.54Å | |
| C62 | C61 | doub | 1.38Å | 1.39Å | Aromatic |
| C62 | C64 | sing | 1.38Å | 1.38Å | Aromatic |
| C61 | C59 | sing | 1.38Å | 1.39Å | Aromatic |
| C64 | C66 | doub | 1.38Å | 1.38Å | Aromatic |
| C59 | C58 | doub | 1.38Å | 1.39Å | Aromatic |
| C66 | C58 | sing | 1.38Å | 1.39Å | Aromatic |
| C58 | C51 | sing | 1.51Å | 1.51Å | |
| C52 | C51 | sing | 1.53Å | 1.50Å | |
| C52 | C55 | sing | 1.53Å | 1.50Å | |
| C51 | C55 | sing | 1.53Å | 1.53Å | |
| C51 | N49 | sing | 1.47Å | 1.46Å | |
| N49 | C46 | sing | 1.47Å | 1.47Å | |
| C46 | C42 | sing | 1.53Å | 1.52Å | |
| O44 | C42 | sing | 1.43Å | 1.43Å | |
| O81 | C4 | doub | 1.22Å | 1.23Å | |
| C42 | C7 | sing | 1.52Å | 1.53Å | |
| C38 | C12 | sing | 1.53Å | 1.52Å | |
| C7 | C9 | sing | 1.52Å | 1.52Å | |
| C7 | N5 | sing | 1.48Å | 1.46Å | |
| C4 | N5 | sing | 1.36Å | 1.34Å | |
| C4 | C2 | sing | 1.51Å | 1.54Å | |
| C9 | C12 | sing | 1.53Å | 1.54Å | |
| C82 | C2 | sing | 1.52Å | 1.52Å | |
| C12 | C14 | sing | 1.53Å | 1.54Å | |
| C2 | N1 | sing | 1.47Å | 1.46Å | |
| C14 | C17 | sing | 1.53Å | 1.53Å | |
| C86 | N1 | sing | 1.48Å | 1.46Å | |
| N1 | C36 | sing | 1.36Å | 1.34Å | |
| C17 | C20 | sing | 1.53Å | 1.51Å | |
| C20 | C23 | sing | 1.53Å | 1.52Å | |
| C36 | O37 | doub | 1.21Å | 1.22Å | |
| C36 | C33 | sing | 1.51Å | 1.50Å | |
| C33 | O32 | sing | 1.43Å | 1.41Å | |
| C23 | C26 | sing | 1.53Å | 1.49Å | |
| C29 | O32 | sing | 1.43Å | 1.41Å | |
| C29 | C26 | sing | 1.53Å | 1.49Å | |
| C2 | H1 | sing | 1.11Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.08Å | 1.10Å | |
| C17 | H6 | sing | 1.10Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C29 | H13 | sing | 1.09Å | 1.10Å | |
| C29 | H14 | sing | 1.09Å | 1.10Å | |
| C33 | H15 | sing | 1.09Å | 1.10Å | |
| C33 | H16 | sing | 1.09Å | 1.10Å | |
| C38 | H17 | sing | 1.09Å | 1.10Å | |
| C38 | H18 | sing | 1.09Å | 1.10Å | |
| C38 | H19 | sing | 1.09Å | 1.10Å | |
| C42 | H20 | sing | 1.09Å | 1.10Å | |
| C46 | H21 | sing | 1.09Å | 1.10Å | |
| C46 | H22 | sing | 1.09Å | 1.10Å | |
| C52 | H23 | sing | 1.09Å | 1.10Å | |
| C52 | H24 | sing | 1.09Å | 1.10Å | |
| C55 | H25 | sing | 1.09Å | 1.10Å | |
| C55 | H26 | sing | 1.09Å | 1.10Å | |
| C59 | H27 | sing | 1.08Å | 1.08Å | |
| C62 | H28 | sing | 1.08Å | 1.08Å | |
| C64 | H29 | sing | 1.08Å | 1.08Å | |
| C66 | H30 | sing | 1.08Å | 1.08Å | |
| C69 | H31 | sing | 1.09Å | 1.10Å | |
| C69 | H32 | sing | 1.09Å | 1.10Å | |
| C69 | H33 | sing | 1.09Å | 1.10Å | |
| C7 | H34 | sing | 1.10Å | 1.10Å | |
| C73 | H35 | sing | 1.09Å | 1.10Å | |
| C73 | H36 | sing | 1.09Å | 1.10Å | |
| C73 | H37 | sing | 1.09Å | 1.10Å | |
| C77 | H38 | sing | 1.09Å | 1.10Å | |
| C77 | H39 | sing | 1.09Å | 1.10Å | |
| C77 | H40 | sing | 1.09Å | 1.10Å | |
| C82 | H41 | sing | 1.09Å | 1.10Å | |
| C82 | H42 | sing | 1.09Å | 1.10Å | |
| C82 | H43 | sing | 1.09Å | 1.10Å | |
| C86 | H44 | sing | 1.09Å | 1.10Å | |
| C86 | H45 | sing | 1.09Å | 1.10Å | |
| C86 | H46 | sing | 1.09Å | 1.10Å | |
| C9 | H47 | sing | 1.10Å | 1.10Å | |
| C9 | H48 | sing | 1.10Å | 1.10Å | |
| N49 | H49 | sing | 1.01Å | 1.00Å | |
| N5 | H51 | sing | 0.98Å | 1.00Å | |
| O44 | H52 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C73 | C68 | C69 | 109.3° | 109.4° |
| C73 | C68 | C61 | 109.6° | 109.5° |
| C73 | C68 | C77 | 108.2° | 109.5° |
| C68 | C73 | H35 | 109.5° | 109.5° |
| C68 | C73 | H36 | 109.4° | 109.5° |
| C68 | C73 | H37 | 109.5° | 109.5° |
| C69 | C68 | C61 | 111.0° | 109.5° |
| C69 | C68 | C77 | 108.5° | 109.5° |
| C68 | C69 | H31 | 109.5° | 109.5° |
| C68 | C69 | H32 | 109.5° | 109.5° |
| C68 | C69 | H33 | 109.5° | 109.5° |
| C61 | C68 | C77 | 110.2° | 109.5° |
| C68 | C61 | C62 | 120.1° | 120.0° |
| C68 | C61 | C59 | 120.8° | 120.0° |
| C68 | C77 | H38 | 109.5° | 109.5° |
| C68 | C77 | H39 | 109.5° | 109.5° |
| C68 | C77 | H40 | 109.4° | 109.4° |
| C61 | C62 | C64 | 120.8° | 120.0° |
| C62 | C61 | C59 | 119.1° | 120.0° |
| C61 | C62 | H28 | 119.6° | 120.0° |
| C62 | C64 | C66 | 119.8° | 120.0° |
| C64 | C62 | H28 | 119.6° | 120.0° |
| C62 | C64 | H29 | 120.1° | 120.0° |
| C61 | C59 | C58 | 120.3° | 120.0° |
| C61 | C59 | H27 | 119.9° | 119.9° |
| C64 | C66 | C58 | 120.3° | 120.0° |
| C66 | C64 | H29 | 120.1° | 120.0° |
| C64 | C66 | H30 | 119.9° | 120.0° |
| C59 | C58 | C66 | 119.7° | 120.1° |
| C59 | C58 | C51 | 119.0° | 120.0° |
| C58 | C59 | H27 | 119.9° | 120.1° |
| C66 | C58 | C51 | 121.3° | 120.0° |
| C58 | C66 | H30 | 119.9° | 120.0° |
| C58 | C51 | C52 | 112.9° | 117.5° |
| C58 | C51 | C55 | 131.0° | 117.5° |
| C58 | C51 | N49 | 112.6° | 115.6° |
| C51 | C52 | C55 | 61.3° | 60.0° |
| C52 | C51 | C55 | 59.4° | 60.0° |
| C52 | C51 | N49 | 115.0° | 117.5° |
| C51 | C52 | H23 | 119.8° | 117.5° |
| C51 | C52 | H24 | 119.8° | 117.5° |
| C52 | C55 | C51 | 59.3° | 60.0° |
| C55 | C52 | H23 | 119.8° | 117.5° |
| C55 | C52 | H24 | 119.8° | 117.5° |
| C52 | C55 | H25 | 120.1° | 117.5° |
| C52 | C55 | H26 | 120.1° | 117.5° |
| C55 | C51 | N49 | 113.5° | 117.5° |
| C51 | C55 | H25 | 120.1° | 117.5° |
| C51 | C55 | H26 | 120.1° | 117.5° |
| C51 | N49 | C46 | 109.6° | 111.0° |
| C51 | N49 | H49 | 109.5° | 111.0° |
| N49 | C46 | C42 | 106.4° | 109.4° |
| N49 | C46 | H21 | 110.2° | 109.5° |
| N49 | C46 | H22 | 110.2° | 109.5° |
| C46 | N49 | H49 | 109.4° | 111.0° |
| C46 | C42 | O44 | 108.8° | 109.4° |
| C46 | C42 | C7 | 108.9° | 109.4° |
| C46 | C42 | H20 | 109.3° | 109.5° |
| C42 | C46 | H21 | 110.2° | 109.4° |
| C42 | C46 | H22 | 110.2° | 109.5° |
| O44 | C42 | C7 | 110.2° | 109.5° |
| O44 | C42 | H20 | 110.5° | 109.5° |
| C42 | O44 | H52 | 109.5° | 114.0° |
| O81 | C4 | N5 | 123.6° | 121.3° |
| O81 | C4 | C2 | 121.4° | 119.0° |
| C42 | C7 | C9 | 108.8° | 111.6° |
| C42 | C7 | N5 | 111.4° | 112.0° |
| C7 | C42 | H20 | 109.1° | 109.5° |
| C42 | C7 | H34 | 108.6° | 107.9° |
| C38 | C12 | C9 | 111.5° | 111.1° |
| C38 | C12 | C14 | 111.3° | 109.0° |
| C38 | C12 | H2 | 107.5° | 109.7° |
| C12 | C38 | H17 | 109.5° | 109.5° |
| C12 | C38 | H18 | 109.5° | 109.5° |
| C12 | C38 | H19 | 109.5° | 109.4° |
| C9 | C7 | N5 | 109.9° | 109.3° |
| C7 | C9 | C12 | 114.4° | 114.0° |
| C9 | C7 | H34 | 108.6° | 108.1° |
| C7 | C9 | H47 | 108.2° | 108.9° |
| C7 | C9 | H48 | 108.2° | 108.8° |
| C7 | N5 | C4 | 123.6° | 117.1° |
| N5 | C7 | H34 | 109.5° | 107.8° |
| C7 | N5 | H51 | 118.2° | 121.4° |
| N5 | C4 | C2 | 115.0° | 119.7° |
| C4 | N5 | H51 | 118.2° | 121.4° |
| C4 | C2 | C82 | 112.7° | 111.1° |
| C4 | C2 | N1 | 110.4° | 110.8° |
| C4 | C2 | H1 | 106.8° | 107.2° |
| C9 | C12 | C14 | 111.8° | 108.3° |
| C9 | C12 | H2 | 107.2° | 110.2° |
| C12 | C9 | H47 | 108.2° | 108.8° |
| C12 | C9 | H48 | 108.3° | 108.7° |
| C82 | C2 | N1 | 112.1° | 112.6° |
| C82 | C2 | H1 | 107.0° | 107.5° |
| C2 | C82 | H41 | 109.5° | 109.5° |
| C2 | C82 | H42 | 109.5° | 109.5° |
| C2 | C82 | H43 | 109.5° | 109.5° |
| C12 | C14 | C17 | 115.0° | 111.3° |
| C14 | C12 | H2 | 107.2° | 108.3° |
| C12 | C14 | H3 | 108.1° | 108.8° |
| C12 | C14 | H4 | 108.1° | 108.9° |
| C2 | N1 | C86 | 118.3° | 119.4° |
| C2 | N1 | C36 | 118.4° | 120.4° |
| N1 | C2 | H1 | 107.6° | 107.4° |
| C14 | C17 | C20 | 114.0° | 109.9° |
| C17 | C14 | H3 | 108.1° | 109.4° |
| C17 | C14 | H4 | 108.1° | 109.7° |
| C14 | C17 | H5 | 108.3° | 111.7° |
| C14 | C17 | H6 | 108.3° | 108.4° |
| C86 | N1 | C36 | 123.3° | 120.3° |
| N1 | C86 | H44 | 109.5° | 109.5° |
| N1 | C86 | H45 | 109.5° | 109.4° |
| N1 | C86 | H46 | 109.5° | 109.5° |
| N1 | C36 | O37 | 121.9° | 123.5° |
| N1 | C36 | C33 | 118.4° | 118.8° |
| C17 | C20 | C23 | 114.3° | 110.4° |
| C20 | C17 | H5 | 108.3° | 110.8° |
| C20 | C17 | H6 | 108.3° | 108.2° |
| C17 | C20 | H7 | 108.3° | 109.1° |
| C17 | C20 | H8 | 108.3° | 109.6° |
| C20 | C23 | C26 | 113.9° | 109.5° |
| C23 | C20 | H7 | 108.2° | 109.2° |
| C23 | C20 | H8 | 108.3° | 109.6° |
| C20 | C23 | H9 | 108.3° | 110.1° |
| C20 | C23 | H10 | 108.3° | 109.2° |
| O37 | C36 | C33 | 119.7° | 117.7° |
| C36 | C33 | O32 | 108.9° | 109.0° |
| C36 | C33 | H15 | 109.6° | 109.3° |
| C36 | C33 | H16 | 109.6° | 109.7° |
| C33 | O32 | C29 | 114.1° | 114.5° |
| O32 | C33 | H15 | 109.6° | 109.2° |
| O32 | C33 | H16 | 109.6° | 109.4° |
| C23 | C26 | C29 | 111.7° | 110.0° |
| C26 | C23 | H9 | 108.3° | 110.0° |
| C26 | C23 | H10 | 108.4° | 109.1° |
| C23 | C26 | H11 | 108.9° | 109.4° |
| C23 | C26 | H12 | 108.9° | 109.6° |
| O32 | C29 | C26 | 108.5° | 109.3° |
| O32 | C29 | H13 | 109.7° | 109.8° |
| O32 | C29 | H14 | 109.7° | 109.3° |
| C29 | C26 | H11 | 108.9° | 109.2° |
| C29 | C26 | H12 | 108.9° | 109.3° |
| C26 | C29 | H13 | 109.7° | 109.8° |
| C26 | C29 | H14 | 109.7° | 109.4° |
| H3 | C14 | H4 | 109.5° | 108.7° |
| H5 | C17 | H6 | 109.5° | 107.8° |
| H7 | C20 | H8 | 109.5° | 108.9° |
| H9 | C23 | H10 | 109.5° | 109.0° |
| H11 | C26 | H12 | 109.5° | 109.3° |
| H13 | C29 | H14 | 109.5° | 109.2° |
| H15 | C33 | H16 | 109.5° | 110.2° |
| H17 | C38 | H18 | 109.5° | 109.5° |
| H17 | C38 | H19 | 109.5° | 109.4° |
| H18 | C38 | H19 | 109.4° | 109.5° |
| H21 | C46 | H22 | 109.5° | 109.5° |
| H23 | C52 | H24 | 109.5° | 115.5° |
| H25 | C55 | H26 | 109.4° | 115.6° |
| H31 | C69 | H32 | 109.4° | 109.5° |
| H31 | C69 | H33 | 109.5° | 109.4° |
| H32 | C69 | H33 | 109.5° | 109.4° |
| H35 | C73 | H36 | 109.5° | 109.5° |
| H35 | C73 | H37 | 109.5° | 109.4° |
| H36 | C73 | H37 | 109.5° | 109.4° |
| H38 | C77 | H39 | 109.4° | 109.5° |
| H38 | C77 | H40 | 109.5° | 109.5° |
| H39 | C77 | H40 | 109.5° | 109.4° |
| H41 | C82 | H42 | 109.5° | 109.5° |
| H41 | C82 | H43 | 109.4° | 109.4° |
| H42 | C82 | H43 | 109.5° | 109.4° |
| H44 | C86 | H45 | 109.5° | 109.5° |
| H44 | C86 | H46 | 109.5° | 109.5° |
| H45 | C86 | H46 | 109.4° | 109.4° |
| H47 | C9 | H48 | 109.5° | 107.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C73 | C68 | C69 | C61 | 120.9° | 120.0° |
| C73 | C68 | C69 | C77 | 117.8° | 120.0° |
| C73 | C68 | C61 | C77 | 119.0° | 120.0° |
| C73 | C68 | C61 | C62 | 4.7° | 122.8° |
| C73 | C68 | C61 | C59 | 176.2° | 57.2° |
| C73 | C68 | C69 | H31 | 180.0° | 60.9° |
| C73 | C68 | C69 | H32 | 60.0° | 59.1° |
| C73 | C68 | C69 | H33 | 60.0° | 179.1° |
| C68 | C73 | H35 | H36 | 120.0° | 120.1° |
| C68 | C73 | H35 | H37 | 120.0° | 120.0° |
| C68 | C73 | H36 | H37 | 120.0° | 120.1° |
| C73 | C68 | C77 | H38 | 180.0° | 176.3° |
| C73 | C68 | C77 | H39 | 60.0° | 56.3° |
| C73 | C68 | C77 | H40 | 60.0° | 63.7° |
| C69 | C68 | C61 | C77 | 120.3° | 120.0° |
| C69 | C68 | C61 | C62 | 125.5° | 2.8° |
| C69 | C68 | C61 | C59 | 55.5° | 177.2° |
| C68 | C69 | H31 | H32 | 120.0° | 120.1° |
| C68 | C69 | H31 | H33 | 120.0° | 120.0° |
| C68 | C69 | H32 | H33 | 120.0° | 120.0° |
| C69 | C68 | C73 | H35 | 180.0° | 174.7° |
| C69 | C68 | C73 | H36 | 60.0° | 54.7° |
| C69 | C68 | C73 | H37 | 60.0° | 65.4° |
| C69 | C68 | C77 | H38 | 61.5° | 56.4° |
| C69 | C68 | C77 | H39 | 58.5° | 63.7° |
| C69 | C68 | C77 | H40 | 178.5° | 176.4° |
| C68 | C61 | C62 | C59 | 179.1° | 180.0° |
| C68 | C61 | C62 | C64 | 179.3° | 180.0° |
| C68 | C61 | C59 | C58 | 179.9° | 179.9° |
| C68 | C61 | C59 | H27 | 0.1° | 0.0° |
| C68 | C61 | C62 | H28 | 0.7° | 0.0° |
| C61 | C68 | C69 | H31 | 59.1° | 59.0° |
| C61 | C68 | C69 | H32 | 60.9° | 179.1° |
| C61 | C68 | C69 | H33 | 179.1° | 60.9° |
| C61 | C68 | C73 | H35 | 58.2° | 65.3° |
| C61 | C68 | C73 | H36 | 178.2° | 174.7° |
| C61 | C68 | C73 | H37 | 61.8° | 54.6° |
| C61 | C68 | C77 | H38 | 60.2° | 63.7° |
| C61 | C68 | C77 | H39 | 179.8° | 176.3° |
| C61 | C68 | C77 | H40 | 59.8° | 56.3° |
| C77 | C68 | C61 | C62 | 114.3° | 117.2° |
| C77 | C68 | C61 | C59 | 64.8° | 62.8° |
| C77 | C68 | C69 | H31 | 62.2° | 179.1° |
| C77 | C68 | C69 | H32 | 177.8° | 60.9° |
| C77 | C68 | C69 | H33 | 57.8° | 59.1° |
| C77 | C68 | C73 | H35 | 62.0° | 54.7° |
| C77 | C68 | C73 | H36 | 58.0° | 65.3° |
| C77 | C68 | C73 | H37 | 178.0° | 174.7° |
| C68 | C77 | H38 | H39 | 120.0° | 120.0° |
| C68 | C77 | H38 | H40 | 120.0° | 120.0° |
| C68 | C77 | H39 | H40 | 120.0° | 119.9° |
| C61 | C62 | C64 | H28 | 180.0° | 180.0° |
| C61 | C62 | C64 | C66 | 0.6° | 0.1° |
| C62 | C61 | C59 | C58 | 0.8° | 0.1° |
| C62 | C61 | C59 | H27 | 179.2° | 180.0° |
| C61 | C62 | C64 | H29 | 179.4° | 179.9° |
| C64 | C62 | C61 | C59 | 0.2° | 0.0° |
| C62 | C64 | C66 | H29 | 180.0° | 179.9° |
| C62 | C64 | C66 | C58 | 0.8° | 0.4° |
| C62 | C64 | C66 | H30 | 179.2° | 180.0° |
| C61 | C59 | C58 | H27 | 180.0° | 179.9° |
| C61 | C59 | C58 | C66 | 0.6° | 0.3° |
| C61 | C59 | C58 | C51 | 179.6° | 180.0° |
| C59 | C61 | C62 | H28 | 179.8° | 180.0° |
| C64 | C66 | C58 | C59 | 0.2° | 0.5° |
| C64 | C66 | C58 | H30 | 180.0° | 179.6° |
| C64 | C66 | C58 | C51 | 178.8° | 179.8° |
| C66 | C64 | C62 | H28 | 179.4° | 179.8° |
| C59 | C58 | C66 | C51 | 179.0° | 179.7° |
| C59 | C58 | C51 | C52 | 73.0° | 150.5° |
| C59 | C58 | C51 | C55 | 141.6° | 140.9° |
| C59 | C58 | C51 | N49 | 59.3° | 4.7° |
| C59 | C58 | C66 | H30 | 179.8° | 179.9° |
| C66 | C58 | C51 | C52 | 108.0° | 29.2° |
| C66 | C58 | C51 | C55 | 39.4° | 39.4° |
| C66 | C58 | C51 | N49 | 119.8° | 175.0° |
| C66 | C58 | C59 | H27 | 179.4° | 179.7° |
| C58 | C66 | C64 | H29 | 179.2° | 179.7° |
| C58 | C51 | C52 | C55 | 125.3° | 107.4° |
| C58 | C51 | C52 | N49 | 131.0° | 145.1° |
| C58 | C51 | C55 | N49 | 159.0° | 145.0° |
| C58 | C51 | N49 | C46 | 72.7° | 86.2° |
| C58 | C51 | C52 | H23 | 15.5° | 0.1° |
| C58 | C51 | C52 | H24 | 124.9° | 145.0° |
| C58 | C51 | C55 | H25 | 14.4° | 145.0° |
| C58 | C51 | C55 | H26 | 155.8° | 0.0° |
| C51 | C58 | C59 | H27 | 0.4° | 0.0° |
| C51 | C58 | C66 | H30 | 1.2° | 0.2° |
| C58 | C51 | N49 | H49 | 167.3° | 149.8° |
| C51 | C52 | C55 | H23 | 109.8° | 107.5° |
| C51 | C52 | C55 | H24 | 109.8° | 107.4° |
| C52 | C51 | C55 | N49 | 106.1° | 107.5° |
| C52 | C51 | N49 | C46 | 156.1° | 128.1° |
| C51 | C52 | H23 | H24 | 144.1° | 145.6° |
| C51 | C52 | C55 | H25 | 109.3° | 107.5° |
| C51 | C52 | C55 | H26 | 109.3° | 107.5° |
| C52 | C51 | N49 | H49 | 36.1° | 4.1° |
| C55 | C52 | H23 | H24 | 144.0° | 145.7° |
| C52 | C55 | H25 | H26 | 145.1° | 145.7° |
| C55 | C51 | N49 | C46 | 90.3° | 59.5° |
| C51 | C55 | H25 | H26 | 145.1° | 145.7° |
| C55 | C51 | N49 | H49 | 29.8° | 64.5° |
| C51 | N49 | C46 | H49 | 120.0° | 124.0° |
| C51 | N49 | C46 | C42 | 172.7° | 178.3° |
| C51 | N49 | C46 | H21 | 53.1° | 58.3° |
| C51 | N49 | C46 | H22 | 67.8° | 61.7° |
| N49 | C51 | C52 | H23 | 146.5° | 145.0° |
| N49 | C51 | C52 | H24 | 6.1° | 0.1° |
| N49 | C51 | C55 | H25 | 144.6° | 0.0° |
| N49 | C51 | C55 | H26 | 3.2° | 145.0° |
| N49 | C46 | C42 | H21 | 119.5° | 120.0° |
| N49 | C46 | C42 | H22 | 119.5° | 120.0° |
| N49 | C46 | C42 | O44 | 51.1° | 46.9° |
| N49 | C46 | C42 | C7 | 171.3° | 167.0° |
| N49 | C46 | C42 | H20 | 69.6° | 73.0° |
| N49 | C46 | H21 | H22 | 121.4° | 120.1° |
| C46 | C42 | O44 | C7 | 119.3° | 120.0° |
| C46 | C42 | O44 | H20 | 120.0° | 120.0° |
| C46 | C42 | C7 | H20 | 119.2° | 120.0° |
| C46 | C42 | C7 | C9 | 169.3° | 171.8° |
| C46 | C42 | C7 | N5 | 69.4° | 65.2° |
| C42 | C46 | H21 | H22 | 121.4° | 120.0° |
| C46 | C42 | C7 | H34 | 51.3° | 53.2° |
| C42 | C46 | N49 | H49 | 67.3° | 54.3° |
| C46 | C42 | O44 | H52 | 180.0° | 60.0° |
| O44 | C42 | C7 | H20 | 121.5° | 120.0° |
| O44 | C42 | C7 | C9 | 50.0° | 51.9° |
| O44 | C42 | C7 | N5 | 171.3° | 174.8° |
| O44 | C42 | C46 | H21 | 68.4° | 166.9° |
| O44 | C42 | C46 | H22 | 170.6° | 73.1° |
| O44 | C42 | C7 | H34 | 68.0° | 66.7° |
| O81 | C4 | N5 | C7 | 1.2° | 10.0° |
| O81 | C4 | N5 | C2 | 179.8° | 178.5° |
| O81 | C4 | C2 | C82 | 19.8° | 106.2° |
| O81 | C4 | C2 | N1 | 106.3° | 127.9° |
| O81 | C4 | C2 | H1 | 137.0° | 11.0° |
| O81 | C4 | N5 | H51 | 178.8° | 167.4° |
| C42 | C7 | C9 | N5 | 122.2° | 124.4° |
| C42 | C7 | C9 | H34 | 118.0° | 118.5° |
| C42 | C7 | N5 | H34 | 120.1° | 118.5° |
| C42 | C7 | N5 | C4 | 107.1° | 58.4° |
| C42 | C7 | C9 | C12 | 178.8° | 42.8° |
| C7 | C42 | C46 | H21 | 51.8° | 73.1° |
| C7 | C42 | C46 | H22 | 69.2° | 46.9° |
| C42 | C7 | C9 | H47 | 58.1° | 164.6° |
| C42 | C7 | C9 | H48 | 60.4° | 78.7° |
| C42 | C7 | N5 | H51 | 72.8° | 124.1° |
| C7 | C42 | O44 | H52 | 60.6° | 59.9° |
| C38 | C12 | C9 | C7 | 56.9° | 51.8° |
| C38 | C12 | C9 | C14 | 125.4° | 119.7° |
| C38 | C12 | C9 | H2 | 117.4° | 121.9° |
| C38 | C12 | C14 | H2 | 117.3° | 119.4° |
| C38 | C12 | C14 | C17 | 72.9° | 48.1° |
| C38 | C12 | C14 | H3 | 166.3° | 168.8° |
| C38 | C12 | C14 | H4 | 47.9° | 72.9° |
| C12 | C38 | H17 | H18 | 120.0° | 120.1° |
| C12 | C38 | H17 | H19 | 120.0° | 120.0° |
| C12 | C38 | H18 | H19 | 120.0° | 120.0° |
| C38 | C12 | C9 | H47 | 177.6° | 70.1° |
| C38 | C12 | C9 | H48 | 63.9° | 173.4° |
| C9 | C7 | N5 | H34 | 119.2° | 117.2° |
| C9 | C7 | N5 | C4 | 132.3° | 177.3° |
| C7 | C9 | C12 | H47 | 120.7° | 121.8° |
| C7 | C9 | C12 | H48 | 120.7° | 121.6° |
| C7 | C9 | C12 | C14 | 177.8° | 171.5° |
| C7 | C9 | C12 | H2 | 60.5° | 70.1° |
| C9 | C7 | C42 | H20 | 71.4° | 68.2° |
| C7 | C9 | H47 | H48 | 117.7° | 117.7° |
| C9 | C7 | N5 | H51 | 47.8° | 0.1° |
| C7 | N5 | C4 | H51 | 180.0° | 177.4° |
| C7 | N5 | C4 | C2 | 178.7° | 171.5° |
| N5 | C7 | C9 | C12 | 56.6° | 81.6° |
| N5 | C7 | C42 | H20 | 49.8° | 54.8° |
| N5 | C7 | C9 | H47 | 64.1° | 40.1° |
| N5 | C7 | C9 | H48 | 177.3° | 156.8° |
| N5 | C4 | C2 | C82 | 160.3° | 72.3° |
| N5 | C4 | C2 | N1 | 73.6° | 53.6° |
| N5 | C4 | C2 | H1 | 43.2° | 170.5° |
| C4 | N5 | C7 | H34 | 13.0° | 60.1° |
| C4 | C2 | C82 | N1 | 125.2° | 124.9° |
| C4 | C2 | C82 | H1 | 117.1° | 117.0° |
| C4 | C2 | N1 | H1 | 116.2° | 116.8° |
| C4 | C2 | N1 | C86 | 31.8° | 101.6° |
| C4 | C2 | N1 | C36 | 148.7° | 78.5° |
| C4 | C2 | C82 | H41 | 180.0° | 57.8° |
| C4 | C2 | C82 | H42 | 60.0° | 62.2° |
| C4 | C2 | C82 | H43 | 60.0° | 177.8° |
| C2 | C4 | N5 | H51 | 1.4° | 11.1° |
| C9 | C12 | C14 | H2 | 117.3° | 119.6° |
| C9 | C12 | C14 | C17 | 161.6° | 169.1° |
| C9 | C12 | C14 | H3 | 40.9° | 70.2° |
| C9 | C12 | C14 | H4 | 77.6° | 48.1° |
| C9 | C12 | C38 | H17 | 180.0° | 59.4° |
| C9 | C12 | C38 | H18 | 60.0° | 60.7° |
| C9 | C12 | C38 | H19 | 60.0° | 179.3° |
| C12 | C9 | C7 | H34 | 63.2° | 161.3° |
| C12 | C9 | H47 | H48 | 117.8° | 117.5° |
| C82 | C2 | N1 | H1 | 117.3° | 118.2° |
| C82 | C2 | N1 | C86 | 94.7° | 133.3° |
| C82 | C2 | N1 | C36 | 84.9° | 46.6° |
| C2 | C82 | H41 | H42 | 120.0° | 120.0° |
| C2 | C82 | H41 | H43 | 120.0° | 120.0° |
| C2 | C82 | H42 | H43 | 120.0° | 120.0° |
| C12 | C14 | C17 | H3 | 120.8° | 120.3° |
| C12 | C14 | C17 | H4 | 120.8° | 120.6° |
| C12 | C14 | C17 | C20 | 54.0° | 106.8° |
| C12 | C14 | H3 | H4 | 117.5° | 118.4° |
| C12 | C14 | C17 | H5 | 174.7° | 16.5° |
| C12 | C14 | C17 | H6 | 66.7° | 135.1° |
| C14 | C12 | C38 | H17 | 54.4° | 60.0° |
| C14 | C12 | C38 | H18 | 65.7° | 180.0° |
| C14 | C12 | C38 | H19 | 174.4° | 60.0° |
| C14 | C12 | C9 | H47 | 57.1° | 49.7° |
| C14 | C12 | C9 | H48 | 61.5° | 66.9° |
| C2 | N1 | C86 | C36 | 179.6° | 180.0° |
| C2 | N1 | C36 | O37 | 1.2° | 1.5° |
| C2 | N1 | C36 | C33 | 178.9° | 178.4° |
| N1 | C2 | C82 | H41 | 54.8° | 67.1° |
| N1 | C2 | C82 | H42 | 65.2° | 172.9° |
| N1 | C2 | C82 | H43 | 174.8° | 52.9° |
| C2 | N1 | C86 | H44 | 180.0° | 88.9° |
| C2 | N1 | C86 | H45 | 60.0° | 151.1° |
| C2 | N1 | C86 | H46 | 60.0° | 31.2° |
| C14 | C17 | C20 | H5 | 120.6° | 123.9° |
| C14 | C17 | C20 | H6 | 120.7° | 118.2° |
| C14 | C17 | C20 | C23 | 65.4° | 123.7° |
| C17 | C14 | C12 | H2 | 44.3° | 71.3° |
| C17 | C14 | H3 | H4 | 117.5° | 119.7° |
| C14 | C17 | H5 | H6 | 117.9° | 119.0° |
| C14 | C17 | C20 | H7 | 173.9° | 116.3° |
| C14 | C17 | C20 | H8 | 55.3° | 2.9° |
| C86 | N1 | C36 | O37 | 179.2° | 178.6° |
| C86 | N1 | C36 | C33 | 1.5° | 1.5° |
| C86 | N1 | C2 | H1 | 147.9° | 15.2° |
| N1 | C86 | H44 | H45 | 120.1° | 120.0° |
| N1 | C86 | H44 | H46 | 120.0° | 120.1° |
| N1 | C86 | H45 | H46 | 120.0° | 120.0° |
| N1 | C36 | O37 | C33 | 177.7° | 179.9° |
| N1 | C36 | C33 | O32 | 102.0° | 177.5° |
| C36 | N1 | C2 | H1 | 32.5° | 164.8° |
| N1 | C36 | C33 | H15 | 17.9° | 63.2° |
| N1 | C36 | C33 | H16 | 138.1° | 57.7° |
| C36 | N1 | C86 | H44 | 0.4° | 91.1° |
| C36 | N1 | C86 | H45 | 120.5° | 28.9° |
| C36 | N1 | C86 | H46 | 119.6° | 148.8° |
| C17 | C20 | C23 | H7 | 120.7° | 120.0° |
| C17 | C20 | C23 | H8 | 120.7° | 120.8° |
| C17 | C20 | C23 | C26 | 171.0° | 132.2° |
| C20 | C17 | C14 | H3 | 66.8° | 132.9° |
| C20 | C17 | C14 | H4 | 174.8° | 13.8° |
| C20 | C17 | H5 | H6 | 117.9° | 118.2° |
| C17 | C20 | H7 | H8 | 117.8° | 119.6° |
| C17 | C20 | C23 | H9 | 68.3° | 11.2° |
| C17 | C20 | C23 | H10 | 50.4° | 108.3° |
| C20 | C23 | C26 | H9 | 120.7° | 121.1° |
| C20 | C23 | C26 | H10 | 120.7° | 119.5° |
| C20 | C23 | C26 | C29 | 20.7° | 137.8° |
| C23 | C20 | C17 | H5 | 55.2° | 0.2° |
| C23 | C20 | C17 | H6 | 173.9° | 118.1° |
| C23 | C20 | H7 | H8 | 117.8° | 119.6° |
| C20 | C23 | H9 | H10 | 118.0° | 119.7° |
| C20 | C23 | C26 | H11 | 141.1° | 102.2° |
| C20 | C23 | C26 | H12 | 99.6° | 17.6° |
| O37 | C36 | C33 | O32 | 75.8° | 2.5° |
| O37 | C36 | C33 | H15 | 164.3° | 116.7° |
| O37 | C36 | C33 | H16 | 44.1° | 122.3° |
| C36 | C33 | O32 | H15 | 119.9° | 119.4° |
| C36 | C33 | O32 | H16 | 119.9° | 120.0° |
| C36 | C33 | O32 | C29 | 126.9° | 123.3° |
| C36 | C33 | H15 | H16 | 120.3° | 120.7° |
| C33 | O32 | C29 | C26 | 161.0° | 145.0° |
| C33 | O32 | C29 | H13 | 41.1° | 24.5° |
| C33 | O32 | C29 | H14 | 79.2° | 95.3° |
| O32 | C33 | H15 | H16 | 120.3° | 120.2° |
| C23 | C26 | C29 | O32 | 115.0° | 145.1° |
| C23 | C26 | C29 | H11 | 120.3° | 120.1° |
| C23 | C26 | C29 | H12 | 120.3° | 120.4° |
| C26 | C23 | C20 | H7 | 50.3° | 107.8° |
| C26 | C23 | C20 | H8 | 68.2° | 11.5° |
| C26 | C23 | H9 | H10 | 118.0° | 119.5° |
| C23 | C26 | H11 | H12 | 119.0° | 120.0° |
| C23 | C26 | C29 | H13 | 4.9° | 24.5° |
| C23 | C26 | C29 | H14 | 125.2° | 95.3° |
| O32 | C29 | C26 | H13 | 119.9° | 120.5° |
| O32 | C29 | C26 | H14 | 119.9° | 119.6° |
| O32 | C29 | C26 | H11 | 5.4° | 94.9° |
| O32 | C29 | C26 | H12 | 124.7° | 24.6° |
| O32 | C29 | H13 | H14 | 120.4° | 119.8° |
| C29 | O32 | C33 | H15 | 7.0° | 117.4° |
| C29 | O32 | C33 | H16 | 113.2° | 3.3° |
| C29 | C26 | C23 | H9 | 99.9° | 16.7° |
| C29 | C26 | C23 | H10 | 141.4° | 102.7° |
| C29 | C26 | H11 | H12 | 119.0° | 119.5° |
| C26 | C29 | H13 | H14 | 120.4° | 119.9° |
| H1 | C2 | C82 | H41 | 62.9° | 174.8° |
| H1 | C2 | C82 | H42 | 177.1° | 54.8° |
| H1 | C2 | C82 | H43 | 57.1° | 65.2° |
| H2 | C12 | C14 | H3 | 76.4° | 49.4° |
| H2 | C12 | C14 | H4 | 165.1° | 167.7° |
| H2 | C12 | C38 | H17 | 62.8° | 178.5° |
| H2 | C12 | C38 | H18 | 177.2° | 61.5° |
| H2 | C12 | C38 | H19 | 57.2° | 58.5° |
| H2 | C12 | C9 | H47 | 60.2° | 168.1° |
| H2 | C12 | C9 | H48 | 178.8° | 51.5° |
| H3 | C14 | C17 | H5 | 53.9° | 103.8° |
| H3 | C14 | C17 | H6 | 172.6° | 14.8° |
| H4 | C14 | C17 | H5 | 64.5° | 137.1° |
| H4 | C14 | C17 | H6 | 54.1° | 104.3° |
| H5 | C17 | C20 | H7 | 65.5° | 119.9° |
| H5 | C17 | C20 | H8 | 175.9° | 121.0° |
| H6 | C17 | C20 | H7 | 53.2° | 2.0° |
| H6 | C17 | C20 | H8 | 65.4° | 121.1° |
| H7 | C20 | C23 | H9 | 171.0° | 131.2° |
| H7 | C20 | C23 | H10 | 70.3° | 11.7° |
| H8 | C20 | C23 | H9 | 52.4° | 109.6° |
| H8 | C20 | C23 | H10 | 171.1° | 130.9° |
| H9 | C23 | C26 | H11 | 20.4° | 136.7° |
| H9 | C23 | C26 | H12 | 139.7° | 103.5° |
| H10 | C23 | C26 | H11 | 98.3° | 17.2° |
| H10 | C23 | C26 | H12 | 21.1° | 137.0° |
| H11 | C26 | C29 | H13 | 125.2° | 144.6° |
| H11 | C26 | C29 | H14 | 114.5° | 24.8° |
| H12 | C26 | C29 | H13 | 115.4° | 95.9° |
| H12 | C26 | C29 | H14 | 4.8° | 144.3° |
| H17 | C38 | H18 | H19 | 120.0° | 119.9° |
| H20 | C42 | C46 | H21 | 170.9° | 47.0° |
| H20 | C42 | C46 | H22 | 49.9° | 167.0° |
| H20 | C42 | C7 | H34 | 170.5° | 173.2° |
| H20 | C42 | O44 | H52 | 60.0° | 180.0° |
| H21 | C46 | N49 | H49 | 173.1° | 65.7° |
| H22 | C46 | N49 | H49 | 52.2° | 174.3° |
| H23 | C52 | C55 | H25 | 0.6° | 145.0° |
| H23 | C52 | C55 | H26 | 140.9° | 0.0° |
| H24 | C52 | C55 | H25 | 140.9° | 0.0° |
| H24 | C52 | C55 | H26 | 0.6° | 145.1° |
| H28 | C62 | C64 | H29 | 0.6° | 0.1° |
| H29 | C64 | C66 | H30 | 0.8° | 0.1° |
| H31 | C69 | H32 | H33 | 120.0° | 120.0° |
| H34 | C7 | C9 | H47 | 176.1° | 76.9° |
| H34 | C7 | C9 | H48 | 57.6° | 39.8° |
| H34 | C7 | N5 | H51 | 167.0° | 117.3° |
| H35 | C73 | H36 | H37 | 120.0° | 119.9° |
| H38 | C77 | H39 | H40 | 120.0° | 120.0° |
| H41 | C82 | H42 | H43 | 120.0° | 119.9° |
| H44 | C86 | H45 | H46 | 120.0° | 120.0° |
