CA9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C4 | doub | 1.32Å | 1.35Å | |
| C1 | C6 | sing | 1.49Å | 1.52Å | |
| C1 | C21 | sing | 1.43Å | 1.26Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C5 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.50Å | 1.51Å | |
| C5 | C6 | sing | 1.54Å | 1.54Å | |
| C5 | C9 | sing | 1.54Å | 1.54Å | |
| C5 | C10 | sing | 1.53Å | 1.53Å | |
| C6 | C7 | sing | 1.54Å | 1.53Å | |
| C7 | C8 | sing | 1.54Å | 1.52Å | |
| C8 | C9 | sing | 1.54Å | 1.53Å | |
| C9 | C12 | sing | 1.53Å | 1.55Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | C14 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | C19 | sing | 1.53Å | 1.52Å | |
| C17 | O20 | sing | 1.43Å | 1.43Å | |
| C21 | C22 | trip | 1.17Å | 1.19Å | |
| C22 | C23 | sing | 1.43Å | 1.26Å | |
| C23 | C24 | sing | 1.50Å | 1.52Å | |
| C23 | C28 | doub | 1.32Å | 1.35Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.54Å | |
| C25 | O29 | sing | 1.43Å | 1.44Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C26 | C31 | sing | 1.53Å | 1.53Å | |
| C27 | C28 | sing | 1.50Å | 1.52Å | |
| C27 | O30 | sing | 1.43Å | 1.43Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| O20 | HO20 | sing | 0.97Å | 0.95Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| O29 | HO29 | sing | 0.97Å | 0.95Å | |
| O30 | HO30 | sing | 0.97Å | 0.95Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C1 | C6 | 122.6° | 124.9° |
| C4 | C1 | C21 | 117.9° | 117.5° |
| C1 | C4 | C3 | 123.1° | 122.6° |
| C1 | C4 | H4 | 118.4° | 118.7° |
| C6 | C1 | C21 | 119.5° | 117.6° |
| C1 | C6 | C5 | 116.1° | 112.0° |
| C1 | C6 | C7 | 111.6° | 110.7° |
| C1 | C6 | H6 | 102.4° | 109.9° |
| C1 | C21 | C22 | 177.8° | 179.9° |
| C3 | C2 | C5 | 114.1° | 109.5° |
| C2 | C3 | C4 | 111.2° | 109.6° |
| C3 | C2 | H2 | 108.0° | 109.5° |
| C3 | C2 | H2A | 108.0° | 109.5° |
| C2 | C3 | H3 | 108.9° | 109.4° |
| C2 | C3 | H3A | 108.9° | 109.5° |
| C2 | C5 | C6 | 113.4° | 109.4° |
| C2 | C5 | C9 | 107.8° | 108.2° |
| C2 | C5 | C10 | 108.4° | 111.3° |
| C5 | C2 | H2 | 108.0° | 109.5° |
| C5 | C2 | H2A | 108.0° | 109.5° |
| C4 | C3 | H3 | 108.9° | 109.4° |
| C4 | C3 | H3A | 108.9° | 109.4° |
| C3 | C4 | H4 | 118.5° | 118.7° |
| C6 | C5 | C9 | 106.3° | 104.2° |
| C6 | C5 | C10 | 107.9° | 111.4° |
| C5 | C6 | C7 | 107.2° | 103.5° |
| C5 | C6 | H6 | 107.3° | 109.9° |
| C9 | C5 | C10 | 113.1° | 112.1° |
| C5 | C9 | C8 | 107.9° | 106.6° |
| C5 | C9 | C12 | 117.8° | 110.0° |
| C5 | C9 | H9 | 106.7° | 110.0° |
| C5 | C10 | H10 | 109.5° | 109.5° |
| C5 | C10 | H10A | 109.5° | 109.4° |
| C5 | C10 | H10B | 109.4° | 109.4° |
| C6 | C7 | C8 | 106.2° | 104.2° |
| C7 | C6 | H6 | 112.2° | 110.6° |
| C6 | C7 | H7 | 110.6° | 110.5° |
| C6 | C7 | H7A | 110.6° | 110.5° |
| C7 | C8 | C9 | 106.8° | 106.6° |
| C8 | C7 | H7 | 110.6° | 110.5° |
| C8 | C7 | H7A | 110.6° | 110.5° |
| C7 | C8 | H8 | 110.3° | 110.0° |
| C7 | C8 | H8A | 110.3° | 110.0° |
| C8 | C9 | C12 | 114.6° | 110.0° |
| C9 | C8 | H8 | 110.4° | 110.1° |
| C9 | C8 | H8A | 110.4° | 110.0° |
| C8 | C9 | H9 | 110.6° | 110.1° |
| C9 | C12 | C13 | 110.4° | 109.4° |
| C9 | C12 | C14 | 116.3° | 109.5° |
| C12 | C9 | H9 | 98.5° | 110.1° |
| C9 | C12 | H12 | 104.1° | 109.4° |
| C13 | C12 | C14 | 109.9° | 109.5° |
| C13 | C12 | H12 | 111.3° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.5° |
| C12 | C13 | H13A | 109.4° | 109.4° |
| C12 | C13 | H13B | 109.5° | 109.5° |
| C12 | C14 | C15 | 110.9° | 109.5° |
| C14 | C12 | H12 | 104.6° | 109.5° |
| C12 | C14 | H14 | 109.0° | 109.5° |
| C12 | C14 | H14A | 109.0° | 109.5° |
| C14 | C15 | C16 | 112.1° | 109.5° |
| C15 | C14 | H14 | 109.0° | 109.5° |
| C15 | C14 | H14A | 109.0° | 109.5° |
| C14 | C15 | H15 | 108.6° | 109.5° |
| C14 | C15 | H15A | 108.6° | 109.4° |
| C15 | C16 | C17 | 114.5° | 109.4° |
| C16 | C15 | H15 | 108.6° | 109.5° |
| C16 | C15 | H15A | 108.6° | 109.5° |
| C15 | C16 | H16 | 107.8° | 109.5° |
| C15 | C16 | H16A | 107.8° | 109.5° |
| C16 | C17 | C18 | 112.1° | 109.5° |
| C16 | C17 | C19 | 109.8° | 109.5° |
| C16 | C17 | O20 | 109.4° | 109.5° |
| C17 | C16 | H16 | 107.8° | 109.4° |
| C17 | C16 | H16A | 107.8° | 109.4° |
| C18 | C17 | C19 | 109.4° | 109.5° |
| C18 | C17 | O20 | 108.3° | 109.5° |
| C17 | C18 | H18 | 109.5° | 109.5° |
| C17 | C18 | H18A | 109.5° | 109.5° |
| C17 | C18 | H18B | 109.5° | 109.5° |
| C19 | C17 | O20 | 107.8° | 109.4° |
| C17 | C19 | H19 | 109.5° | 109.5° |
| C17 | C19 | H19A | 109.5° | 109.5° |
| C17 | C19 | H19B | 109.4° | 109.5° |
| C17 | O20 | HO20 | 109.5° | 114.1° |
| C21 | C22 | C23 | 179.5° | 179.9° |
| C22 | C23 | C24 | 118.7° | 118.1° |
| C22 | C23 | C28 | 119.0° | 118.2° |
| C24 | C23 | C28 | 122.3° | 123.7° |
| C23 | C24 | C25 | 113.5° | 110.1° |
| C23 | C24 | H24 | 108.1° | 109.3° |
| C23 | C24 | H24A | 108.2° | 109.3° |
| C23 | C28 | C27 | 124.5° | 123.8° |
| C23 | C28 | H28 | 117.8° | 118.2° |
| C24 | C25 | C26 | 114.2° | 108.6° |
| C24 | C25 | O29 | 109.2° | 109.6° |
| C25 | C24 | H24 | 108.2° | 109.4° |
| C25 | C24 | H24A | 108.2° | 109.4° |
| C24 | C25 | H25 | 106.3° | 109.6° |
| C26 | C25 | O29 | 109.0° | 109.6° |
| C25 | C26 | C27 | 112.5° | 108.5° |
| C25 | C26 | C31 | 112.0° | 109.7° |
| C26 | C25 | H25 | 106.4° | 109.6° |
| C25 | C26 | H26 | 107.1° | 109.6° |
| O29 | C25 | H25 | 111.7° | 109.7° |
| C25 | O29 | HO29 | 109.5° | 114.0° |
| C27 | C26 | C31 | 113.7° | 109.6° |
| C26 | C27 | C28 | 113.3° | 110.1° |
| C26 | C27 | O30 | 111.4° | 109.4° |
| C27 | C26 | H26 | 105.1° | 109.6° |
| C26 | C27 | H27 | 105.8° | 109.4° |
| C31 | C26 | H26 | 105.7° | 109.8° |
| C26 | C31 | H31 | 109.5° | 109.5° |
| C26 | C31 | H31A | 109.5° | 109.5° |
| C26 | C31 | H31B | 109.5° | 109.5° |
| C28 | C27 | O30 | 110.4° | 109.5° |
| C28 | C27 | H27 | 106.8° | 109.2° |
| C27 | C28 | H28 | 117.8° | 118.1° |
| O30 | C27 | H27 | 108.9° | 109.3° |
| C27 | O30 | HO30 | 109.5° | 114.1° |
| H2 | C2 | H2A | 110.9° | 109.4° |
| H3 | C3 | H3A | 110.0° | 109.5° |
| H7 | C7 | H7A | 108.3° | 110.6° |
| H8 | C8 | H8A | 108.6° | 110.0° |
| H10 | C10 | H10A | 109.4° | 109.5° |
| H10 | C10 | H10B | 109.5° | 109.5° |
| H10A | C10 | H10B | 109.5° | 109.5° |
| H13 | C13 | H13A | 109.4° | 109.5° |
| H13 | C13 | H13B | 109.5° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.4° |
| H14 | C14 | H14A | 109.9° | 109.4° |
| H15 | C15 | H15A | 110.3° | 109.5° |
| H16 | C16 | H16A | 111.1° | 109.5° |
| H18 | C18 | H18A | 109.5° | 109.5° |
| H18 | C18 | H18B | 109.5° | 109.4° |
| H18A | C18 | H18B | 109.5° | 109.4° |
| H19 | C19 | H19A | 109.5° | 109.5° |
| H19 | C19 | H19B | 109.5° | 109.5° |
| H19A | C19 | H19B | 109.5° | 109.4° |
| H24 | C24 | H24A | 110.7° | 109.2° |
| H31 | C31 | H31A | 109.4° | 109.4° |
| H31 | C31 | H31B | 109.5° | 109.5° |
| H31A | C31 | H31B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C1 | C6 | C21 | 178.3° | 179.7° |
| C1 | C4 | C3 | C2 | 24.2° | 22.3° |
| C1 | C4 | C3 | H4 | 180.0° | 179.9° |
| C4 | C1 | C6 | C5 | 1.5° | 9.5° |
| C4 | C1 | C6 | C7 | 124.8° | 105.6° |
| C4 | C1 | C21 | C22 | 149.8° | 176.2° |
| C1 | C4 | C3 | H3 | 95.8° | 97.6° |
| C1 | C4 | C3 | H3A | 144.2° | 142.4° |
| C4 | C1 | C6 | H6 | 115.0° | 132.0° |
| C1 | C6 | C5 | C2 | 22.9° | 40.8° |
| C6 | C1 | C4 | C3 | 0.6° | 0.1° |
| C1 | C6 | C5 | C7 | 125.5° | 119.3° |
| C1 | C6 | C5 | H6 | 113.8° | 122.5° |
| C1 | C6 | C5 | C9 | 141.1° | 156.3° |
| C1 | C6 | C5 | C10 | 97.3° | 82.6° |
| C1 | C6 | C7 | H6 | 114.3° | 122.0° |
| C1 | C6 | C7 | C8 | 151.9° | 157.3° |
| C6 | C1 | C21 | C22 | 28.6° | 4.1° |
| C6 | C1 | C4 | H4 | 179.4° | 180.0° |
| C1 | C6 | C7 | H7 | 88.0° | 84.0° |
| C1 | C6 | C7 | H7A | 31.9° | 38.7° |
| C21 | C1 | C4 | C3 | 179.0° | 179.8° |
| C21 | C1 | C6 | C5 | 179.8° | 170.2° |
| C21 | C1 | C6 | C7 | 56.9° | 74.7° |
| C1 | C21 | C22 | C23 | 27.6° | 180.0° |
| C21 | C1 | C4 | H4 | 1.0° | 0.3° |
| C21 | C1 | C6 | H6 | 63.3° | 47.7° |
| C3 | C2 | C5 | H2 | 120.0° | 120.0° |
| C3 | C2 | C5 | H2A | 120.0° | 120.0° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 120.0° | 120.1° |
| C3 | C2 | C5 | C6 | 48.5° | 64.4° |
| C3 | C2 | C5 | C9 | 165.9° | 177.4° |
| C3 | C2 | C5 | C10 | 71.3° | 59.0° |
| C3 | C2 | H2 | H2A | 118.1° | 120.0° |
| C2 | C3 | H3 | H3A | 119.4° | 120.0° |
| C2 | C3 | C4 | H4 | 155.8° | 157.6° |
| C5 | C2 | C3 | C4 | 48.4° | 53.8° |
| C2 | C5 | C6 | C9 | 118.2° | 115.5° |
| C2 | C5 | C6 | C10 | 120.2° | 123.4° |
| C2 | C5 | C9 | C10 | 119.9° | 123.1° |
| C2 | C5 | C6 | C7 | 102.6° | 78.6° |
| C2 | C5 | C9 | C8 | 120.3° | 93.6° |
| C2 | C5 | C9 | C12 | 108.1° | 147.2° |
| C5 | C2 | H2 | H2A | 118.1° | 120.0° |
| C5 | C2 | C3 | H3 | 71.5° | 66.2° |
| C5 | C2 | C3 | H3A | 168.4° | 173.8° |
| C2 | C5 | C6 | H6 | 136.7° | 163.3° |
| C2 | C5 | C9 | H9 | 1.4° | 25.7° |
| C2 | C5 | C10 | H10 | 180.0° | 54.5° |
| C2 | C5 | C10 | H10A | 60.0° | 174.5° |
| C2 | C5 | C10 | H10B | 60.0° | 65.5° |
| C4 | C3 | C2 | H2 | 71.6° | 66.2° |
| C4 | C3 | C2 | H2A | 168.5° | 173.8° |
| C4 | C3 | H3 | H3A | 119.3° | 119.9° |
| C6 | C5 | C9 | C10 | 118.2° | 120.6° |
| C5 | C6 | C7 | H6 | 117.5° | 117.7° |
| C5 | C6 | C7 | C8 | 23.8° | 37.1° |
| C6 | C5 | C9 | C8 | 1.6° | 22.7° |
| C6 | C5 | C9 | C12 | 130.0° | 96.5° |
| C6 | C5 | C2 | H2 | 71.5° | 55.6° |
| C6 | C5 | C2 | H2A | 168.6° | 175.5° |
| C5 | C6 | C7 | H7 | 143.8° | 155.8° |
| C5 | C6 | C7 | H7A | 96.3° | 81.6° |
| C6 | C5 | C9 | H9 | 120.5° | 142.1° |
| C6 | C5 | C10 | H10 | 56.8° | 67.9° |
| C6 | C5 | C10 | H10A | 176.8° | 52.2° |
| C6 | C5 | C10 | H10B | 63.2° | 172.1° |
| C9 | C5 | C6 | C7 | 15.6° | 36.9° |
| C5 | C9 | C8 | C7 | 13.0° | 0.2° |
| C5 | C9 | C8 | C12 | 133.4° | 119.2° |
| C5 | C9 | C8 | H9 | 116.3° | 119.3° |
| C5 | C9 | C12 | H9 | 114.1° | 121.4° |
| C5 | C9 | C12 | C13 | 150.9° | 173.5° |
| C5 | C9 | C12 | C14 | 83.0° | 66.5° |
| C9 | C5 | C2 | H2 | 45.9° | 57.4° |
| C9 | C5 | C2 | H2A | 74.1° | 62.6° |
| C9 | C5 | C6 | H6 | 105.1° | 81.2° |
| C5 | C9 | C8 | H8 | 107.0° | 119.1° |
| C5 | C9 | C8 | H8A | 133.0° | 119.5° |
| C9 | C5 | C10 | H10 | 60.5° | 175.8° |
| C9 | C5 | C10 | H10A | 59.5° | 64.2° |
| C9 | C5 | C10 | H10B | 179.5° | 55.8° |
| C5 | C9 | C12 | H12 | 31.4° | 53.5° |
| C10 | C5 | C6 | C7 | 137.2° | 158.0° |
| C10 | C5 | C9 | C8 | 119.8° | 143.3° |
| C10 | C5 | C9 | C12 | 11.8° | 24.1° |
| C10 | C5 | C2 | H2 | 168.7° | 179.0° |
| C10 | C5 | C2 | H2A | 48.7° | 61.0° |
| C10 | C5 | C6 | H6 | 16.5° | 39.9° |
| C10 | C5 | C9 | H9 | 121.3° | 97.4° |
| C5 | C10 | H10 | H10A | 120.0° | 120.0° |
| C5 | C10 | H10 | H10B | 120.0° | 119.9° |
| C5 | C10 | H10A | H10B | 120.0° | 119.9° |
| C6 | C7 | C8 | H7 | 120.0° | 118.7° |
| C6 | C7 | C8 | H7A | 120.0° | 118.6° |
| C6 | C7 | C8 | C9 | 22.6° | 23.0° |
| C6 | C7 | H7 | H7A | 121.3° | 122.6° |
| C6 | C7 | C8 | H8 | 97.4° | 96.3° |
| C6 | C7 | C8 | H8A | 142.6° | 142.3° |
| C7 | C8 | C9 | H8 | 120.0° | 119.3° |
| C7 | C8 | C9 | H8A | 120.0° | 119.3° |
| C7 | C8 | C9 | C12 | 146.4° | 119.4° |
| C8 | C7 | C6 | H6 | 93.7° | 80.6° |
| C8 | C7 | H7 | H7A | 121.3° | 122.6° |
| C7 | C8 | H8 | H8A | 121.0° | 121.4° |
| C7 | C8 | C9 | H9 | 103.3° | 119.1° |
| C8 | C9 | C12 | H9 | 117.4° | 121.4° |
| C8 | C9 | C12 | C13 | 80.5° | 69.4° |
| C8 | C9 | C12 | C14 | 45.5° | 50.7° |
| C9 | C8 | C7 | H7 | 142.6° | 141.7° |
| C9 | C8 | C7 | H7A | 97.4° | 95.6° |
| C9 | C8 | H8 | H8A | 121.1° | 121.4° |
| C8 | C9 | C12 | H12 | 160.0° | 170.7° |
| C9 | C12 | C13 | C14 | 129.6° | 120.1° |
| C9 | C12 | C13 | H12 | 115.0° | 119.9° |
| C9 | C12 | C14 | H12 | 114.1° | 120.0° |
| C9 | C12 | C14 | C15 | 146.9° | 174.8° |
| C12 | C9 | C8 | H8 | 26.4° | 0.1° |
| C12 | C9 | C8 | H8A | 93.7° | 121.3° |
| C9 | C12 | C13 | H13 | 180.0° | 54.0° |
| C9 | C12 | C13 | H13A | 60.0° | 174.1° |
| C9 | C12 | C13 | H13B | 60.0° | 66.0° |
| C9 | C12 | C14 | H14 | 26.9° | 54.8° |
| C9 | C12 | C14 | H14A | 93.1° | 65.1° |
| C13 | C12 | C14 | H12 | 119.6° | 120.0° |
| C13 | C12 | C14 | C15 | 86.8° | 65.2° |
| C13 | C12 | C9 | H9 | 36.9° | 52.1° |
| C12 | C13 | H13 | H13A | 120.0° | 120.0° |
| C12 | C13 | H13 | H13B | 120.0° | 120.0° |
| C12 | C13 | H13A | H13B | 120.0° | 120.0° |
| C13 | C12 | C14 | H14 | 153.2° | 174.8° |
| C13 | C12 | C14 | H14A | 33.2° | 54.9° |
| C12 | C14 | C15 | H14 | 120.0° | 120.0° |
| C12 | C14 | C15 | H14A | 120.0° | 120.0° |
| C12 | C14 | C15 | C16 | 175.0° | 180.0° |
| C14 | C12 | C9 | H9 | 162.9° | 172.1° |
| C14 | C12 | C13 | H13 | 50.4° | 174.1° |
| C14 | C12 | C13 | H13A | 69.6° | 65.8° |
| C14 | C12 | C13 | H13B | 170.4° | 54.1° |
| C12 | C14 | H14 | H14A | 119.4° | 120.0° |
| C12 | C14 | C15 | H15 | 65.0° | 60.0° |
| C12 | C14 | C15 | H15A | 55.0° | 60.0° |
| C14 | C15 | C16 | H15 | 120.0° | 120.0° |
| C14 | C15 | C16 | H15A | 120.0° | 119.9° |
| C14 | C15 | C16 | C17 | 175.9° | 180.0° |
| C15 | C14 | C12 | H12 | 32.8° | 54.8° |
| C15 | C14 | H14 | H14A | 119.4° | 120.0° |
| C14 | C15 | H15 | H15A | 118.9° | 119.9° |
| C14 | C15 | C16 | H16 | 64.1° | 60.0° |
| C14 | C15 | C16 | H16A | 55.9° | 60.1° |
| C15 | C16 | C17 | H16 | 120.0° | 120.0° |
| C15 | C16 | C17 | H16A | 120.0° | 120.0° |
| C15 | C16 | C17 | C18 | 54.2° | 60.0° |
| C15 | C16 | C17 | C19 | 176.0° | 180.0° |
| C15 | C16 | C17 | O20 | 65.9° | 60.0° |
| C16 | C15 | C14 | H14 | 55.0° | 59.9° |
| C16 | C15 | C14 | H14A | 65.0° | 60.0° |
| C16 | C15 | H15 | H15A | 118.9° | 120.1° |
| C15 | C16 | H16 | H16A | 117.9° | 120.1° |
| C16 | C17 | C18 | C19 | 122.0° | 120.0° |
| C16 | C17 | C18 | O20 | 120.8° | 120.0° |
| C16 | C17 | C19 | O20 | 119.1° | 120.0° |
| C17 | C16 | C15 | H15 | 55.9° | 60.0° |
| C17 | C16 | C15 | H15A | 64.1° | 60.0° |
| C17 | C16 | H16 | H16A | 117.9° | 120.0° |
| C16 | C17 | C18 | H18 | 180.0° | 59.9° |
| C16 | C17 | C18 | H18A | 60.0° | 180.0° |
| C16 | C17 | C18 | H18B | 60.0° | 60.0° |
| C16 | C17 | C19 | H19 | 180.0° | 60.0° |
| C16 | C17 | C19 | H19A | 60.0° | 180.0° |
| C16 | C17 | C19 | H19B | 60.0° | 60.0° |
| C16 | C17 | O20 | HO20 | 180.0° | 59.9° |
| C18 | C17 | C19 | O20 | 117.5° | 120.0° |
| C18 | C17 | C16 | H16 | 65.8° | 60.0° |
| C18 | C17 | C16 | H16A | 174.2° | 180.0° |
| C17 | C18 | H18 | H18A | 120.0° | 120.1° |
| C17 | C18 | H18 | H18B | 120.0° | 120.0° |
| C17 | C18 | H18A | H18B | 120.0° | 120.0° |
| C18 | C17 | C19 | H19 | 56.6° | 180.0° |
| C18 | C17 | C19 | H19A | 63.4° | 59.9° |
| C18 | C17 | C19 | H19B | 176.6° | 60.0° |
| C18 | C17 | O20 | HO20 | 57.5° | 180.0° |
| C19 | C17 | C16 | H16 | 56.0° | 60.0° |
| C19 | C17 | C16 | H16A | 64.0° | 60.0° |
| C19 | C17 | C18 | H18 | 57.9° | 60.1° |
| C19 | C17 | C18 | H18A | 177.9° | 60.0° |
| C19 | C17 | C18 | H18B | 62.1° | 180.0° |
| C17 | C19 | H19 | H19A | 120.0° | 120.0° |
| C17 | C19 | H19 | H19B | 120.0° | 120.0° |
| C17 | C19 | H19A | H19B | 120.0° | 120.0° |
| C19 | C17 | O20 | HO20 | 60.7° | 60.0° |
| O20 | C17 | C16 | H16 | 174.1° | 180.0° |
| O20 | C17 | C16 | H16A | 54.1° | 60.0° |
| O20 | C17 | C18 | H18 | 59.3° | 180.0° |
| O20 | C17 | C18 | H18A | 60.7° | 60.0° |
| O20 | C17 | C18 | H18B | 179.3° | 60.0° |
| O20 | C17 | C19 | H19 | 60.9° | 60.0° |
| O20 | C17 | C19 | H19A | 179.1° | 60.1° |
| O20 | C17 | C19 | H19B | 59.1° | 180.0° |
| C21 | C22 | C23 | C24 | 109.7° | 176.2° |
| C21 | C22 | C23 | C28 | 69.8° | 3.6° |
| C22 | C23 | C24 | C28 | 179.4° | 179.7° |
| C22 | C23 | C24 | C25 | 166.1° | 162.9° |
| C22 | C23 | C28 | C27 | 179.2° | 179.3° |
| C22 | C23 | C24 | H24 | 73.9° | 42.7° |
| C22 | C23 | C24 | H24A | 46.1° | 76.9° |
| C22 | C23 | C28 | H28 | 0.8° | 0.4° |
| C23 | C24 | C25 | H24 | 120.0° | 120.1° |
| C23 | C24 | C25 | H24A | 120.0° | 120.2° |
| C23 | C24 | C25 | C26 | 39.8° | 49.8° |
| C23 | C24 | C25 | O29 | 82.5° | 169.5° |
| C24 | C23 | C28 | C27 | 1.4° | 1.0° |
| C23 | C24 | H24 | H24A | 118.3° | 119.6° |
| C23 | C24 | C25 | H25 | 156.8° | 69.9° |
| C24 | C23 | C28 | H28 | 178.6° | 179.3° |
| C28 | C23 | C24 | C25 | 14.5° | 17.5° |
| C23 | C28 | C27 | C26 | 13.3° | 17.6° |
| C23 | C28 | C27 | H28 | 180.0° | 179.8° |
| C23 | C28 | C27 | O30 | 139.1° | 102.7° |
| C28 | C23 | C24 | H24 | 105.5° | 137.7° |
| C28 | C23 | C24 | H24A | 134.5° | 102.8° |
| C23 | C28 | C27 | H27 | 102.7° | 137.7° |
| C24 | C25 | C26 | O29 | 122.4° | 119.7° |
| C24 | C25 | C26 | H25 | 117.0° | 119.8° |
| C24 | C25 | O29 | H25 | 117.3° | 120.5° |
| C24 | C25 | C26 | C27 | 52.2° | 68.1° |
| C24 | C25 | C26 | C31 | 77.3° | 172.1° |
| C25 | C24 | H24 | H24A | 118.4° | 119.7° |
| C24 | C25 | C26 | H26 | 167.3° | 51.6° |
| C24 | C25 | O29 | HO29 | 180.0° | 60.0° |
| C26 | C25 | O29 | H25 | 117.3° | 120.4° |
| C25 | C26 | C27 | C31 | 128.7° | 119.8° |
| C25 | C26 | C27 | H26 | 116.2° | 119.6° |
| C25 | C26 | C31 | H26 | 116.3° | 120.4° |
| C25 | C26 | C27 | C28 | 37.7° | 49.9° |
| C25 | C26 | C27 | O30 | 162.9° | 70.4° |
| C26 | C25 | C24 | H24 | 80.2° | 169.9° |
| C26 | C25 | C24 | H24A | 159.8° | 70.4° |
| C25 | C26 | C27 | H27 | 78.9° | 169.9° |
| C26 | C25 | O29 | HO29 | 54.6° | 179.1° |
| C25 | C26 | C31 | H31 | 180.0° | 60.0° |
| C25 | C26 | C31 | H31A | 60.0° | 180.0° |
| C25 | C26 | C31 | H31B | 60.0° | 60.0° |
| O29 | C25 | C26 | C27 | 70.2° | 172.2° |
| O29 | C25 | C26 | C31 | 160.3° | 52.4° |
| O29 | C25 | C24 | H24 | 157.5° | 70.3° |
| O29 | C25 | C24 | H24A | 37.5° | 49.3° |
| O29 | C25 | C26 | H26 | 44.9° | 68.2° |
| C27 | C26 | C31 | H26 | 114.8° | 120.5° |
| C26 | C27 | C28 | O30 | 125.7° | 120.3° |
| C26 | C27 | C28 | H27 | 116.0° | 120.1° |
| C26 | C27 | O30 | H27 | 116.3° | 119.7° |
| C27 | C26 | C25 | H25 | 169.2° | 51.6° |
| C26 | C27 | C28 | H28 | 166.7° | 162.6° |
| C26 | C27 | O30 | HO30 | 180.0° | 180.0° |
| C27 | C26 | C31 | H31 | 51.1° | 179.1° |
| C27 | C26 | C31 | H31A | 68.9° | 61.0° |
| C27 | C26 | C31 | H31B | 171.1° | 59.1° |
| C31 | C26 | C27 | C28 | 91.0° | 169.7° |
| C31 | C26 | C27 | O30 | 34.2° | 49.3° |
| C31 | C26 | C25 | H25 | 39.7° | 68.1° |
| C31 | C26 | C27 | H27 | 152.4° | 70.3° |
| C26 | C31 | H31 | H31A | 120.0° | 120.0° |
| C26 | C31 | H31 | H31B | 120.0° | 120.0° |
| C26 | C31 | H31A | H31B | 120.0° | 120.0° |
| C28 | C27 | O30 | H27 | 116.9° | 119.6° |
| C28 | C27 | C26 | H26 | 153.9° | 69.7° |
| C28 | C27 | O30 | HO30 | 53.1° | 59.3° |
| O30 | C27 | C26 | H26 | 80.9° | 169.9° |
| O30 | C27 | C28 | H28 | 41.0° | 77.1° |
| H2 | C2 | C3 | H3 | 168.4° | 173.8° |
| H2 | C2 | C3 | H3A | 48.4° | 53.8° |
| H2A | C2 | C3 | H3 | 48.5° | 53.9° |
| H2A | C2 | C3 | H3A | 71.6° | 66.1° |
| H3 | C3 | C4 | H4 | 84.2° | 82.5° |
| H3A | C3 | C4 | H4 | 35.8° | 37.5° |
| H6 | C6 | C7 | H7 | 26.3° | 38.0° |
| H6 | C6 | C7 | H7A | 146.2° | 160.7° |
| H7 | C7 | C8 | H8 | 22.6° | 22.4° |
| H7 | C7 | C8 | H8A | 97.4° | 99.0° |
| H7A | C7 | C8 | H8 | 142.6° | 145.0° |
| H7A | C7 | C8 | H8A | 22.6° | 23.7° |
| H8 | C8 | C9 | H9 | 136.7° | 121.6° |
| H8A | C8 | C9 | H9 | 16.6° | 0.2° |
| H9 | C9 | C12 | H12 | 82.6° | 67.9° |
| H10 | C10 | H10A | H10B | 120.0° | 120.1° |
| H12 | C12 | C13 | H13 | 65.0° | 65.9° |
| H12 | C12 | C13 | H13A | 175.0° | 54.1° |
| H12 | C12 | C13 | H13B | 55.0° | 174.1° |
| H12 | C12 | C14 | H14 | 87.2° | 65.2° |
| H12 | C12 | C14 | H14A | 152.8° | 174.8° |
| H13 | C13 | H13A | H13B | 120.0° | 120.0° |
| H14 | C14 | C15 | H15 | 174.9° | 180.0° |
| H14 | C14 | C15 | H15A | 65.0° | 60.0° |
| H14A | C14 | C15 | H15 | 55.0° | 60.1° |
| H14A | C14 | C15 | H15A | 175.0° | 180.0° |
| H15 | C15 | C16 | H16 | 175.9° | 180.0° |
| H15 | C15 | C16 | H16A | 64.1° | 60.0° |
| H15A | C15 | C16 | H16 | 55.9° | 59.9° |
| H15A | C15 | C16 | H16A | 175.9° | 180.0° |
| H18 | C18 | H18A | H18B | 120.0° | 119.9° |
| H19 | C19 | H19A | H19B | 120.0° | 120.0° |
| H24 | C24 | C25 | H25 | 36.9° | 50.2° |
| H24A | C24 | C25 | H25 | 83.2° | 169.9° |
| H25 | C25 | C26 | H26 | 75.8° | 171.3° |
| H25 | C25 | O29 | HO29 | 62.7° | 60.5° |
| H26 | C26 | C27 | H27 | 37.3° | 50.3° |
| H26 | C26 | C31 | H31 | 63.7° | 60.4° |
| H26 | C26 | C31 | H31A | 176.3° | 59.5° |
| H26 | C26 | C31 | H31B | 56.3° | 179.6° |
| H27 | C27 | C28 | H28 | 77.3° | 42.5° |
| H27 | C27 | O30 | HO30 | 63.8° | 60.2° |
| H31 | C31 | H31A | H31B | 120.0° | 120.0° |
