JM1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F29 | C20 | sing | 1.45Å | 1.45Å | |
| C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C29 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C4 | sing | 1.41Å | 1.41Å | Aromatic |
| C4 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C4 | C8 | sing | 1.41Å | 1.41Å | |
| C8 | O9 | doub | 1.23Å | 1.23Å | |
| C8 | N7 | sing | 1.38Å | 1.38Å | |
| N7 | C5 | sing | 1.38Å | 1.38Å | |
| N7 | HN7 | sing | 1.00Å | 1.00Å | |
| C5 | C3 | sing | 1.40Å | 1.40Å | |
| C5 | O6 | doub | 1.18Å | 1.18Å | |
| C19 | N18 | sing | 1.35Å | 1.35Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| N18 | RU12 | sing | 2.05Å | 2.05Å | |
| N18 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| RU12 | C15 | sing | 2.15Å | 2.15Å | |
| RU12 | C14 | sing | 2.13Å | 2.13Å | |
| RU12 | C16 | sing | 2.15Å | 2.15Å | |
| RU12 | C13 | sing | 2.12Å | 2.12Å | |
| RU12 | C17 | sing | 2.15Å | 2.15Å | |
| RU12 | C11 | sing | 1.99Å | 1.99Å | |
| RU12 | N22 | sing | 2.07Å | 2.07Å | |
| C11 | O10 | trip | 1.08Å | 1.08Å | |
| C17 | C16 | sing | 1.39Å | 1.39Å | |
| C17 | C13 | sing | 1.40Å | 1.40Å | |
| C17 | H17 | sing | 1.10Å | 1.10Å | |
| C16 | C15 | sing | 1.40Å | 1.40Å | |
| C16 | H16 | sing | 1.10Å | 1.10Å | |
| C15 | C14 | sing | 1.38Å | 1.38Å | |
| C15 | H15 | sing | 1.10Å | 1.10Å | |
| C14 | C13 | sing | 1.40Å | 1.40Å | |
| C14 | H14 | sing | 1.10Å | 1.10Å | |
| C13 | H13 | sing | 1.10Å | 1.10Å | |
| N22 | C31 | sing | 1.37Å | 1.37Å | Aromatic |
| N22 | C23 | sing | 1.43Å | 1.43Å | Aromatic |
| C31 | C12 | sing | 1.37Å | 1.37Å | Aromatic |
| C31 | C30 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C24 | sing | 1.41Å | 1.41Å | Aromatic |
| C30 | C3 | sing | 1.42Å | 1.42Å | Aromatic |
| C24 | C23 | sing | 1.42Å | 1.42Å | Aromatic |
| C24 | C25 | doub | 1.41Å | 1.41Å | Aromatic |
| C23 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | C25 | sing | 1.40Å | 1.40Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F29 | C20 | C19 | 116.3° | 116.3° |
| F29 | C20 | C21 | 117.7° | 117.7° |
| C19 | C20 | C21 | 125.9° | 125.9° |
| C20 | C19 | N18 | 117.9° | 117.9° |
| C20 | C19 | H19 | 121.0° | 121.0° |
| C20 | C21 | C29 | 116.0° | 116.0° |
| C20 | C21 | H21 | 122.0° | 122.0° |
| C29 | C21 | H21 | 122.0° | 122.0° |
| C21 | C29 | C12 | 116.9° | 116.9° |
| C21 | C29 | C4 | 125.5° | 125.5° |
| C12 | C29 | C4 | 117.6° | 117.6° |
| C29 | C12 | N18 | 126.1° | 126.1° |
| C29 | C12 | C31 | 118.9° | 118.9° |
| C29 | C4 | C3 | 122.0° | 122.0° |
| C29 | C4 | C8 | 130.1° | 130.1° |
| C3 | C4 | C8 | 107.9° | 107.9° |
| C4 | C3 | C5 | 103.9° | 103.9° |
| C4 | C3 | C30 | 120.7° | 120.7° |
| C4 | C8 | O9 | 126.1° | 126.1° |
| C4 | C8 | N7 | 110.5° | 110.5° |
| O9 | C8 | N7 | 123.0° | 123.0° |
| C8 | N7 | C5 | 104.3° | 104.3° |
| C8 | N7 | HN7 | 127.9° | 127.9° |
| C5 | N7 | HN7 | 127.9° | 127.9° |
| N7 | C5 | C3 | 113.3° | 113.3° |
| N7 | C5 | O6 | 121.9° | 121.9° |
| C3 | C5 | O6 | 124.8° | 124.8° |
| C5 | C3 | C30 | 135.2° | 135.2° |
| N18 | C19 | H19 | 121.0° | 121.0° |
| C19 | N18 | RU12 | 127.7° | 127.7° |
| C19 | N18 | C12 | 117.1° | 117.1° |
| RU12 | N18 | C12 | 115.1° | 115.1° |
| N18 | RU12 | C15 | 106.2° | 106.2° |
| N18 | RU12 | C14 | 142.0° | 142.0° |
| N18 | RU12 | C16 | 95.6° | 95.6° |
| N18 | RU12 | C13 | 156.9° | 156.9° |
| N18 | RU12 | C17 | 118.9° | 118.9° |
| N18 | RU12 | C11 | 98.2° | 98.2° |
| N18 | RU12 | N22 | 78.3° | 78.3° |
| N18 | C12 | C31 | 114.9° | 114.9° |
| C15 | RU12 | C14 | 37.6° | 37.6° |
| C15 | RU12 | C16 | 38.0° | 38.0° |
| C15 | RU12 | C13 | 63.9° | 63.9° |
| C15 | RU12 | C17 | 63.9° | 63.9° |
| C15 | RU12 | C11 | 104.1° | 104.1° |
| C15 | RU12 | N22 | 159.1° | 159.1° |
| RU12 | C15 | C16 | 71.1° | 71.1° |
| RU12 | C15 | C14 | 70.3° | 70.3° |
| RU12 | C15 | H15 | 112.1° | 112.1° |
| C14 | RU12 | C16 | 63.0° | 63.0° |
| C14 | RU12 | C13 | 38.4° | 38.4° |
| C14 | RU12 | C17 | 63.8° | 63.8° |
| C14 | RU12 | C11 | 85.1° | 85.1° |
| C14 | RU12 | N22 | 139.4° | 139.4° |
| RU12 | C14 | C15 | 72.1° | 72.1° |
| RU12 | C14 | C13 | 70.3° | 70.3° |
| RU12 | C14 | H14 | 111.8° | 111.8° |
| C16 | RU12 | C13 | 63.4° | 63.4° |
| C16 | RU12 | C17 | 37.8° | 37.8° |
| C16 | RU12 | C11 | 142.1° | 142.1° |
| C16 | RU12 | N22 | 122.2° | 122.2° |
| RU12 | C16 | C17 | 71.2° | 71.2° |
| RU12 | C16 | C15 | 70.9° | 70.9° |
| RU12 | C16 | H16 | 111.5° | 111.5° |
| C13 | RU12 | C17 | 38.3° | 38.3° |
| C13 | RU12 | C11 | 104.5° | 104.5° |
| C13 | RU12 | N22 | 103.9° | 103.9° |
| RU12 | C13 | C17 | 72.4° | 72.4° |
| RU12 | C13 | C14 | 71.3° | 71.3° |
| RU12 | C13 | H13 | 112.5° | 112.5° |
| C17 | RU12 | C11 | 142.7° | 142.7° |
| C17 | RU12 | N22 | 95.8° | 95.8° |
| RU12 | C17 | C16 | 71.0° | 71.0° |
| RU12 | C17 | C13 | 69.4° | 69.4° |
| RU12 | C17 | H17 | 112.2° | 112.2° |
| C11 | RU12 | N22 | 95.2° | 95.2° |
| RU12 | C11 | O10 | 173.9° | 173.9° |
| RU12 | N22 | C31 | 113.6° | 113.6° |
| RU12 | N22 | C23 | 144.1° | 144.1° |
| C16 | C17 | C13 | 106.7° | 106.7° |
| C16 | C17 | H17 | 125.8° | 125.8° |
| C17 | C16 | C15 | 109.3° | 109.3° |
| C17 | C16 | H16 | 124.5° | 124.5° |
| C13 | C17 | H17 | 125.6° | 125.6° |
| C17 | C13 | C14 | 108.1° | 108.1° |
| C17 | C13 | H13 | 125.3° | 125.3° |
| C15 | C16 | H16 | 124.3° | 124.3° |
| C16 | C15 | C14 | 107.0° | 107.0° |
| C16 | C15 | H15 | 125.3° | 125.3° |
| C14 | C15 | H15 | 125.9° | 125.9° |
| C15 | C14 | C13 | 108.9° | 108.9° |
| C15 | C14 | H14 | 124.9° | 124.9° |
| C13 | C14 | H14 | 124.5° | 124.5° |
| C14 | C13 | H13 | 125.5° | 125.5° |
| C31 | N22 | C23 | 102.0° | 102.0° |
| N22 | C31 | C12 | 117.8° | 117.8° |
| N22 | C31 | C30 | 115.3° | 115.3° |
| N22 | C23 | C24 | 111.0° | 111.0° |
| N22 | C23 | C28 | 127.8° | 127.8° |
| C12 | C31 | C30 | 126.7° | 126.7° |
| C31 | C30 | C24 | 105.1° | 105.1° |
| C31 | C30 | C3 | 113.9° | 113.9° |
| C24 | C30 | C3 | 141.0° | 141.0° |
| C30 | C24 | C23 | 106.5° | 106.5° |
| C30 | C24 | C25 | 133.1° | 133.1° |
| C23 | C24 | C25 | 120.4° | 120.4° |
| C24 | C23 | C28 | 121.2° | 121.2° |
| C24 | C25 | C26 | 118.3° | 118.3° |
| C24 | C25 | H25 | 120.8° | 120.8° |
| C23 | C28 | C27 | 116.7° | 116.7° |
| C23 | C28 | H28 | 121.6° | 121.7° |
| C27 | C28 | H28 | 121.6° | 121.6° |
| C28 | C27 | C26 | 124.4° | 124.4° |
| C28 | C27 | H27 | 117.8° | 117.8° |
| C26 | C27 | H27 | 117.8° | 117.8° |
| C27 | C26 | C25 | 118.9° | 118.9° |
| C27 | C26 | H26 | 120.6° | 120.6° |
| C25 | C26 | H26 | 120.6° | 120.6° |
| C26 | C25 | H25 | 120.9° | 120.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F29 | C20 | C19 | C21 | 178.5° | 178.5° |
| F29 | C20 | C21 | C29 | 178.9° | 178.9° |
| F29 | C20 | C21 | H21 | 1.1° | 1.1° |
| F29 | C20 | C19 | N18 | 178.0° | 178.0° |
| F29 | C20 | C19 | H19 | 2.0° | 2.0° |
| C19 | C20 | C21 | C29 | 0.4° | 0.4° |
| C19 | C20 | C21 | H21 | 179.5° | 179.5° |
| C20 | C19 | N18 | H19 | 180.0° | 180.0° |
| C20 | C19 | N18 | RU12 | 177.2° | 177.2° |
| C20 | C19 | N18 | C12 | 0.4° | 0.4° |
| C20 | C21 | C29 | H21 | 180.0° | 180.0° |
| C20 | C21 | C29 | C12 | 1.3° | 1.3° |
| C20 | C21 | C29 | C4 | 179.8° | 179.8° |
| C21 | C20 | C19 | N18 | 0.4° | 0.4° |
| C21 | C20 | C19 | H19 | 179.6° | 179.6° |
| C21 | C29 | C12 | C4 | 178.6° | 178.6° |
| C21 | C29 | C4 | C3 | 178.7° | 178.7° |
| C21 | C29 | C4 | C8 | 0.1° | 0.1° |
| C21 | C29 | C12 | N18 | 1.5° | 1.5° |
| C21 | C29 | C12 | C31 | 178.4° | 178.4° |
| H21 | C21 | C29 | C12 | 178.7° | 178.7° |
| H21 | C21 | C29 | C4 | 0.2° | 0.2° |
| C12 | C29 | C4 | C3 | 0.2° | 0.2° |
| C12 | C29 | C4 | C8 | 178.5° | 178.5° |
| C29 | C12 | N18 | C19 | 0.6° | 0.6° |
| C29 | C12 | N18 | RU12 | 178.4° | 178.4° |
| C29 | C12 | N18 | C31 | 179.8° | 179.8° |
| C29 | C12 | C31 | N22 | 177.9° | 177.9° |
| C29 | C12 | C31 | C30 | 2.0° | 2.0° |
| C29 | C4 | C3 | C8 | 179.0° | 179.0° |
| C29 | C4 | C8 | O9 | 4.4° | 4.4° |
| C29 | C4 | C8 | N7 | 176.9° | 176.9° |
| C29 | C4 | C3 | C5 | 175.9° | 175.9° |
| C4 | C29 | C12 | N18 | 179.9° | 179.9° |
| C4 | C29 | C12 | C31 | 0.2° | 0.2° |
| C29 | C4 | C3 | C30 | 0.8° | 0.8° |
| C3 | C4 | C8 | O9 | 174.5° | 174.5° |
| C3 | C4 | C8 | N7 | 2.0° | 2.0° |
| C4 | C3 | C5 | N7 | 3.3° | 3.3° |
| C4 | C3 | C5 | C30 | 176.0° | 176.0° |
| C4 | C3 | C5 | O6 | 178.1° | 178.1° |
| C4 | C3 | C30 | C31 | 2.2° | 2.2° |
| C4 | C3 | C30 | C24 | 179.4° | 179.4° |
| C4 | C8 | O9 | N7 | 171.6° | 171.6° |
| C4 | C8 | N7 | C5 | 0.0° | 0.0° |
| C4 | C8 | N7 | HN7 | 180.0° | 180.0° |
| C8 | C4 | C3 | C5 | 3.1° | 3.1° |
| C8 | C4 | C3 | C30 | 179.8° | 179.8° |
| O9 | C8 | N7 | C5 | 172.7° | 172.7° |
| O9 | C8 | N7 | HN7 | 7.3° | 7.3° |
| C8 | N7 | C5 | HN7 | 180.0° | 180.0° |
| C8 | N7 | C5 | C3 | 2.1° | 2.1° |
| C8 | N7 | C5 | O6 | 179.3° | 179.3° |
| N7 | C5 | C3 | O6 | 178.6° | 178.6° |
| N7 | C5 | C3 | C30 | 179.3° | 179.3° |
| HN7 | N7 | C5 | C3 | 177.9° | 177.9° |
| HN7 | N7 | C5 | O6 | 0.7° | 0.7° |
| C5 | C3 | C30 | C31 | 173.3° | 173.3° |
| C5 | C3 | C30 | C24 | 3.8° | 3.8° |
| O6 | C5 | C3 | C30 | 2.1° | 2.1° |
| C19 | N18 | RU12 | C12 | 177.6° | 177.6° |
| C19 | N18 | RU12 | C15 | 21.6° | 21.6° |
| C19 | N18 | RU12 | C14 | 6.7° | 6.7° |
| C19 | N18 | RU12 | C16 | 58.8° | 58.8° |
| C19 | N18 | RU12 | C13 | 82.5° | 82.5° |
| C19 | N18 | RU12 | C17 | 90.3° | 90.3° |
| C19 | N18 | RU12 | C11 | 85.8° | 85.8° |
| C19 | N18 | RU12 | N22 | 179.5° | 179.5° |
| C19 | N18 | C12 | C31 | 179.3° | 179.3° |
| H19 | C19 | N18 | RU12 | 2.8° | 2.8° |
| H19 | C19 | N18 | C12 | 179.6° | 179.6° |
| N18 | RU12 | C15 | C14 | 165.0° | 165.0° |
| N18 | RU12 | C15 | C16 | 78.1° | 78.1° |
| N18 | RU12 | C15 | C13 | 157.5° | 157.5° |
| N18 | RU12 | C15 | C17 | 114.7° | 114.7° |
| N18 | RU12 | C15 | C11 | 103.0° | 103.0° |
| N18 | RU12 | C15 | N22 | 99.9° | 99.9° |
| N18 | RU12 | C14 | C16 | 61.8° | 61.8° |
| N18 | RU12 | C14 | C13 | 142.2° | 142.2° |
| N18 | RU12 | C14 | C17 | 104.2° | 104.2° |
| N18 | RU12 | C14 | C11 | 97.0° | 97.0° |
| N18 | RU12 | C14 | N22 | 170.6° | 170.6° |
| N18 | RU12 | C16 | C13 | 169.8° | 169.8° |
| N18 | RU12 | C16 | C17 | 131.7° | 131.7° |
| N18 | RU12 | C16 | C11 | 111.0° | 111.0° |
| N18 | RU12 | C16 | N22 | 79.8° | 79.8° |
| N18 | RU12 | C13 | C17 | 11.0° | 11.0° |
| N18 | RU12 | C13 | C11 | 168.1° | 168.1° |
| N18 | RU12 | C13 | N22 | 92.7° | 92.7° |
| N18 | RU12 | C17 | C11 | 173.6° | 173.6° |
| N18 | RU12 | C17 | N22 | 79.9° | 79.9° |
| N18 | RU12 | C11 | N22 | 78.9° | 78.9° |
| N18 | RU12 | C11 | O10 | 5.1° | 5.1° |
| N18 | RU12 | C17 | H17 | 63.7° | 63.7° |
| N18 | RU12 | C16 | H16 | 11.1° | 11.1° |
| N18 | RU12 | C15 | H15 | 43.2° | 43.2° |
| N18 | RU12 | C14 | H14 | 97.5° | 97.5° |
| N18 | RU12 | C13 | H13 | 132.6° | 132.6° |
| N18 | RU12 | N22 | C31 | 4.0° | 4.0° |
| N18 | RU12 | N22 | C23 | 176.0° | 176.0° |
| RU12 | N18 | C12 | C31 | 1.4° | 1.4° |
| C12 | N18 | RU12 | C15 | 156.0° | 156.0° |
| C12 | N18 | RU12 | C14 | 170.9° | 170.9° |
| C12 | N18 | RU12 | C16 | 118.8° | 118.8° |
| C12 | N18 | RU12 | C13 | 95.0° | 95.0° |
| C12 | N18 | RU12 | C17 | 87.3° | 87.3° |
| C12 | N18 | RU12 | C11 | 96.6° | 96.6° |
| C12 | N18 | RU12 | N22 | 2.9° | 2.9° |
| N18 | C12 | C31 | N22 | 2.2° | 2.2° |
| N18 | C12 | C31 | C30 | 178.2° | 178.2° |
| C15 | RU12 | C14 | C16 | 38.1° | 38.1° |
| C15 | RU12 | C14 | C13 | 118.5° | 118.5° |
| C15 | RU12 | C14 | C17 | 80.5° | 80.5° |
| C15 | RU12 | C14 | C11 | 120.7° | 120.7° |
| C15 | RU12 | C14 | N22 | 146.9° | 146.9° |
| C15 | RU12 | C16 | C13 | 81.0° | 81.0° |
| C15 | RU12 | C16 | C17 | 119.1° | 119.1° |
| C15 | RU12 | C16 | C11 | 1.8° | 1.8° |
| C15 | RU12 | C16 | N22 | 171.0° | 171.0° |
| C15 | RU12 | C13 | C17 | 80.2° | 80.2° |
| C15 | RU12 | C13 | C11 | 98.8° | 98.8° |
| C15 | RU12 | C13 | N22 | 161.9° | 161.9° |
| C15 | RU12 | C17 | C11 | 78.7° | 78.7° |
| C15 | RU12 | C17 | N22 | 174.7° | 174.7° |
| C15 | RU12 | C11 | N22 | 172.0° | 172.0° |
| C15 | RU12 | C11 | O10 | 104.0° | 104.0° |
| C15 | RU12 | C17 | H17 | 158.6° | 158.6° |
| RU12 | C15 | C16 | H15 | 104.1° | 104.1° |
| C15 | RU12 | C16 | H16 | 120.3° | 120.3° |
| RU12 | C15 | C14 | H15 | 103.5° | 103.5° |
| C15 | RU12 | C14 | H14 | 121.2° | 121.2° |
| C15 | RU12 | C13 | H13 | 158.2° | 158.2° |
| C15 | RU12 | N22 | C31 | 100.9° | 100.9° |
| C15 | RU12 | N22 | C23 | 71.1° | 71.1° |
| C14 | RU12 | C16 | C13 | 43.3° | 43.3° |
| C14 | RU12 | C16 | C17 | 81.4° | 81.4° |
| C14 | RU12 | C16 | C11 | 35.9° | 35.9° |
| C14 | RU12 | C16 | N22 | 133.3° | 133.3° |
| C14 | RU12 | C13 | C17 | 116.9° | 116.9° |
| C14 | RU12 | C13 | C11 | 62.2° | 62.2° |
| C14 | RU12 | C13 | N22 | 161.4° | 161.4° |
| C14 | RU12 | C17 | C11 | 36.6° | 36.6° |
| C14 | RU12 | C17 | N22 | 143.2° | 143.2° |
| C14 | RU12 | C11 | N22 | 139.2° | 139.2° |
| C14 | RU12 | C11 | O10 | 136.8° | 136.8° |
| C14 | RU12 | C17 | H17 | 159.3° | 159.3° |
| C14 | RU12 | C16 | H16 | 158.0° | 158.0° |
| RU12 | C14 | C13 | H14 | 103.5° | 103.5° |
| C14 | RU12 | C13 | H13 | 121.5° | 121.5° |
| C14 | RU12 | N22 | C31 | 170.1° | 170.1° |
| C14 | RU12 | N22 | C23 | 1.9° | 1.9° |
| C16 | RU12 | C13 | C17 | 37.6° | 37.6° |
| C16 | RU12 | C13 | C11 | 141.4° | 141.4° |
| C16 | RU12 | C13 | N22 | 119.3° | 119.3° |
| C16 | RU12 | C17 | C11 | 115.5° | 115.5° |
| C16 | RU12 | C17 | N22 | 137.9° | 137.9° |
| C16 | RU12 | C11 | N22 | 170.8° | 170.8° |
| C16 | RU12 | C11 | O10 | 105.2° | 105.2° |
| RU12 | C16 | C17 | H16 | 103.6° | 103.6° |
| C16 | RU12 | C17 | H17 | 121.8° | 121.8° |
| C16 | RU12 | C14 | H14 | 159.3° | 159.3° |
| C16 | RU12 | C13 | H13 | 159.2° | 159.2° |
| C16 | RU12 | N22 | C31 | 85.3° | 85.3° |
| C16 | RU12 | N22 | C23 | 86.7° | 86.7° |
| C13 | RU12 | C17 | C11 | 1.5° | 1.5° |
| C13 | RU12 | C17 | N22 | 105.1° | 105.1° |
| C13 | RU12 | C11 | N22 | 105.8° | 105.8° |
| C13 | RU12 | C11 | O10 | 170.2° | 170.2° |
| RU12 | C13 | C17 | H13 | 105.5° | 105.5° |
| C13 | RU12 | C17 | H17 | 121.2° | 121.2° |
| C13 | RU12 | C16 | H16 | 158.7° | 158.7° |
| C13 | RU12 | C15 | H15 | 159.2° | 159.2° |
| C13 | RU12 | N22 | C31 | 152.4° | 152.4° |
| C13 | RU12 | N22 | C23 | 19.6° | 19.6° |
| C17 | RU12 | C11 | N22 | 106.7° | 106.7° |
| C17 | RU12 | C11 | O10 | 169.3° | 169.3° |
| C17 | RU12 | C15 | H15 | 157.9° | 157.9° |
| C17 | RU12 | C14 | H14 | 158.3° | 158.3° |
| C17 | RU12 | N22 | C31 | 114.3° | 114.3° |
| C17 | RU12 | N22 | C23 | 57.7° | 57.7° |
| C11 | RU12 | C17 | H17 | 122.7° | 122.7° |
| C11 | RU12 | C16 | H16 | 122.2° | 122.2° |
| C11 | RU12 | C15 | H15 | 59.8° | 59.8° |
| C11 | RU12 | C14 | H14 | 0.5° | 0.5° |
| C11 | RU12 | C13 | H13 | 59.3° | 59.3° |
| C11 | RU12 | N22 | C31 | 101.3° | 101.3° |
| C11 | RU12 | N22 | C23 | 86.7° | 86.7° |
| N22 | RU12 | C11 | O10 | 84.0° | 84.0° |
| N22 | RU12 | C17 | H17 | 16.1° | 16.1° |
| N22 | RU12 | C16 | H16 | 68.6° | 68.6° |
| N22 | RU12 | C15 | H15 | 143.1° | 143.1° |
| N22 | RU12 | C14 | H14 | 91.9° | 91.9° |
| N22 | RU12 | C13 | H13 | 39.9° | 39.9° |
| RU12 | N22 | C31 | C23 | 175.2° | 175.2° |
| RU12 | N22 | C31 | C12 | 4.7° | 4.7° |
| RU12 | N22 | C31 | C30 | 178.9° | 178.9° |
| RU12 | N22 | C23 | C24 | 175.6° | 175.6° |
| RU12 | N22 | C23 | C28 | 7.4° | 7.4° |
| C16 | C17 | C13 | H17 | 164.8° | 164.8° |
| C17 | C16 | C15 | H16 | 164.7° | 164.7° |
| C17 | C16 | C15 | C14 | 0.3° | 0.3° |
| C17 | C16 | C15 | H15 | 165.3° | 165.3° |
| C16 | C17 | C13 | C14 | 1.1° | 1.1° |
| C16 | C17 | C13 | H13 | 167.0° | 167.0° |
| C13 | C17 | C16 | C15 | 0.5° | 0.5° |
| C13 | C17 | C16 | H16 | 164.1° | 164.1° |
| C17 | C13 | C14 | C15 | 1.3° | 1.3° |
| C17 | C13 | C14 | H13 | 168.1° | 168.1° |
| C17 | C13 | C14 | H14 | 166.9° | 166.9° |
| H17 | C17 | C16 | C15 | 165.2° | 165.2° |
| H17 | C17 | C16 | H16 | 0.6° | 0.6° |
| H17 | C17 | C13 | C14 | 165.9° | 165.9° |
| H17 | C17 | C13 | H13 | 2.3° | 2.3° |
| C16 | C15 | C14 | H15 | 165.5° | 165.5° |
| C16 | C15 | C14 | C13 | 0.9° | 0.9° |
| C16 | C15 | C14 | H14 | 166.5° | 166.5° |
| H16 | C16 | C15 | C14 | 164.9° | 164.9° |
| H16 | C16 | C15 | H15 | 0.6° | 0.6° |
| C15 | C14 | C13 | H14 | 165.6° | 165.6° |
| C15 | C14 | C13 | H13 | 166.8° | 166.8° |
| H15 | C15 | C14 | C13 | 164.5° | 164.5° |
| H15 | C15 | C14 | H14 | 1.0° | 1.0° |
| H14 | C14 | C13 | H13 | 1.2° | 1.2° |
| N22 | C31 | C12 | C30 | 176.0° | 176.0° |
| N22 | C31 | C30 | C24 | 2.9° | 2.9° |
| N22 | C31 | C30 | C3 | 178.9° | 178.9° |
| C31 | N22 | C23 | C24 | 3.0° | 3.0° |
| C31 | N22 | C23 | C28 | 179.9° | 179.9° |
| C23 | N22 | C31 | C12 | 179.9° | 179.9° |
| C23 | N22 | C31 | C30 | 3.7° | 3.7° |
| N22 | C23 | C24 | C30 | 1.5° | 1.5° |
| N22 | C23 | C24 | C28 | 177.3° | 177.3° |
| N22 | C23 | C24 | C25 | 177.4° | 177.4° |
| N22 | C23 | C28 | C27 | 178.2° | 178.2° |
| N22 | C23 | C28 | H28 | 1.8° | 1.8° |
| C12 | C31 | C30 | C24 | 179.0° | 179.0° |
| C12 | C31 | C30 | C3 | 2.9° | 2.9° |
| C31 | C30 | C24 | C3 | 177.3° | 177.3° |
| C31 | C30 | C24 | C23 | 0.7° | 0.7° |
| C31 | C30 | C24 | C25 | 179.4° | 179.4° |
| C30 | C24 | C23 | C25 | 178.9° | 178.9° |
| C30 | C24 | C23 | C28 | 178.7° | 178.7° |
| C30 | C24 | C25 | C26 | 177.9° | 177.9° |
| C30 | C24 | C25 | H25 | 2.1° | 2.1° |
| C3 | C30 | C24 | C23 | 178.0° | 178.0° |
| C3 | C30 | C24 | C25 | 3.3° | 3.3° |
| C24 | C23 | C28 | C27 | 1.4° | 1.4° |
| C24 | C23 | C28 | H28 | 178.6° | 178.6° |
| C23 | C24 | C25 | C26 | 0.6° | 0.6° |
| C23 | C24 | C25 | H25 | 179.4° | 179.4° |
| C25 | C24 | C23 | C28 | 0.1° | 0.1° |
| C24 | C25 | C26 | C27 | 2.4° | 2.4° |
| C24 | C25 | C26 | H25 | 180.0° | 180.0° |
| C24 | C25 | C26 | H26 | 177.6° | 177.6° |
| C23 | C28 | C27 | H28 | 180.0° | 180.0° |
| C23 | C28 | C27 | C26 | 3.4° | 3.4° |
| C23 | C28 | C27 | H27 | 176.5° | 176.6° |
| C28 | C27 | C26 | H27 | 180.0° | 180.0° |
| C28 | C27 | C26 | C25 | 4.0° | 4.0° |
| C28 | C27 | C26 | H26 | 176.0° | 176.0° |
| H28 | C28 | C27 | C26 | 176.6° | 176.6° |
| H28 | C28 | C27 | H27 | 3.4° | 3.4° |
| C27 | C26 | C25 | H26 | 180.0° | 180.0° |
| C27 | C26 | C25 | H25 | 177.6° | 177.6° |
| H27 | C27 | C26 | C25 | 176.0° | 176.0° |
| H27 | C27 | C26 | H26 | 4.0° | 4.0° |
| H26 | C26 | C25 | H25 | 2.4° | 2.4° |
