6CA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O35 | C33 | doub | 1.35Å | 1.39Å | |
| C33 | O34 | sing | 1.22Å | 1.27Å | |
| C33 | C32 | sing | 1.47Å | 1.52Å | |
| O34 | H34 | sing | 9.27Å | 0.95Å | |
| C32 | C36 | sing | 1.40Å | 1.44Å | Aromatic |
| C32 | C31 | doub | 1.40Å | 1.45Å | Aromatic |
| C36 | C37 | doub | 1.38Å | 1.38Å | Aromatic |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | C38 | sing | 1.39Å | 1.39Å | Aromatic |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | C39 | doub | 1.38Å | 1.38Å | Aromatic |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C39 | C31 | sing | 1.39Å | 1.35Å | Aromatic |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C31 | N30 | sing | 1.39Å | 1.46Å | |
| N30 | C27 | sing | 1.40Å | 1.43Å | |
| N30 | H30 | sing | 0.97Å | 1.00Å | |
| C27 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
| C27 | C26 | doub | 1.39Å | 1.44Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C26 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | C24 | doub | 1.39Å | 1.43Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C24 | O23 | sing | 1.36Å | 1.33Å | |
| O23 | C22 | sing | 1.43Å | 1.46Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C21 | C20 | sing | 1.53Å | 1.55Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C20 | C19 | sing | 1.53Å | 1.56Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C19 | C18 | sing | 1.53Å | 1.56Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C18 | C17 | sing | 1.53Å | 1.56Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C17 | O16 | sing | 1.43Å | 1.44Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| O16 | C11 | sing | 1.36Å | 1.39Å | |
| C11 | C12 | sing | 1.39Å | 1.41Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.41Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.42Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | C8 | sing | 1.39Å | 1.42Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C9 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C8 | C5 | sing | 1.48Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.41Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C4 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | C2 | doub | 1.40Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | C1 | sing | 1.48Å | 1.50Å | |
| C1 | O14 | sing | 1.21Å | 1.37Å | |
| C1 | O15 | doub | 1.35Å | 1.23Å | |
| O14 | H14 | sing | 13.59Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O35 | C33 | O34 | 119.0° | 120.0° |
| O35 | C33 | C32 | 113.8° | 120.0° |
| O34 | C33 | C32 | 127.2° | 120.0° |
| C33 | O34 | H34 | 109.5° | 95.3° |
| C33 | C32 | C36 | 120.4° | 120.2° |
| C33 | C32 | C31 | 123.7° | 120.2° |
| C36 | C32 | C31 | 115.9° | 119.5° |
| C32 | C36 | C37 | 122.3° | 120.0° |
| C32 | C36 | H36 | 118.8° | 120.0° |
| C32 | C31 | C39 | 119.6° | 119.7° |
| C32 | C31 | N30 | 116.5° | 120.2° |
| C37 | C36 | H36 | 118.8° | 120.0° |
| C36 | C37 | C38 | 118.9° | 120.3° |
| C36 | C37 | H37 | 120.5° | 119.8° |
| C38 | C37 | H37 | 120.5° | 119.8° |
| C37 | C38 | C39 | 120.1° | 120.5° |
| C37 | C38 | H38 | 120.0° | 119.8° |
| C39 | C38 | H38 | 120.0° | 119.8° |
| C38 | C39 | C31 | 123.2° | 120.0° |
| C38 | C39 | H39 | 118.5° | 120.0° |
| C31 | C39 | H39 | 118.4° | 120.0° |
| C39 | C31 | N30 | 123.8° | 120.2° |
| C31 | N30 | C27 | 125.0° | 120.0° |
| C31 | N30 | H30 | 117.5° | 120.0° |
| C27 | N30 | H30 | 117.5° | 120.0° |
| N30 | C27 | C28 | 120.9° | 120.0° |
| N30 | C27 | C26 | 122.1° | 120.0° |
| C28 | C27 | C26 | 117.0° | 120.0° |
| C27 | C28 | C29 | 121.8° | 119.9° |
| C27 | C28 | H28 | 119.1° | 120.0° |
| C27 | C26 | C25 | 122.0° | 120.0° |
| C27 | C26 | H26 | 119.0° | 120.0° |
| C29 | C28 | H28 | 119.1° | 120.0° |
| C28 | C29 | C24 | 121.1° | 120.0° |
| C28 | C29 | H29 | 119.5° | 119.9° |
| C24 | C29 | H29 | 119.5° | 120.0° |
| C29 | C24 | C25 | 119.0° | 120.0° |
| C29 | C24 | O23 | 118.7° | 120.0° |
| C25 | C26 | H26 | 119.0° | 120.0° |
| C26 | C25 | C24 | 119.2° | 120.0° |
| C26 | C25 | H25 | 120.4° | 120.0° |
| C24 | C25 | H25 | 120.4° | 120.0° |
| C25 | C24 | O23 | 121.8° | 120.0° |
| C24 | O23 | C22 | 138.4° | 106.8° |
| O23 | C22 | C21 | 135.5° | 109.5° |
| O23 | C22 | H221 | 95.6° | 109.4° |
| O23 | C22 | H222 | 101.6° | 109.5° |
| C21 | C22 | H221 | 95.6° | 109.5° |
| C21 | C22 | H222 | 101.6° | 109.5° |
| C22 | C21 | C20 | 133.9° | 109.5° |
| C22 | C21 | H211 | 96.4° | 109.5° |
| C22 | C21 | H212 | 102.0° | 109.5° |
| H221 | C22 | H222 | 133.0° | 109.5° |
| C20 | C21 | H211 | 96.4° | 109.4° |
| C20 | C21 | H212 | 102.0° | 109.5° |
| C21 | C20 | C19 | 126.1° | 109.5° |
| C21 | C20 | H201 | 100.3° | 109.5° |
| C21 | C20 | H202 | 104.3° | 109.5° |
| H211 | C21 | H212 | 131.4° | 109.5° |
| C19 | C20 | H201 | 100.3° | 109.4° |
| C19 | C20 | H202 | 104.2° | 109.5° |
| C20 | C19 | C18 | 114.9° | 109.5° |
| C20 | C19 | H191 | 106.5° | 109.5° |
| C20 | C19 | H192 | 107.7° | 109.4° |
| H201 | C20 | H202 | 123.7° | 109.4° |
| C18 | C19 | H191 | 106.5° | 109.5° |
| C18 | C19 | H192 | 107.7° | 109.5° |
| C19 | C18 | C17 | 149.1° | 109.5° |
| C19 | C18 | H181 | 90.4° | 109.4° |
| C19 | C18 | H182 | 97.9° | 109.5° |
| H191 | C19 | H192 | 113.8° | 109.5° |
| C17 | C18 | H181 | 90.3° | 109.5° |
| C17 | C18 | H182 | 97.9° | 109.5° |
| C18 | C17 | O16 | 114.1° | 109.5° |
| C18 | C17 | H171 | 106.9° | 109.5° |
| C18 | C17 | H172 | 108.0° | 109.5° |
| H181 | C18 | H182 | 147.8° | 109.5° |
| O16 | C17 | H171 | 106.9° | 109.5° |
| O16 | C17 | H172 | 108.0° | 109.5° |
| C17 | O16 | C11 | 145.7° | 106.8° |
| H171 | C17 | H172 | 113.2° | 109.5° |
| O16 | C11 | C12 | 126.2° | 119.9° |
| O16 | C11 | C10 | 115.0° | 120.0° |
| C12 | C11 | C10 | 118.7° | 120.1° |
| C11 | C12 | C13 | 118.8° | 120.1° |
| C11 | C12 | H12 | 120.6° | 120.0° |
| C11 | C10 | C9 | 122.7° | 120.1° |
| C11 | C10 | H10 | 118.6° | 119.9° |
| C13 | C12 | H12 | 120.6° | 120.0° |
| C12 | C13 | C8 | 121.6° | 120.0° |
| C12 | C13 | H13 | 119.2° | 120.1° |
| C8 | C13 | H13 | 119.2° | 120.0° |
| C13 | C8 | C9 | 119.1° | 119.9° |
| C13 | C8 | C5 | 122.5° | 120.1° |
| C9 | C10 | H10 | 118.6° | 120.0° |
| C10 | C9 | C8 | 119.1° | 119.9° |
| C10 | C9 | H9 | 120.5° | 120.0° |
| C8 | C9 | H9 | 120.5° | 120.1° |
| C9 | C8 | C5 | 118.4° | 120.0° |
| C8 | C5 | C6 | 121.2° | 120.0° |
| C8 | C5 | C4 | 120.8° | 120.0° |
| C6 | C5 | C4 | 118.1° | 120.0° |
| C5 | C6 | C7 | 121.5° | 120.0° |
| C5 | C6 | H6 | 119.2° | 120.0° |
| C5 | C4 | C3 | 120.6° | 120.0° |
| C5 | C4 | H4 | 119.7° | 120.0° |
| C7 | C6 | H6 | 119.3° | 120.0° |
| C6 | C7 | C2 | 120.2° | 120.0° |
| C6 | C7 | H7 | 119.9° | 120.0° |
| C2 | C7 | H7 | 119.9° | 120.0° |
| C7 | C2 | C3 | 119.2° | 120.0° |
| C7 | C2 | C1 | 118.7° | 120.0° |
| C3 | C4 | H4 | 119.7° | 120.0° |
| C4 | C3 | C2 | 120.2° | 119.9° |
| C4 | C3 | H3 | 119.9° | 120.0° |
| C2 | C3 | H3 | 119.9° | 120.0° |
| C3 | C2 | C1 | 122.0° | 120.0° |
| C2 | C1 | O14 | 118.0° | 120.0° |
| C2 | C1 | O15 | 123.8° | 120.0° |
| O14 | C1 | O15 | 118.2° | 120.0° |
| C1 | O14 | H14 | 109.5° | 63.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O35 | C33 | O34 | C32 | 179.7° | 179.9° |
| O35 | C33 | O34 | H34 | 0.0° | 87.4° |
| O35 | C33 | C32 | C36 | 4.0° | 6.5° |
| O35 | C33 | C32 | C31 | 176.2° | 174.0° |
| O34 | C33 | C32 | C36 | 175.7° | 173.6° |
| O34 | C33 | C32 | C31 | 4.0° | 5.9° |
| C32 | C33 | O34 | H34 | 179.7° | 92.5° |
| C33 | C32 | C36 | C31 | 179.8° | 179.5° |
| C33 | C32 | C36 | C37 | 179.8° | 180.0° |
| C33 | C32 | C36 | H36 | 0.2° | 0.2° |
| C33 | C32 | C31 | C39 | 180.0° | 180.0° |
| C33 | C32 | C31 | N30 | 0.6° | 0.2° |
| C32 | C36 | C37 | H36 | 180.0° | 179.7° |
| C32 | C36 | C37 | C38 | 0.2° | 0.3° |
| C32 | C36 | C37 | H37 | 179.8° | 179.8° |
| C36 | C32 | C31 | C39 | 0.2° | 0.5° |
| C36 | C32 | C31 | N30 | 179.2° | 179.7° |
| C31 | C32 | C36 | C37 | 0.0° | 0.6° |
| C31 | C32 | C36 | H36 | 180.0° | 179.7° |
| C32 | C31 | C39 | C38 | 0.2° | 0.2° |
| C32 | C31 | C39 | N30 | 179.4° | 179.8° |
| C32 | C31 | C39 | H39 | 179.8° | 179.7° |
| C32 | C31 | N30 | C27 | 149.0° | 77.4° |
| C32 | C31 | N30 | H30 | 31.1° | 102.6° |
| C36 | C37 | C38 | H37 | 180.0° | 179.9° |
| C36 | C37 | C38 | C39 | 0.3° | 0.0° |
| C36 | C37 | C38 | H38 | 179.7° | 179.9° |
| H36 | C36 | C37 | C38 | 179.7° | 180.0° |
| H36 | C36 | C37 | H37 | 0.3° | 0.1° |
| C37 | C38 | C39 | H38 | 180.0° | 179.9° |
| C37 | C38 | C39 | C31 | 0.1° | 0.0° |
| C37 | C38 | C39 | H39 | 179.9° | 180.0° |
| H37 | C37 | C38 | C39 | 179.7° | 179.9° |
| H37 | C37 | C38 | H38 | 0.3° | 0.0° |
| C38 | C39 | C31 | H39 | 180.0° | 179.9° |
| C38 | C39 | C31 | N30 | 179.2° | 180.0° |
| H38 | C38 | C39 | C31 | 179.9° | 180.0° |
| H38 | C38 | C39 | H39 | 0.1° | 0.1° |
| C39 | C31 | N30 | C27 | 31.6° | 102.4° |
| C39 | C31 | N30 | H30 | 148.3° | 77.6° |
| H39 | C39 | C31 | N30 | 0.8° | 0.1° |
| C31 | N30 | C27 | H30 | 180.0° | 180.0° |
| C31 | N30 | C27 | C28 | 152.1° | 175.9° |
| C31 | N30 | C27 | C26 | 30.7° | 4.1° |
| N30 | C27 | C28 | C26 | 177.4° | 180.0° |
| N30 | C27 | C28 | C29 | 176.5° | 180.0° |
| N30 | C27 | C28 | H28 | 3.4° | 0.0° |
| N30 | C27 | C26 | C25 | 176.7° | 179.7° |
| N30 | C27 | C26 | H26 | 3.4° | 0.0° |
| H30 | N30 | C27 | C28 | 27.9° | 4.1° |
| H30 | N30 | C27 | C26 | 149.4° | 175.9° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C24 | 0.6° | 0.1° |
| C27 | C28 | C29 | H29 | 179.4° | 180.0° |
| C28 | C27 | C26 | C25 | 0.6° | 0.3° |
| C28 | C27 | C26 | H26 | 179.3° | 179.9° |
| C26 | C27 | C28 | C29 | 0.8° | 0.1° |
| C26 | C27 | C28 | H28 | 179.2° | 180.0° |
| C27 | C26 | C25 | H26 | 180.0° | 179.7° |
| C27 | C26 | C25 | C24 | 0.2° | 0.6° |
| C27 | C26 | C25 | H25 | 179.8° | 180.0° |
| C28 | C29 | C24 | H29 | 180.0° | 179.9° |
| C28 | C29 | C24 | C25 | 0.1° | 0.3° |
| C28 | C29 | C24 | O23 | 171.2° | 180.0° |
| H28 | C28 | C29 | C24 | 179.4° | 180.0° |
| H28 | C28 | C29 | H29 | 0.6° | 0.0° |
| C29 | C24 | C25 | C26 | 0.1° | 0.6° |
| C29 | C24 | C25 | O23 | 170.8° | 179.7° |
| C29 | C24 | C25 | H25 | 180.0° | 180.0° |
| C29 | C24 | O23 | C22 | 6.1° | 180.0° |
| H29 | C29 | C24 | C25 | 179.9° | 179.7° |
| H29 | C29 | C24 | O23 | 8.8° | 0.0° |
| C26 | C25 | C24 | H25 | 180.0° | 179.4° |
| C26 | C25 | C24 | O23 | 170.7° | 179.7° |
| H26 | C26 | C25 | C24 | 179.8° | 179.7° |
| H26 | C26 | C25 | H25 | 0.3° | 0.2° |
| C25 | C24 | O23 | C22 | 164.7° | 0.3° |
| H25 | C25 | C24 | O23 | 9.3° | 0.3° |
| C24 | O23 | C22 | C21 | 61.7° | 180.0° |
| C24 | O23 | C22 | H221 | 165.6° | 60.0° |
| C24 | O23 | C22 | H222 | 58.4° | 60.0° |
| O23 | C22 | C21 | H221 | 104.0° | 120.0° |
| O23 | C22 | C21 | H222 | 120.0° | 120.0° |
| O23 | C22 | H221 | H222 | 111.5° | 120.0° |
| O23 | C22 | C21 | C20 | 61.0° | 180.0° |
| O23 | C22 | C21 | H211 | 166.3° | 60.0° |
| O23 | C22 | C21 | H212 | 59.0° | 60.0° |
| C21 | C22 | H221 | H222 | 111.6° | 120.0° |
| C22 | C21 | C20 | H211 | 105.2° | 120.0° |
| C22 | C21 | C20 | H212 | 120.0° | 120.0° |
| C22 | C21 | H211 | H212 | 112.2° | 120.0° |
| C22 | C21 | C20 | C19 | 67.1° | 180.0° |
| C22 | C21 | C20 | H201 | 178.1° | 60.0° |
| C22 | C21 | C20 | H202 | 52.9° | 60.0° |
| H221 | C22 | C21 | C20 | 42.9° | 60.0° |
| H221 | C22 | C21 | H211 | 62.3° | NaN° |
| H221 | C22 | C21 | H212 | 162.9° | 60.0° |
| H222 | C22 | C21 | C20 | 179.0° | 60.0° |
| H222 | C22 | C21 | H211 | 73.7° | 60.0° |
| H222 | C22 | C21 | H212 | 61.1° | 180.0° |
| C20 | C21 | H211 | H212 | 112.2° | 120.0° |
| C21 | C20 | C19 | H201 | 111.0° | 120.0° |
| C21 | C20 | C19 | H202 | 120.0° | 120.0° |
| C21 | C20 | H201 | H202 | 115.0° | 120.0° |
| C21 | C20 | C19 | C18 | 50.6° | 180.0° |
| C21 | C20 | C19 | H191 | 168.2° | 60.0° |
| C21 | C20 | C19 | H192 | 69.4° | 60.0° |
| H211 | C21 | C20 | C19 | 38.2° | 60.0° |
| H211 | C21 | C20 | H201 | 72.9° | 180.0° |
| H211 | C21 | C20 | H202 | 158.2° | 60.0° |
| H212 | C21 | C20 | C19 | 172.9° | 60.0° |
| H212 | C21 | C20 | H201 | 61.9° | 60.0° |
| H212 | C21 | C20 | H202 | 67.1° | 180.0° |
| C19 | C20 | H201 | H202 | 115.0° | 120.0° |
| C20 | C19 | C18 | H191 | 117.6° | 120.0° |
| C20 | C19 | C18 | H192 | 120.0° | 120.0° |
| C20 | C19 | H191 | H192 | 118.5° | 119.9° |
| C20 | C19 | C18 | C17 | 52.2° | 180.0° |
| C20 | C19 | C18 | H181 | 143.5° | 60.0° |
| C20 | C19 | C18 | H182 | 67.8° | 60.0° |
| H201 | C20 | C19 | C18 | 60.4° | 60.0° |
| H201 | C20 | C19 | H191 | 57.2° | 180.0° |
| H201 | C20 | C19 | H192 | 179.6° | 60.1° |
| H202 | C20 | C19 | C18 | 170.6° | 60.0° |
| H202 | C20 | C19 | H191 | 71.8° | 60.0° |
| H202 | C20 | C19 | H192 | 50.6° | 180.0° |
| C18 | C19 | H191 | H192 | 118.5° | 120.1° |
| C19 | C18 | C17 | H181 | 91.3° | 120.0° |
| C19 | C18 | C17 | H182 | 120.0° | 120.1° |
| C19 | C18 | H181 | H182 | 105.5° | 120.1° |
| C19 | C18 | C17 | O16 | 132.3° | 180.0° |
| C19 | C18 | C17 | H171 | 109.7° | 60.0° |
| C19 | C18 | C17 | H172 | 12.3° | 60.0° |
| H191 | C19 | C18 | C17 | 65.4° | 60.0° |
| H191 | C19 | C18 | H181 | 25.9° | 180.0° |
| H191 | C19 | C18 | H182 | 174.6° | 60.0° |
| H192 | C19 | C18 | C17 | 172.2° | 60.0° |
| H192 | C19 | C18 | H181 | 96.6° | 60.0° |
| H192 | C19 | C18 | H182 | 52.2° | 180.0° |
| C17 | C18 | H181 | H182 | 105.4° | 120.0° |
| C18 | C17 | O16 | H171 | 118.0° | 120.0° |
| C18 | C17 | O16 | H172 | 120.0° | 120.0° |
| C18 | C17 | H171 | H172 | 118.7° | 120.0° |
| C18 | C17 | O16 | C11 | 136.4° | 180.0° |
| H181 | C18 | C17 | O16 | 41.1° | 60.0° |
| H181 | C18 | C17 | H171 | 159.0° | 180.0° |
| H181 | C18 | C17 | H172 | 78.9° | 60.0° |
| H182 | C18 | C17 | O16 | 107.7° | 59.9° |
| H182 | C18 | C17 | H171 | 10.3° | 60.1° |
| H182 | C18 | C17 | H172 | 132.3° | 180.0° |
| O16 | C17 | H171 | H172 | 118.7° | 120.0° |
| C17 | O16 | C11 | C12 | 14.2° | 180.0° |
| C17 | O16 | C11 | C10 | 162.2° | 0.0° |
| H171 | C17 | O16 | C11 | 105.6° | 60.0° |
| H172 | C17 | O16 | C11 | 16.4° | 60.0° |
| O16 | C11 | C12 | C10 | 176.3° | 180.0° |
| O16 | C11 | C12 | C13 | 176.4° | 180.0° |
| O16 | C11 | C12 | H12 | 3.6° | 0.0° |
| O16 | C11 | C10 | C9 | 176.7° | 179.8° |
| O16 | C11 | C10 | H10 | 3.3° | 0.1° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C8 | 0.2° | 0.0° |
| C11 | C12 | C13 | H13 | 179.8° | 180.0° |
| C12 | C11 | C10 | C9 | 0.1° | 0.2° |
| C12 | C11 | C10 | H10 | 179.9° | 179.9° |
| C10 | C11 | C12 | C13 | 0.2° | 0.0° |
| C10 | C11 | C12 | H12 | 179.8° | 180.0° |
| C11 | C10 | C9 | H10 | 180.0° | 179.9° |
| C11 | C10 | C9 | C8 | 0.0° | 0.4° |
| C11 | C10 | C9 | H9 | 180.0° | 179.9° |
| C12 | C13 | C8 | H13 | 180.0° | 180.0° |
| C12 | C13 | C8 | C9 | 0.2° | 0.3° |
| C12 | C13 | C8 | C5 | 179.5° | 180.0° |
| H12 | C12 | C13 | C8 | 179.8° | 180.0° |
| H12 | C12 | C13 | H13 | 0.2° | 0.0° |
| C13 | C8 | C9 | C10 | 0.1° | 0.5° |
| C13 | C8 | C9 | C5 | 179.4° | 179.7° |
| C13 | C8 | C9 | H9 | 180.0° | 179.9° |
| C13 | C8 | C5 | C6 | 97.7° | 140.3° |
| C13 | C8 | C5 | C4 | 83.8° | 39.7° |
| H13 | C13 | C8 | C9 | 179.8° | 179.7° |
| H13 | C13 | C8 | C5 | 0.5° | 0.1° |
| C10 | C9 | C8 | H9 | 180.0° | 179.6° |
| C10 | C9 | C8 | C5 | 179.4° | 179.9° |
| H10 | C10 | C9 | C8 | 180.0° | 179.7° |
| H10 | C10 | C9 | H9 | 0.0° | 0.1° |
| C9 | C8 | C5 | C6 | 83.0° | 40.0° |
| C9 | C8 | C5 | C4 | 95.5° | 140.0° |
| H9 | C9 | C8 | C5 | 0.6° | 0.2° |
| C8 | C5 | C6 | C4 | 178.5° | 180.0° |
| C8 | C5 | C6 | C7 | 178.5° | 180.0° |
| C8 | C5 | C6 | H6 | 1.5° | 0.0° |
| C8 | C5 | C4 | C3 | 178.3° | 179.7° |
| C8 | C5 | C4 | H4 | 1.7° | 0.0° |
| C5 | C6 | C7 | H6 | 180.0° | 179.9° |
| C5 | C6 | C7 | C2 | 2.7° | 0.1° |
| C5 | C6 | C7 | H7 | 177.3° | 179.9° |
| C6 | C5 | C4 | C3 | 0.2° | 0.3° |
| C6 | C5 | C4 | H4 | 179.8° | 180.0° |
| C4 | C5 | C6 | C7 | 0.0° | 0.0° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C5 | C4 | C3 | H4 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 2.3° | 0.6° |
| C5 | C4 | C3 | H3 | 177.7° | 180.0° |
| C6 | C7 | C2 | H7 | 180.0° | 179.8° |
| C6 | C7 | C2 | C3 | 5.2° | 0.4° |
| C6 | C7 | C2 | C1 | 177.3° | 180.0° |
| H6 | C6 | C7 | C2 | 177.3° | 180.0° |
| H6 | C6 | C7 | H7 | 2.7° | 0.2° |
| C7 | C2 | C3 | C4 | 5.0° | 0.7° |
| C7 | C2 | C3 | C1 | 177.5° | 179.6° |
| C7 | C2 | C3 | H3 | 175.0° | 179.9° |
| C7 | C2 | C1 | O14 | 131.7° | 0.1° |
| C7 | C2 | C1 | O15 | 48.3° | 180.0° |
| H7 | C7 | C2 | C3 | 174.9° | 179.8° |
| H7 | C7 | C2 | C1 | 2.7° | 0.2° |
| C4 | C3 | C2 | H3 | 180.0° | 179.4° |
| C4 | C3 | C2 | C1 | 177.5° | 179.7° |
| H4 | C4 | C3 | C2 | 177.7° | 179.7° |
| H4 | C4 | C3 | H3 | 2.3° | 0.2° |
| C3 | C2 | C1 | O14 | 50.8° | 179.7° |
| C3 | C2 | C1 | O15 | 129.2° | 0.4° |
| H3 | C3 | C2 | C1 | 2.4° | 0.3° |
| C2 | C1 | O14 | O15 | 180.0° | 179.9° |
| C2 | C1 | O14 | H14 | 180.0° | 8.4° |
| O15 | C1 | O14 | H14 | 0.0° | 171.5° |
