YCQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.52Å | 1.57Å | |
| C1 | C3 | sing | 1.53Å | 1.52Å | |
| C1 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | C5 | sing | 1.53Å | 1.57Å | |
| C2 | C6 | sing | 1.53Å | 1.54Å | |
| C2 | C7 | sing | 1.53Å | 1.56Å | |
| C2 | C3 | sing | 1.56Å | 1.54Å | |
| C4 | C8 | sing | 1.53Å | 1.55Å | |
| C4 | C9 | sing | 1.53Å | 1.56Å | |
| C5 | C10 | sing | 1.53Å | 1.57Å | |
| C5 | O11 | sing | 1.43Å | 1.43Å | |
| C6 | C12 | sing | 1.51Å | 1.57Å | |
| C6 | C13 | sing | 1.53Å | 1.56Å | |
| C7 | C14 | sing | 1.52Å | 1.55Å | |
| C8 | C15 | sing | 1.53Å | 1.59Å | |
| C8 | C16 | sing | 1.51Å | 1.52Å | |
| C9 | C13 | sing | 1.53Å | 1.51Å | |
| C10 | C15 | sing | 1.53Å | 1.57Å | |
| C12 | C17 | sing | 1.55Å | 1.60Å | |
| C12 | C18 | sing | 1.53Å | 1.54Å | |
| C12 | C19 | sing | 1.53Å | 1.56Å | |
| C14 | C17 | sing | 1.52Å | 1.56Å | |
| C15 | O20 | sing | 1.43Å | 1.40Å | |
| C16 | O21 | sing | 1.34Å | 1.39Å | |
| C16 | O22 | doub | 1.21Å | 1.23Å | |
| C17 | C23 | sing | 1.53Å | 1.57Å | |
| C17 | C24 | sing | 1.53Å | 1.57Å | |
| C18 | C25 | sing | 1.55Å | 1.57Å | |
| C23 | C26 | sing | 1.53Å | 1.56Å | |
| C23 | C25 | sing | 1.55Å | 1.57Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C26 | C28 | sing | 1.53Å | 1.55Å | |
| C27 | C29 | sing | 1.51Å | 1.51Å | |
| C29 | C30 | sing | 1.46Å | 1.50Å | |
| C29 | O31 | doub | 1.21Å | 1.23Å | |
| C30 | C32 | sing | 1.51Å | 1.54Å | |
| C30 | C33 | doub | 1.34Å | 1.33Å | |
| C32 | C34 | sing | 1.53Å | 1.56Å | |
| C32 | C35 | sing | 1.53Å | 1.54Å | |
| C10 | H47 | sing | 1.09Å | 1.10Å | |
| C10 | H46 | sing | 1.09Å | 1.10Å | |
| C13 | H50 | sing | 1.09Å | 1.10Å | |
| C13 | H49 | sing | 1.09Å | 1.10Å | |
| C15 | H53 | sing | 1.09Å | 1.10Å | |
| C18 | H55 | sing | 1.09Å | 1.10Å | |
| C18 | H54 | sing | 1.09Å | 1.10Å | |
| C19 | H57 | sing | 1.09Å | 1.10Å | |
| C19 | H58 | sing | 1.09Å | 1.10Å | |
| C19 | H56 | sing | 1.09Å | 1.10Å | |
| C23 | H61 | sing | 1.09Å | 1.10Å | |
| C24 | H64 | sing | 1.09Å | 1.10Å | |
| C24 | H62 | sing | 1.09Å | 1.10Å | |
| C24 | H63 | sing | 1.09Å | 1.10Å | |
| C25 | H66 | sing | 1.09Å | 1.10Å | |
| C25 | H65 | sing | 1.09Å | 1.10Å | |
| C26 | H67 | sing | 1.09Å | 1.10Å | |
| C27 | H68 | sing | 1.09Å | 1.10Å | |
| C27 | H69 | sing | 1.09Å | 1.10Å | |
| C28 | H71 | sing | 1.09Å | 1.10Å | |
| C28 | H70 | sing | 1.09Å | 1.10Å | |
| C28 | H72 | sing | 1.09Å | 1.10Å | |
| C3 | H40 | sing | 1.09Å | 1.10Å | |
| C3 | H39 | sing | 1.09Å | 1.10Å | |
| C4 | H36 | sing | 1.09Å | 1.10Å | |
| C5 | H41 | sing | 1.09Å | 1.10Å | |
| C6 | H37 | sing | 1.09Å | 1.10Å | |
| C7 | H42 | sing | 1.09Å | 1.10Å | |
| C7 | H43 | sing | 1.09Å | 1.10Å | |
| C8 | H38 | sing | 1.09Å | 1.10Å | |
| C9 | H45 | sing | 1.09Å | 1.10Å | |
| C9 | H44 | sing | 1.09Å | 1.10Å | |
| O11 | H48 | sing | 0.97Å | 0.95Å | |
| C14 | H51 | sing | 1.09Å | 1.10Å | |
| C14 | H52 | sing | 1.09Å | 1.10Å | |
| O20 | H59 | sing | 0.97Å | 0.95Å | |
| O21 | H60 | sing | 0.97Å | 0.95Å | |
| C32 | H73 | sing | 1.09Å | 1.10Å | |
| C33 | H75 | sing | 1.08Å | 1.08Å | |
| C33 | H74 | sing | 1.08Å | 1.08Å | |
| C34 | H77 | sing | 1.09Å | 1.10Å | |
| C34 | H76 | sing | 1.09Å | 1.10Å | |
| C34 | H78 | sing | 1.09Å | 1.10Å | |
| C35 | H81 | sing | 1.09Å | 1.10Å | |
| C35 | H80 | sing | 1.09Å | 1.10Å | |
| C35 | H79 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C3 | 59.5° | 61.3° |
| C2 | C1 | C4 | 119.8° | 119.8° |
| C2 | C1 | C5 | 123.0° | 119.4° |
| C1 | C2 | C6 | 118.2° | 120.3° |
| C1 | C2 | C7 | 119.4° | 116.4° |
| C1 | C2 | C3 | 58.6° | 59.7° |
| C3 | C1 | C4 | 120.5° | 115.6° |
| C3 | C1 | C5 | 114.7° | 116.2° |
| C1 | C3 | C2 | 61.9° | 59.0° |
| C1 | C3 | H40 | 119.7° | 117.6° |
| C1 | C3 | H39 | 119.7° | 117.6° |
| C4 | C1 | C5 | 110.5° | 114.1° |
| C1 | C4 | C8 | 107.4° | 108.5° |
| C1 | C4 | C9 | 114.5° | 107.4° |
| C1 | C4 | H36 | 108.9° | 109.9° |
| C1 | C5 | C10 | 114.5° | 108.3° |
| C1 | C5 | O11 | 111.4° | 109.7° |
| C1 | C5 | H41 | 106.8° | 109.7° |
| C6 | C2 | C7 | 118.3° | 119.6° |
| C6 | C2 | C3 | 113.6° | 112.9° |
| C2 | C6 | C12 | 117.0° | 112.4° |
| C2 | C6 | C13 | 111.4° | 112.6° |
| C2 | C6 | H37 | 105.7° | 108.0° |
| C7 | C2 | C3 | 113.7° | 112.2° |
| C2 | C7 | C14 | 119.7° | 114.6° |
| C2 | C7 | H42 | 106.9° | 108.4° |
| C2 | C7 | H43 | 106.9° | 108.4° |
| C2 | C3 | H40 | 119.7° | 117.6° |
| C2 | C3 | H39 | 119.7° | 117.6° |
| C8 | C4 | C9 | 108.9° | 110.7° |
| C4 | C8 | C15 | 114.1° | 108.9° |
| C4 | C8 | C16 | 109.3° | 109.6° |
| C8 | C4 | H36 | 108.6° | 109.9° |
| C4 | C8 | H38 | 108.1° | 109.5° |
| C4 | C9 | C13 | 110.3° | 107.1° |
| C9 | C4 | H36 | 108.5° | 110.3° |
| C4 | C9 | H45 | 109.3° | 109.9° |
| C4 | C9 | H44 | 109.3° | 109.9° |
| C10 | C5 | O11 | 108.6° | 109.7° |
| C5 | C10 | C15 | 119.2° | 110.0° |
| C5 | C10 | H47 | 107.0° | 109.4° |
| C5 | C10 | H46 | 107.0° | 109.3° |
| C10 | C5 | H41 | 106.8° | 109.7° |
| O11 | C5 | H41 | 108.5° | 109.7° |
| C5 | O11 | H48 | 109.5° | 114.0° |
| C12 | C6 | C13 | 110.6° | 108.6° |
| C6 | C12 | C17 | 110.4° | 110.0° |
| C6 | C12 | C18 | 113.2° | 116.0° |
| C6 | C12 | C19 | 110.9° | 109.6° |
| C12 | C6 | H37 | 105.5° | 107.8° |
| C6 | C13 | C9 | 111.0° | 111.6° |
| C6 | C13 | H50 | 109.1° | 109.1° |
| C6 | C13 | H49 | 109.1° | 109.0° |
| C13 | C6 | H37 | 105.5° | 107.1° |
| C7 | C14 | C17 | 114.2° | 106.9° |
| C14 | C7 | H42 | 106.9° | 108.5° |
| C14 | C7 | H43 | 106.9° | 108.5° |
| C7 | C14 | H51 | 108.3° | 110.0° |
| C7 | C14 | H52 | 108.3° | 110.0° |
| C15 | C8 | C16 | 109.3° | 109.6° |
| C8 | C15 | C10 | 117.2° | 110.3° |
| C8 | C15 | O20 | 110.2° | 109.4° |
| C8 | C15 | H53 | 104.2° | 109.2° |
| C15 | C8 | H38 | 107.6° | 109.6° |
| C8 | C16 | O21 | 112.2° | 120.0° |
| C8 | C16 | O22 | 128.4° | 120.0° |
| C16 | C8 | H38 | 108.4° | 109.7° |
| C9 | C13 | H50 | 109.1° | 109.1° |
| C9 | C13 | H49 | 109.1° | 109.0° |
| C13 | C9 | H45 | 109.3° | 109.9° |
| C13 | C9 | H44 | 109.3° | 110.0° |
| C10 | C15 | O20 | 113.6° | 109.4° |
| C15 | C10 | H47 | 107.0° | 109.4° |
| C15 | C10 | H46 | 107.0° | 109.4° |
| C10 | C15 | H53 | 104.4° | 109.3° |
| C17 | C12 | C18 | 99.9° | 102.3° |
| C17 | C12 | C19 | 117.1° | 109.6° |
| C12 | C17 | C14 | 107.9° | 105.5° |
| C12 | C17 | C23 | 100.6° | 103.4° |
| C12 | C17 | C24 | 111.7° | 110.6° |
| C18 | C12 | C19 | 104.7° | 109.0° |
| C12 | C18 | C25 | 102.8° | 103.0° |
| C12 | C18 | H55 | 111.1° | 110.7° |
| C12 | C18 | H54 | 111.1° | 110.9° |
| C12 | C19 | H57 | 109.5° | 109.4° |
| C12 | C19 | H58 | 109.5° | 109.5° |
| C12 | C19 | H56 | 109.4° | 109.5° |
| C14 | C17 | C23 | 118.3° | 115.1° |
| C14 | C17 | C24 | 109.9° | 111.3° |
| C17 | C14 | H51 | 108.3° | 109.9° |
| C17 | C14 | H52 | 108.3° | 110.0° |
| O20 | C15 | H53 | 106.1° | 109.4° |
| C15 | O20 | H59 | 109.5° | 114.0° |
| O21 | C16 | O22 | 119.4° | 120.0° |
| C16 | O21 | H60 | 109.5° | 117.0° |
| C23 | C17 | C24 | 108.2° | 110.5° |
| C17 | C23 | C26 | 116.7° | 110.2° |
| C17 | C23 | C25 | 102.8° | 105.6° |
| C17 | C23 | H61 | 107.5° | 110.3° |
| C17 | C24 | H64 | 109.5° | 109.4° |
| C17 | C24 | H62 | 109.5° | 109.4° |
| C17 | C24 | H63 | 109.5° | 109.5° |
| C18 | C25 | C23 | 107.6° | 106.5° |
| C25 | C18 | H55 | 111.1° | 110.7° |
| C25 | C18 | H54 | 111.1° | 110.7° |
| C18 | C25 | H66 | 109.9° | 110.1° |
| C18 | C25 | H65 | 109.9° | 110.1° |
| C26 | C23 | C25 | 114.2° | 110.2° |
| C23 | C26 | C27 | 112.7° | 109.5° |
| C23 | C26 | C28 | 111.1° | 109.5° |
| C26 | C23 | H61 | 107.7° | 110.2° |
| C23 | C26 | H67 | 108.0° | 109.5° |
| C25 | C23 | H61 | 107.6° | 110.3° |
| C23 | C25 | H66 | 109.9° | 110.1° |
| C23 | C25 | H65 | 109.9° | 110.0° |
| C27 | C26 | C28 | 108.4° | 109.5° |
| C26 | C27 | C29 | 111.6° | 109.5° |
| C27 | C26 | H67 | 108.3° | 109.5° |
| C26 | C27 | H68 | 108.9° | 109.5° |
| C26 | C27 | H69 | 109.0° | 109.5° |
| C28 | C26 | H67 | 108.2° | 109.4° |
| C26 | C28 | H71 | 109.5° | 109.5° |
| C26 | C28 | H70 | 109.5° | 109.5° |
| C26 | C28 | H72 | 109.5° | 109.5° |
| C27 | C29 | C30 | 118.4° | 120.0° |
| C27 | C29 | O31 | 120.0° | 120.0° |
| C29 | C27 | H68 | 108.9° | 109.5° |
| C29 | C27 | H69 | 108.9° | 109.4° |
| C30 | C29 | O31 | 121.6° | 120.0° |
| C29 | C30 | C32 | 121.7° | 120.0° |
| C29 | C30 | C33 | 120.8° | 119.9° |
| C32 | C30 | C33 | 117.4° | 120.0° |
| C30 | C32 | C34 | 116.9° | 109.5° |
| C30 | C32 | C35 | 107.3° | 109.5° |
| C30 | C32 | H73 | 106.2° | 109.5° |
| C30 | C33 | H75 | 120.0° | 119.9° |
| C30 | C33 | H74 | 120.0° | 120.0° |
| C34 | C32 | C35 | 113.5° | 109.5° |
| C34 | C32 | H73 | 106.0° | 109.4° |
| C32 | C34 | H77 | 109.5° | 109.5° |
| C32 | C34 | H76 | 109.5° | 109.5° |
| C32 | C34 | H78 | 109.5° | 109.5° |
| C35 | C32 | H73 | 106.2° | 109.5° |
| C32 | C35 | H81 | 109.5° | 109.5° |
| C32 | C35 | H80 | 109.5° | 109.5° |
| C32 | C35 | H79 | 109.5° | 109.5° |
| H47 | C10 | H46 | 109.5° | 109.4° |
| H50 | C13 | H49 | 109.5° | 109.0° |
| H55 | C18 | H54 | 109.5° | 110.6° |
| H57 | C19 | H58 | 109.5° | 109.5° |
| H57 | C19 | H56 | 109.5° | 109.4° |
| H58 | C19 | H56 | 109.5° | 109.5° |
| H64 | C24 | H62 | 109.5° | 109.5° |
| H64 | C24 | H63 | 109.4° | 109.5° |
| H62 | C24 | H63 | 109.5° | 109.5° |
| H66 | C25 | H65 | 109.5° | 110.1° |
| H68 | C27 | H69 | 109.5° | 109.5° |
| H71 | C28 | H70 | 109.4° | 109.4° |
| H71 | C28 | H72 | 109.5° | 109.4° |
| H70 | C28 | H72 | 109.5° | 109.5° |
| H40 | C3 | H39 | 109.5° | 115.7° |
| H42 | C7 | H43 | 109.5° | 108.3° |
| H45 | C9 | H44 | 109.4° | 109.9° |
| H51 | C14 | H52 | 109.5° | 110.0° |
| H75 | C33 | H74 | 119.9° | 120.0° |
| H77 | C34 | H76 | 109.5° | 109.5° |
| H77 | C34 | H78 | 109.5° | 109.4° |
| H76 | C34 | H78 | 109.5° | 109.5° |
| H81 | C35 | H80 | 109.4° | 109.5° |
| H81 | C35 | H79 | 109.4° | 109.5° |
| H80 | C35 | H79 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C3 | C4 | 108.8° | 111.5° |
| C2 | C1 | C3 | C5 | 115.1° | 110.7° |
| C2 | C1 | C4 | C5 | 152.2° | 151.1° |
| C1 | C2 | C6 | C7 | 157.1° | 157.5° |
| C1 | C2 | C6 | C3 | 65.7° | 67.2° |
| C1 | C2 | C7 | C3 | 66.1° | 66.1° |
| C2 | C1 | C4 | C8 | 137.5° | 151.7° |
| C2 | C1 | C4 | C9 | 16.5° | 32.0° |
| C2 | C1 | C5 | C10 | 163.1° | 152.9° |
| C2 | C1 | C5 | O11 | 73.1° | 87.4° |
| C1 | C2 | C6 | C12 | 156.0° | 131.3° |
| C1 | C2 | C6 | C13 | 27.2° | 8.1° |
| C1 | C2 | C7 | C14 | 168.2° | 130.7° |
| C2 | C1 | C3 | H40 | 110.0° | 107.2° |
| C2 | C1 | C3 | H39 | 110.0° | 107.2° |
| C2 | C1 | C4 | H36 | 105.1° | 88.0° |
| C2 | C1 | C5 | H41 | 45.1° | 33.2° |
| C1 | C2 | C6 | H37 | 87.0° | 110.0° |
| C1 | C2 | C7 | H42 | 46.8° | 9.4° |
| C1 | C2 | C7 | H43 | 70.3° | 107.9° |
| C3 | C1 | C4 | C5 | 137.7° | 138.7° |
| C3 | C1 | C4 | C8 | 67.4° | 81.5° |
| C3 | C1 | C4 | C9 | 53.6° | 38.2° |
| C3 | C1 | C5 | C10 | 94.6° | 82.6° |
| C3 | C1 | C5 | O11 | 141.7° | 157.7° |
| C1 | C3 | H40 | H39 | 143.7° | 146.3° |
| C3 | C1 | C4 | H36 | 175.2° | 158.2° |
| C3 | C1 | C5 | H41 | 23.4° | 37.1° |
| C4 | C1 | C2 | C6 | 8.2° | 4.3° |
| C4 | C1 | C2 | C7 | 148.6° | 153.8° |
| C1 | C4 | C8 | C9 | 124.5° | 117.6° |
| C1 | C4 | C8 | H36 | 117.6° | 120.3° |
| C1 | C4 | C9 | H36 | 121.8° | 119.8° |
| C4 | C1 | C5 | C10 | 45.7° | 55.8° |
| C4 | C1 | C5 | O11 | 78.0° | 63.9° |
| C1 | C4 | C8 | C15 | 56.3° | 58.2° |
| C1 | C4 | C8 | C16 | 179.0° | 178.0° |
| C1 | C4 | C9 | C13 | 45.1° | 63.9° |
| C4 | C1 | C3 | H40 | 141.2° | 141.4° |
| C4 | C1 | C3 | H39 | 1.2° | 4.3° |
| C4 | C1 | C5 | H41 | 163.7° | 175.5° |
| C1 | C4 | C8 | H38 | 63.3° | 61.6° |
| C1 | C4 | C9 | H45 | 75.0° | 176.7° |
| C1 | C4 | C9 | H44 | 165.3° | 55.5° |
| C5 | C1 | C2 | C6 | 156.8° | 153.9° |
| C5 | C1 | C2 | C7 | 0.0° | 4.2° |
| C5 | C1 | C4 | C8 | 70.3° | 57.2° |
| C5 | C1 | C4 | C9 | 168.7° | 176.9° |
| C1 | C5 | C10 | O11 | 125.2° | 119.7° |
| C1 | C5 | C10 | H41 | 118.0° | 119.7° |
| C1 | C5 | O11 | H41 | 117.2° | 120.6° |
| C1 | C5 | C10 | C15 | 7.7° | 56.4° |
| C1 | C5 | C10 | H47 | 113.6° | 176.5° |
| C1 | C5 | C10 | H46 | 129.1° | 63.7° |
| C5 | C1 | C3 | H40 | 5.1° | 3.6° |
| C5 | C1 | C3 | H39 | 134.9° | 142.1° |
| C5 | C1 | C4 | H36 | 47.1° | 63.1° |
| C1 | C5 | O11 | H48 | 180.0° | 180.0° |
| C6 | C2 | C7 | C3 | 137.1° | 135.6° |
| C2 | C6 | C12 | C13 | 129.1° | 125.4° |
| C2 | C6 | C12 | H37 | 117.2° | 118.9° |
| C2 | C6 | C13 | H37 | 114.3° | 118.6° |
| C6 | C2 | C7 | C14 | 11.4° | 27.6° |
| C2 | C6 | C13 | C9 | 57.3° | 41.3° |
| C2 | C6 | C12 | C17 | 38.9° | 47.4° |
| C2 | C6 | C12 | C18 | 150.0° | 162.9° |
| C2 | C6 | C12 | C19 | 92.7° | 73.2° |
| C2 | C6 | C13 | H50 | 63.0° | 79.4° |
| C2 | C6 | C13 | H49 | 177.5° | 161.7° |
| C6 | C2 | C3 | H40 | 140.4° | 140.0° |
| C6 | C2 | C3 | H39 | 0.3° | 5.6° |
| C6 | C2 | C7 | H42 | 110.0° | 148.9° |
| C6 | C2 | C7 | H43 | 132.9° | 93.7° |
| C7 | C2 | C6 | C12 | 1.1° | 26.2° |
| C7 | C2 | C6 | C13 | 129.9° | 149.3° |
| C2 | C7 | C14 | H42 | 121.4° | 121.3° |
| C2 | C7 | C14 | H43 | 121.4° | 121.3° |
| C2 | C7 | C14 | C17 | 16.1° | 49.1° |
| C7 | C2 | C3 | H40 | 1.2° | 1.4° |
| C7 | C2 | C3 | H39 | 138.9° | 144.2° |
| C7 | C2 | C6 | H37 | 115.9° | 92.6° |
| C2 | C7 | H42 | H43 | 115.4° | 117.5° |
| C2 | C7 | C14 | H51 | 104.6° | 168.4° |
| C2 | C7 | C14 | H52 | 136.8° | 70.3° |
| C3 | C2 | C6 | C12 | 138.3° | 161.5° |
| C3 | C2 | C6 | C13 | 93.0° | 75.3° |
| C3 | C2 | C7 | C14 | 125.7° | 163.2° |
| C2 | C3 | H40 | H39 | 143.7° | 146.2° |
| C3 | C2 | C6 | H37 | 21.2° | 42.7° |
| C3 | C2 | C7 | H42 | 112.9° | 75.5° |
| C3 | C2 | C7 | H43 | 4.2° | 41.9° |
| C8 | C4 | C9 | H36 | 118.0° | 121.9° |
| C4 | C8 | C15 | C16 | 122.7° | 119.8° |
| C4 | C8 | C15 | H38 | 119.9° | 119.8° |
| C4 | C8 | C16 | H38 | 117.5° | 120.3° |
| C8 | C4 | C9 | C13 | 165.3° | 177.7° |
| C4 | C8 | C15 | C10 | 19.2° | 62.3° |
| C4 | C8 | C15 | O20 | 112.6° | 58.0° |
| C4 | C8 | C16 | O21 | 46.0° | 180.0° |
| C4 | C8 | C16 | O22 | 134.0° | 0.0° |
| C4 | C8 | C15 | H53 | 133.9° | 177.6° |
| C8 | C4 | C9 | H45 | 45.1° | 58.4° |
| C8 | C4 | C9 | H44 | 74.6° | 62.8° |
| C4 | C9 | C13 | C6 | 66.9° | 72.1° |
| C9 | C4 | C8 | C15 | 179.2° | 175.9° |
| C9 | C4 | C8 | C16 | 56.5° | 64.4° |
| C4 | C9 | C13 | H45 | 120.1° | 119.4° |
| C4 | C9 | C13 | H44 | 120.1° | 119.4° |
| C4 | C9 | C13 | H50 | 53.3° | 48.5° |
| C4 | C9 | C13 | H49 | 172.8° | 167.4° |
| C9 | C4 | C8 | H38 | 61.2° | 56.0° |
| C4 | C9 | H45 | H44 | 119.6° | 121.1° |
| C10 | C5 | O11 | H41 | 115.8° | 120.6° |
| C5 | C10 | C15 | C8 | 5.3° | 61.7° |
| C5 | C10 | C15 | H47 | 121.4° | 120.1° |
| C5 | C10 | C15 | H46 | 121.4° | 120.0° |
| C5 | C10 | C15 | O20 | 135.7° | 58.6° |
| C5 | C10 | H47 | H46 | 115.6° | 119.7° |
| C5 | C10 | C15 | H53 | 109.2° | 178.3° |
| C10 | C5 | O11 | H48 | 53.0° | 61.2° |
| O11 | C5 | C10 | C15 | 117.5° | 63.3° |
| O11 | C5 | C10 | H47 | 121.2° | 56.8° |
| O11 | C5 | C10 | H46 | 3.9° | 176.6° |
| C12 | C6 | C13 | H37 | 113.6° | 116.2° |
| C12 | C6 | C13 | C9 | 170.7° | 166.5° |
| C6 | C12 | C17 | C18 | 119.5° | 123.8° |
| C6 | C12 | C17 | C19 | 128.2° | 120.6° |
| C6 | C12 | C18 | C19 | 120.9° | 124.2° |
| C6 | C12 | C17 | C14 | 65.0° | 71.8° |
| C6 | C12 | C17 | C23 | 170.5° | 166.9° |
| C6 | C12 | C17 | C24 | 56.0° | 48.6° |
| C6 | C12 | C18 | C25 | 161.1° | 160.4° |
| C12 | C6 | C13 | H50 | 69.1° | 45.9° |
| C12 | C6 | C13 | H49 | 50.4° | 73.0° |
| C6 | C12 | C18 | H55 | 42.2° | 81.2° |
| C6 | C12 | C18 | H54 | 79.9° | 42.0° |
| C6 | C12 | C19 | H57 | 180.0° | 49.9° |
| C6 | C12 | C19 | H58 | 60.0° | 169.9° |
| C6 | C12 | C19 | H56 | 60.0° | 70.1° |
| C6 | C13 | C9 | H50 | 120.2° | 120.6° |
| C6 | C13 | C9 | H49 | 120.3° | 120.5° |
| C13 | C6 | C12 | C17 | 168.0° | 172.8° |
| C13 | C6 | C12 | C18 | 80.9° | 71.7° |
| C13 | C6 | C12 | C19 | 36.5° | 52.2° |
| C6 | C13 | H50 | H49 | 119.3° | 118.9° |
| C6 | C13 | C9 | H45 | 53.2° | 168.5° |
| C6 | C13 | C9 | H44 | 172.9° | 47.3° |
| C7 | C14 | C17 | C12 | 53.1° | 70.6° |
| C7 | C14 | C17 | H51 | 120.7° | 119.4° |
| C7 | C14 | C17 | H52 | 120.7° | 119.4° |
| C7 | C14 | C17 | C23 | 166.2° | 176.1° |
| C7 | C14 | C17 | C24 | 68.9° | 49.4° |
| C14 | C7 | H42 | H43 | 115.4° | 117.6° |
| C7 | C14 | H51 | H52 | 117.8° | 121.3° |
| C15 | C8 | C16 | H38 | 117.0° | 120.4° |
| C8 | C15 | C10 | O20 | 130.3° | 120.3° |
| C8 | C15 | C10 | H53 | 114.6° | 120.0° |
| C8 | C15 | O20 | H53 | 112.2° | 119.5° |
| C15 | C8 | C16 | O21 | 79.5° | 60.6° |
| C15 | C8 | C16 | O22 | 100.5° | 119.4° |
| C8 | C15 | C10 | H47 | 126.7° | 178.2° |
| C8 | C15 | C10 | H46 | 116.0° | 58.3° |
| C15 | C8 | C4 | H36 | 61.3° | 62.1° |
| C8 | C15 | O20 | H59 | 180.0° | 179.2° |
| C16 | C8 | C15 | C10 | 141.9° | 177.9° |
| C16 | C8 | C15 | O20 | 10.0° | 61.8° |
| C8 | C16 | O21 | O22 | 180.0° | 180.0° |
| C16 | C8 | C15 | H53 | 103.4° | 57.8° |
| C16 | C8 | C4 | H36 | 61.4° | 57.7° |
| C8 | C16 | O21 | H60 | 180.0° | 180.0° |
| C9 | C13 | H50 | H49 | 119.3° | 118.9° |
| C13 | C9 | C4 | H36 | 76.7° | 55.9° |
| C9 | C13 | C6 | H37 | 57.0° | 77.3° |
| C13 | C9 | H45 | H44 | 119.6° | 121.2° |
| C10 | C15 | O20 | H53 | 114.1° | 119.6° |
| C15 | C10 | H47 | H46 | 115.6° | 119.8° |
| C15 | C10 | C5 | H41 | 125.7° | 176.1° |
| C10 | C15 | C8 | H38 | 100.6° | 57.5° |
| C10 | C15 | O20 | H59 | 46.2° | 59.9° |
| C17 | C12 | C18 | C19 | 121.6° | 116.0° |
| C12 | C17 | C14 | C23 | 113.1° | 113.3° |
| C12 | C17 | C14 | C24 | 122.0° | 120.0° |
| C12 | C17 | C23 | C24 | 117.2° | 118.4° |
| C17 | C12 | C18 | C25 | 43.7° | 40.7° |
| C12 | C17 | C23 | C26 | 163.1° | 147.2° |
| C12 | C17 | C23 | C25 | 37.4° | 28.2° |
| C17 | C12 | C18 | H55 | 75.2° | 159.1° |
| C17 | C12 | C18 | H54 | 162.6° | 77.7° |
| C17 | C12 | C19 | H57 | 52.0° | 71.0° |
| C17 | C12 | C19 | H58 | 172.0° | 49.0° |
| C17 | C12 | C19 | H56 | 68.0° | 169.1° |
| C12 | C17 | C23 | H61 | 75.9° | 90.9° |
| C12 | C17 | C24 | H64 | 180.0° | 172.9° |
| C12 | C17 | C24 | H62 | 60.0° | 67.1° |
| C12 | C17 | C24 | H63 | 60.0° | 52.8° |
| C17 | C12 | C6 | H37 | 78.3° | 71.4° |
| C12 | C17 | C14 | H51 | 67.6° | 170.0° |
| C12 | C17 | C14 | H52 | 173.8° | 48.8° |
| C18 | C12 | C17 | C14 | 175.5° | 164.4° |
| C18 | C12 | C17 | C23 | 51.0° | 43.1° |
| C18 | C12 | C17 | C24 | 63.5° | 75.2° |
| C12 | C18 | C25 | H55 | 118.9° | 118.4° |
| C12 | C18 | C25 | H54 | 118.9° | 118.6° |
| C12 | C18 | C25 | C23 | 21.0° | 23.4° |
| C12 | C18 | H55 | H54 | 123.1° | 123.3° |
| C18 | C12 | C19 | H57 | 57.6° | 177.8° |
| C18 | C12 | C19 | H58 | 62.4° | 62.2° |
| C18 | C12 | C19 | H56 | 177.6° | 57.8° |
| C12 | C18 | C25 | H66 | 140.7° | 142.7° |
| C12 | C18 | C25 | H65 | 98.7° | 95.8° |
| C18 | C12 | C6 | H37 | 32.8° | 44.1° |
| C19 | C12 | C17 | C14 | 63.3° | 48.8° |
| C19 | C12 | C17 | C23 | 61.3° | 72.5° |
| C19 | C12 | C17 | C24 | 175.8° | 169.2° |
| C19 | C12 | C18 | C25 | 78.0° | 75.3° |
| C19 | C12 | C18 | H55 | 163.2° | 43.0° |
| C19 | C12 | C18 | H54 | 41.0° | 166.2° |
| C12 | C19 | H57 | H58 | 120.0° | 120.0° |
| C12 | C19 | H57 | H56 | 120.0° | 120.0° |
| C12 | C19 | H58 | H56 | 120.0° | 120.1° |
| C19 | C12 | C6 | H37 | 150.1° | 168.0° |
| C14 | C17 | C23 | C24 | 125.7° | 127.1° |
| C14 | C17 | C23 | C26 | 79.7° | 98.3° |
| C14 | C17 | C23 | C25 | 154.6° | 142.7° |
| C14 | C17 | C23 | H61 | 41.2° | 23.6° |
| C14 | C17 | C24 | H64 | 60.3° | 70.2° |
| C14 | C17 | C24 | H62 | 59.8° | 49.7° |
| C14 | C17 | C24 | H63 | 179.8° | 169.7° |
| C17 | C14 | C7 | H42 | 137.5° | 170.4° |
| C17 | C14 | C7 | H43 | 105.4° | 72.2° |
| C17 | C14 | H51 | H52 | 117.9° | 121.2° |
| O20 | C15 | C10 | H47 | 102.9° | 61.5° |
| O20 | C15 | C10 | H46 | 14.3° | 178.6° |
| O20 | C15 | C8 | H38 | 127.5° | 177.8° |
| O21 | C16 | C8 | H38 | 163.5° | 59.8° |
| O22 | C16 | C8 | H38 | 16.5° | 120.2° |
| O22 | C16 | O21 | H60 | 0.0° | 0.0° |
| C17 | C23 | C25 | C18 | 11.1° | 3.1° |
| C17 | C23 | C26 | C25 | 119.8° | 116.1° |
| C17 | C23 | C26 | H61 | 120.9° | 121.9° |
| C17 | C23 | C25 | H61 | 113.3° | 119.1° |
| C17 | C23 | C26 | C27 | 173.0° | 173.9° |
| C17 | C23 | C26 | C28 | 65.0° | 66.1° |
| C23 | C17 | C24 | H64 | 70.2° | 59.0° |
| C23 | C17 | C24 | H62 | 169.7° | 179.0° |
| C23 | C17 | C24 | H63 | 49.7° | 61.1° |
| C17 | C23 | C25 | H66 | 108.6° | 116.2° |
| C17 | C23 | C25 | H65 | 130.8° | 122.3° |
| C17 | C23 | C26 | H67 | 53.5° | 53.9° |
| C23 | C17 | C14 | H51 | 45.6° | 56.7° |
| C23 | C17 | C14 | H52 | 73.1° | 64.5° |
| C24 | C17 | C23 | C26 | 46.0° | 28.8° |
| C24 | C17 | C23 | C25 | 79.7° | 90.1° |
| C24 | C17 | C23 | H61 | 167.0° | 150.7° |
| C17 | C24 | H64 | H62 | 120.0° | 119.9° |
| C17 | C24 | H64 | H63 | 120.0° | 120.0° |
| C17 | C24 | H62 | H63 | 120.0° | 120.0° |
| C24 | C17 | C14 | H51 | 170.4° | 70.0° |
| C24 | C17 | C14 | H52 | 51.8° | 168.8° |
| C18 | C25 | C23 | C26 | 138.4° | 122.1° |
| C18 | C25 | C23 | H66 | 119.7° | 119.3° |
| C18 | C25 | C23 | H65 | 119.7° | 119.2° |
| C25 | C18 | H55 | H54 | 123.1° | 123.1° |
| C18 | C25 | C23 | H61 | 102.2° | 116.0° |
| C18 | C25 | H66 | H65 | 120.9° | 121.5° |
| C26 | C23 | C25 | H61 | 119.4° | 121.9° |
| C23 | C26 | C27 | C28 | 123.4° | 120.0° |
| C23 | C26 | C27 | H67 | 119.4° | 120.0° |
| C23 | C26 | C28 | H67 | 118.4° | 120.0° |
| C23 | C26 | C27 | C29 | 164.5° | 175.0° |
| C26 | C23 | C25 | H66 | 18.7° | 2.8° |
| C26 | C23 | C25 | H65 | 101.9° | 118.7° |
| C23 | C26 | C27 | H68 | 44.2° | 55.0° |
| C23 | C26 | C27 | H69 | 75.2° | 65.0° |
| C23 | C26 | C28 | H71 | 180.0° | 65.8° |
| C23 | C26 | C28 | H70 | 60.0° | 54.2° |
| C23 | C26 | C28 | H72 | 60.0° | 174.2° |
| C25 | C23 | C26 | C27 | 53.2° | 57.8° |
| C25 | C23 | C26 | C28 | 175.2° | 177.8° |
| C23 | C25 | C18 | H55 | 97.9° | 141.8° |
| C23 | C25 | C18 | H54 | 139.9° | 95.1° |
| C23 | C25 | H66 | H65 | 120.9° | 121.5° |
| C25 | C23 | C26 | H67 | 66.3° | 62.2° |
| C27 | C26 | C28 | H67 | 117.2° | 120.0° |
| C26 | C27 | C29 | H68 | 120.3° | 120.0° |
| C26 | C27 | C29 | H69 | 120.3° | 120.0° |
| C26 | C27 | C29 | C30 | 152.5° | 174.8° |
| C26 | C27 | C29 | O31 | 29.2° | 5.2° |
| C27 | C26 | C23 | H61 | 66.1° | 64.2° |
| C26 | C27 | H68 | H69 | 119.0° | 120.0° |
| C27 | C26 | C28 | H71 | 55.6° | 54.2° |
| C27 | C26 | C28 | H70 | 64.4° | 174.2° |
| C27 | C26 | C28 | H72 | 175.6° | 65.8° |
| C28 | C26 | C27 | C29 | 72.1° | 65.0° |
| C28 | C26 | C23 | H61 | 55.8° | 55.8° |
| C28 | C26 | C27 | H68 | 167.6° | 175.0° |
| C28 | C26 | C27 | H69 | 48.2° | 55.0° |
| C26 | C28 | H71 | H70 | 120.0° | 120.0° |
| C26 | C28 | H71 | H72 | 120.0° | 120.0° |
| C26 | C28 | H70 | H72 | 120.0° | 120.1° |
| C27 | C29 | C30 | O31 | 178.3° | 180.0° |
| C27 | C29 | C30 | C32 | 178.9° | 175.7° |
| C27 | C29 | C30 | C33 | 2.8° | 4.4° |
| C29 | C27 | C26 | H67 | 45.1° | 55.0° |
| C29 | C27 | H68 | H69 | 119.0° | 120.0° |
| C29 | C30 | C32 | C33 | 178.3° | 180.0° |
| C29 | C30 | C32 | C34 | 20.3° | 57.6° |
| C29 | C30 | C32 | C35 | 108.4° | 62.4° |
| C30 | C29 | C27 | H68 | 87.2° | 65.2° |
| C30 | C29 | C27 | H69 | 32.1° | 54.8° |
| C29 | C30 | C32 | H73 | 138.2° | 177.6° |
| C29 | C30 | C33 | H75 | 178.3° | 180.0° |
| C29 | C30 | C33 | H74 | 1.7° | 0.1° |
| O31 | C29 | C30 | C32 | 2.8° | 4.3° |
| O31 | C29 | C30 | C33 | 175.5° | 175.7° |
| O31 | C29 | C27 | H68 | 91.1° | 114.8° |
| O31 | C29 | C27 | H69 | 149.6° | 125.2° |
| C30 | C32 | C34 | C35 | 125.7° | 120.0° |
| C30 | C32 | C34 | H73 | 118.1° | 120.0° |
| C30 | C32 | C35 | H73 | 113.3° | 120.0° |
| C32 | C30 | C33 | H75 | 0.0° | 0.0° |
| C32 | C30 | C33 | H74 | 180.0° | 179.9° |
| C30 | C32 | C34 | H77 | 180.0° | 174.0° |
| C30 | C32 | C34 | H76 | 60.0° | 53.9° |
| C30 | C32 | C34 | H78 | 60.0° | 66.1° |
| C30 | C32 | C35 | H81 | 180.0° | 64.8° |
| C30 | C32 | C35 | H80 | 60.0° | 175.2° |
| C30 | C32 | C35 | H79 | 60.0° | 55.2° |
| C33 | C30 | C32 | C34 | 158.0° | 122.3° |
| C33 | C30 | C32 | C35 | 73.3° | 117.7° |
| C33 | C30 | C32 | H73 | 40.1° | 2.3° |
| C30 | C33 | H75 | H74 | 180.0° | 179.9° |
| C34 | C32 | C35 | H73 | 116.1° | 120.0° |
| C32 | C34 | H77 | H76 | 120.0° | 120.0° |
| C32 | C34 | H77 | H78 | 120.0° | 120.0° |
| C32 | C34 | H76 | H78 | 120.0° | 120.0° |
| C34 | C32 | C35 | H81 | 49.4° | 175.2° |
| C34 | C32 | C35 | H80 | 169.4° | 55.2° |
| C34 | C32 | C35 | H79 | 70.6° | 64.8° |
| C35 | C32 | C34 | H77 | 54.3° | 66.0° |
| C35 | C32 | C34 | H76 | 65.7° | 174.0° |
| C35 | C32 | C34 | H78 | 174.3° | 54.0° |
| C32 | C35 | H81 | H80 | 120.0° | 120.0° |
| C32 | C35 | H81 | H79 | 120.0° | 120.0° |
| C32 | C35 | H80 | H79 | 120.0° | 120.0° |
| H47 | C10 | C15 | H53 | 12.2° | 58.1° |
| H47 | C10 | C5 | H41 | 4.3° | 63.8° |
| H46 | C10 | C15 | H53 | 129.4° | 61.7° |
| H46 | C10 | C5 | H41 | 113.0° | 56.0° |
| H50 | C13 | C6 | H37 | 177.3° | 162.1° |
| H50 | C13 | C9 | H45 | 173.4° | 70.9° |
| H50 | C13 | C9 | H44 | 66.9° | 167.9° |
| H49 | C13 | C6 | H37 | 63.2° | 43.2° |
| H49 | C13 | C9 | H45 | 67.0° | 48.0° |
| H49 | C13 | C9 | H44 | 52.7° | 73.2° |
| H53 | C15 | C8 | H38 | 14.1° | 62.6° |
| H53 | C15 | O20 | H59 | 67.8° | 59.7° |
| H55 | C18 | C25 | H66 | 21.7° | 98.9° |
| H55 | C18 | C25 | H65 | 142.3° | 22.6° |
| H54 | C18 | C25 | H66 | 100.4° | 24.1° |
| H54 | C18 | C25 | H65 | 20.2° | 145.6° |
| H57 | C19 | H58 | H56 | 120.0° | 120.0° |
| H61 | C23 | C25 | H66 | 138.1° | 124.7° |
| H61 | C23 | C25 | H65 | 17.5° | 3.2° |
| H61 | C23 | C26 | H67 | 174.3° | 175.8° |
| H64 | C24 | H62 | H63 | 120.0° | 120.1° |
| H67 | C26 | C27 | H68 | 75.3° | 65.0° |
| H67 | C26 | C27 | H69 | 165.4° | 175.0° |
| H67 | C26 | C28 | H71 | 61.6° | 174.2° |
| H67 | C26 | C28 | H70 | 178.4° | 65.9° |
| H67 | C26 | C28 | H72 | 58.4° | 54.2° |
| H71 | C28 | H70 | H72 | 120.0° | 120.0° |
| H36 | C4 | C8 | H38 | 179.1° | 178.1° |
| H36 | C4 | C9 | H45 | 163.2° | 63.5° |
| H36 | C4 | C9 | H44 | 43.5° | 175.3° |
| H41 | C5 | O11 | H48 | 62.8° | 59.4° |
| H42 | C7 | C14 | H51 | 16.8° | 70.3° |
| H42 | C7 | C14 | H52 | 101.8° | 51.0° |
| H43 | C7 | C14 | H51 | 133.9° | 47.1° |
| H43 | C7 | C14 | H52 | 15.3° | 168.4° |
| H73 | C32 | C34 | H77 | 61.9° | 54.0° |
| H73 | C32 | C34 | H76 | 178.1° | 66.1° |
| H73 | C32 | C34 | H78 | 58.1° | 173.9° |
| H73 | C32 | C35 | H81 | 66.7° | 55.2° |
| H73 | C32 | C35 | H80 | 53.3° | 64.8° |
| H73 | C32 | C35 | H79 | 173.3° | 175.2° |
| H77 | C34 | H76 | H78 | 120.0° | 120.0° |
| H81 | C35 | H80 | H79 | 119.9° | 120.0° |
