K7C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.38Å | 1.44Å | Aromatic |
| C02 | N03 | sing | 1.32Å | 1.38Å | Aromatic |
| N03 | C04 | doub | 1.32Å | 1.39Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.43Å | Aromatic |
| C01 | C06 | sing | 1.40Å | 1.41Å | Aromatic |
| C05 | C06 | doub | 1.41Å | 1.38Å | Aromatic |
| C06 | C07 | sing | 1.48Å | 1.46Å | |
| C05 | C08 | sing | 1.48Å | 1.54Å | |
| C04 | C09 | sing | 1.51Å | 1.53Å | |
| C09 | C10 | sing | 1.54Å | 1.46Å | |
| C10 | C11 | sing | 1.55Å | 1.47Å | |
| C11 | C12 | sing | 1.55Å | 1.50Å | |
| C09 | C13 | sing | 1.54Å | 1.50Å | |
| C12 | C13 | sing | 1.54Å | 1.51Å | |
| C02 | C14 | sing | 1.51Å | 1.53Å | |
| C14 | C15 | sing | 1.55Å | 1.51Å | |
| C15 | C16 | sing | 1.54Å | 1.52Å | |
| C16 | C17 | sing | 1.54Å | 1.50Å | |
| C14 | C18 | sing | 1.55Å | 1.46Å | |
| C17 | C18 | sing | 1.54Å | 1.49Å | |
| C01 | C19 | sing | 1.51Å | 1.52Å | |
| C09 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | O21 | sing | 1.43Å | 1.41Å | |
| O21 | C22 | sing | 1.43Å | 1.44Å | |
| C08 | N23 | sing | 1.36Å | 1.34Å | Aromatic |
| N23 | N24 | sing | 1.41Å | 1.37Å | Aromatic |
| N24 | N25 | doub | 1.29Å | 1.35Å | Aromatic |
| C08 | N26 | doub | 1.32Å | 1.36Å | Aromatic |
| N25 | N26 | sing | 1.28Å | 1.36Å | Aromatic |
| C07 | C27 | doub | 1.40Å | 1.44Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | doub | 1.39Å | 1.43Å | Aromatic |
| C29 | C30 | sing | 1.39Å | 1.42Å | Aromatic |
| C07 | C31 | sing | 1.39Å | 1.42Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C29 | F32 | sing | 1.35Å | 1.30Å | |
| C10 | H34 | sing | 1.09Å | 1.10Å | |
| C10 | H33 | sing | 1.09Å | 1.10Å | |
| C11 | H35 | sing | 1.09Å | 1.10Å | |
| C11 | H36 | sing | 1.09Å | 1.10Å | |
| C13 | H40 | sing | 1.09Å | 1.10Å | |
| C13 | H39 | sing | 1.09Å | 1.10Å | |
| C15 | H43 | sing | 1.09Å | 1.10Å | |
| C15 | H42 | sing | 1.09Å | 1.10Å | |
| C16 | H45 | sing | 1.09Å | 1.10Å | |
| C16 | H44 | sing | 1.09Å | 1.10Å | |
| C17 | H47 | sing | 1.09Å | 1.10Å | |
| C17 | H46 | sing | 1.09Å | 1.10Å | |
| C18 | H49 | sing | 1.09Å | 1.10Å | |
| C18 | H48 | sing | 1.09Å | 1.10Å | |
| C19 | H52 | sing | 1.09Å | 1.10Å | |
| C19 | H51 | sing | 1.09Å | 1.10Å | |
| C19 | H50 | sing | 1.09Å | 1.10Å | |
| C20 | H53 | sing | 1.09Å | 1.10Å | |
| C20 | H54 | sing | 1.09Å | 1.10Å | |
| C22 | H57 | sing | 1.09Å | 1.10Å | |
| C22 | H56 | sing | 1.09Å | 1.10Å | |
| C22 | H55 | sing | 1.09Å | 1.10Å | |
| C27 | H59 | sing | 1.08Å | 1.08Å | |
| C28 | H60 | sing | 1.08Å | 1.08Å | |
| C12 | H37 | sing | 1.09Å | 1.10Å | |
| C12 | H38 | sing | 1.09Å | 1.10Å | |
| C14 | H41 | sing | 1.09Å | 1.10Å | |
| N23 | H58 | sing | 0.97Å | 1.00Å | |
| C30 | H61 | sing | 1.08Å | 1.08Å | |
| C31 | H62 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | N03 | 119.9° | 121.2° |
| C02 | C01 | C06 | 119.0° | 119.1° |
| C01 | C02 | C14 | 124.1° | 119.4° |
| C02 | C01 | C19 | 121.5° | 120.4° |
| C02 | N03 | C04 | 120.3° | 122.2° |
| N03 | C02 | C14 | 116.0° | 119.4° |
| N03 | C04 | C05 | 120.7° | 120.7° |
| N03 | C04 | C09 | 115.7° | 119.6° |
| C04 | C05 | C06 | 119.3° | 118.7° |
| C04 | C05 | C08 | 124.4° | 120.7° |
| C05 | C04 | C09 | 123.6° | 119.6° |
| C01 | C06 | C05 | 120.7° | 118.1° |
| C01 | C06 | C07 | 122.3° | 120.9° |
| C06 | C01 | C19 | 119.5° | 120.5° |
| C05 | C06 | C07 | 117.0° | 120.9° |
| C06 | C05 | C08 | 116.2° | 120.7° |
| C06 | C07 | C27 | 121.0° | 120.1° |
| C06 | C07 | C31 | 119.7° | 120.1° |
| C05 | C08 | N23 | 127.9° | 126.5° |
| C05 | C08 | N26 | 124.4° | 126.5° |
| C04 | C09 | C10 | 108.6° | 110.0° |
| C04 | C09 | C13 | 110.2° | 110.0° |
| C04 | C09 | C20 | 108.9° | 110.0° |
| C09 | C10 | C11 | 108.5° | 104.2° |
| C10 | C09 | C13 | 106.3° | 106.6° |
| C10 | C09 | C20 | 112.1° | 110.0° |
| C09 | C10 | H34 | 109.7° | 110.5° |
| C09 | C10 | H33 | 109.7° | 110.6° |
| C10 | C11 | C12 | 107.8° | 102.8° |
| C11 | C10 | H34 | 109.7° | 110.4° |
| C11 | C10 | H33 | 109.7° | 110.4° |
| C10 | C11 | H35 | 109.9° | 110.8° |
| C10 | C11 | H36 | 109.9° | 110.8° |
| C11 | C12 | C13 | 105.8° | 104.1° |
| C12 | C11 | H35 | 109.9° | 110.7° |
| C12 | C11 | H36 | 109.9° | 110.8° |
| C11 | C12 | H37 | 110.4° | 110.5° |
| C11 | C12 | H38 | 110.4° | 110.5° |
| C09 | C13 | C12 | 107.0° | 106.6° |
| C13 | C09 | C20 | 110.7° | 110.1° |
| C09 | C13 | H40 | 110.1° | 110.0° |
| C09 | C13 | H39 | 110.1° | 110.1° |
| C12 | C13 | H40 | 110.1° | 110.0° |
| C12 | C13 | H39 | 110.1° | 110.0° |
| C13 | C12 | H37 | 110.3° | 110.5° |
| C13 | C12 | H38 | 110.4° | 110.5° |
| C02 | C14 | C15 | 111.4° | 110.8° |
| C02 | C14 | C18 | 111.6° | 110.7° |
| C02 | C14 | H41 | 108.5° | 110.7° |
| C14 | C15 | C16 | 105.9° | 104.2° |
| C15 | C14 | C18 | 107.3° | 102.7° |
| C14 | C15 | H43 | 110.4° | 110.5° |
| C14 | C15 | H42 | 110.4° | 110.6° |
| C15 | C14 | H41 | 108.7° | 110.8° |
| C15 | C16 | C17 | 101.8° | 106.6° |
| C16 | C15 | H43 | 110.3° | 110.5° |
| C16 | C15 | H42 | 110.3° | 110.5° |
| C15 | C16 | H45 | 111.4° | 110.0° |
| C15 | C16 | H44 | 111.4° | 110.0° |
| C16 | C17 | C18 | 106.4° | 106.6° |
| C17 | C16 | H45 | 111.3° | 110.0° |
| C17 | C16 | H44 | 111.3° | 110.1° |
| C16 | C17 | H47 | 110.2° | 110.1° |
| C16 | C17 | H46 | 110.2° | 110.0° |
| C14 | C18 | C17 | 106.7° | 104.2° |
| C14 | C18 | H49 | 110.1° | 110.5° |
| C14 | C18 | H48 | 110.1° | 110.6° |
| C18 | C14 | H41 | 109.4° | 110.9° |
| C18 | C17 | H47 | 110.2° | 110.0° |
| C18 | C17 | H46 | 110.2° | 110.0° |
| C17 | C18 | H49 | 110.2° | 110.5° |
| C17 | C18 | H48 | 110.2° | 110.5° |
| C01 | C19 | H52 | 109.5° | 109.4° |
| C01 | C19 | H51 | 109.4° | 109.5° |
| C01 | C19 | H50 | 109.5° | 109.5° |
| C09 | C20 | O21 | 111.3° | 109.5° |
| C09 | C20 | H53 | 109.0° | 109.5° |
| C09 | C20 | H54 | 109.0° | 109.5° |
| C20 | O21 | C22 | 116.7° | 114.0° |
| O21 | C20 | H53 | 109.0° | 109.5° |
| O21 | C20 | H54 | 109.0° | 109.5° |
| O21 | C22 | H57 | 109.5° | 109.5° |
| O21 | C22 | H56 | 109.5° | 109.5° |
| O21 | C22 | H55 | 109.5° | 109.5° |
| C08 | N23 | N24 | 108.4° | 105.2° |
| N23 | C08 | N26 | 107.7° | 107.0° |
| C08 | N23 | H58 | 125.8° | 127.4° |
| N23 | N24 | N25 | 107.6° | 106.9° |
| N24 | N23 | H58 | 125.8° | 127.4° |
| N24 | N25 | N26 | 108.0° | 110.4° |
| C08 | N26 | N25 | 108.3° | 110.5° |
| C07 | C27 | C28 | 120.1° | 119.9° |
| C27 | C07 | C31 | 119.3° | 119.8° |
| C07 | C27 | H59 | 119.9° | 120.1° |
| C27 | C28 | C29 | 120.5° | 120.2° |
| C28 | C27 | H59 | 119.9° | 120.0° |
| C27 | C28 | H60 | 119.8° | 119.9° |
| C28 | C29 | C30 | 119.7° | 120.2° |
| C28 | C29 | F32 | 120.7° | 119.9° |
| C29 | C28 | H60 | 119.8° | 119.9° |
| C29 | C30 | C31 | 119.9° | 120.1° |
| C30 | C29 | F32 | 119.6° | 119.9° |
| C29 | C30 | H61 | 120.0° | 120.0° |
| C07 | C31 | C30 | 120.5° | 119.9° |
| C07 | C31 | H62 | 119.8° | 120.0° |
| C31 | C30 | H61 | 120.0° | 120.0° |
| C30 | C31 | H62 | 119.8° | 120.0° |
| H34 | C10 | H33 | 109.4° | 110.5° |
| H35 | C11 | H36 | 109.5° | 110.8° |
| H40 | C13 | H39 | 109.5° | 110.0° |
| H43 | C15 | H42 | 109.5° | 110.4° |
| H45 | C16 | H44 | 109.5° | 110.0° |
| H47 | C17 | H46 | 109.5° | 110.1° |
| H49 | C18 | H48 | 109.5° | 110.4° |
| H52 | C19 | H51 | 109.5° | 109.5° |
| H52 | C19 | H50 | 109.4° | 109.5° |
| H51 | C19 | H50 | 109.5° | 109.5° |
| H53 | C20 | H54 | 109.5° | 109.4° |
| H57 | C22 | H56 | 109.5° | 109.5° |
| H57 | C22 | H55 | 109.5° | 109.5° |
| H56 | C22 | H55 | 109.4° | 109.4° |
| H37 | C12 | H38 | 109.5° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | N03 | C14 | 178.8° | 180.0° |
| C01 | C02 | N03 | C04 | 0.7° | 0.0° |
| C02 | C01 | C06 | C19 | 179.5° | 179.7° |
| C02 | C01 | C06 | C05 | 1.0° | 0.0° |
| C02 | C01 | C06 | C07 | 179.8° | 180.0° |
| C01 | C02 | C14 | C15 | 159.6° | 120.0° |
| C01 | C02 | C14 | C18 | 80.5° | 126.7° |
| C02 | C01 | C19 | H52 | 90.3° | 90.0° |
| C02 | C01 | C19 | H51 | 149.7° | 150.0° |
| C02 | C01 | C19 | H50 | 29.7° | 30.0° |
| C01 | C02 | C14 | H41 | 40.0° | 3.3° |
| C02 | N03 | C04 | C05 | 1.8° | 0.0° |
| N03 | C02 | C01 | C06 | 0.3° | 0.0° |
| C02 | N03 | C04 | C09 | 178.3° | 180.0° |
| N03 | C02 | C14 | C15 | 19.1° | 60.0° |
| N03 | C02 | C14 | C18 | 100.8° | 53.3° |
| N03 | C02 | C01 | C19 | 179.7° | 179.7° |
| N03 | C02 | C14 | H41 | 138.7° | 176.7° |
| N03 | C04 | C05 | C09 | 176.2° | 180.0° |
| N03 | C04 | C05 | C06 | 2.4° | 0.0° |
| N03 | C04 | C05 | C08 | 179.5° | 180.0° |
| N03 | C04 | C09 | C10 | 117.7° | 125.2° |
| N03 | C04 | C09 | C13 | 1.6° | 8.0° |
| C04 | N03 | C02 | C14 | 178.1° | 180.0° |
| N03 | C04 | C09 | C20 | 120.0° | 113.5° |
| C04 | C05 | C06 | C01 | 2.0° | 0.0° |
| C04 | C05 | C06 | C08 | 177.3° | 180.0° |
| C04 | C05 | C06 | C07 | 178.7° | 180.0° |
| C05 | C04 | C09 | C10 | 58.7° | 54.8° |
| C05 | C04 | C09 | C13 | 174.8° | 172.0° |
| C05 | C04 | C09 | C20 | 63.6° | 66.5° |
| C04 | C05 | C08 | N23 | 82.2° | 167.2° |
| C04 | C05 | C08 | N26 | 98.3° | 12.4° |
| C01 | C06 | C05 | C07 | 179.3° | 180.0° |
| C01 | C06 | C05 | C08 | 179.3° | 180.0° |
| C06 | C01 | C02 | C14 | 178.4° | 179.9° |
| C01 | C06 | C07 | C27 | 73.0° | 69.9° |
| C01 | C06 | C07 | C31 | 105.8° | 110.3° |
| C06 | C01 | C19 | H52 | 90.3° | 90.3° |
| C06 | C01 | C19 | H51 | 29.7° | 29.6° |
| C06 | C01 | C19 | H50 | 149.7° | 149.7° |
| C06 | C05 | C04 | C09 | 178.7° | 180.0° |
| C05 | C06 | C01 | C19 | 179.6° | 179.7° |
| C06 | C05 | C08 | N23 | 100.7° | 12.8° |
| C06 | C05 | C08 | N26 | 78.8° | 167.6° |
| C05 | C06 | C07 | C27 | 107.6° | 110.0° |
| C05 | C06 | C07 | C31 | 73.5° | 69.7° |
| C07 | C06 | C05 | C08 | 1.4° | 0.0° |
| C07 | C06 | C01 | C19 | 0.3° | 0.3° |
| C06 | C07 | C27 | C31 | 178.9° | 179.8° |
| C06 | C07 | C27 | C28 | 179.5° | 180.0° |
| C06 | C07 | C31 | C30 | 179.2° | 179.7° |
| C06 | C07 | C27 | H59 | 0.5° | 0.0° |
| C06 | C07 | C31 | H62 | 0.8° | 0.0° |
| C08 | C05 | C04 | C09 | 4.3° | 0.0° |
| C05 | C08 | N23 | N26 | 179.6° | 179.7° |
| C05 | C08 | N23 | N24 | 179.6° | 180.0° |
| C05 | C08 | N26 | N25 | 179.8° | 179.8° |
| C05 | C08 | N23 | H58 | 0.5° | 0.0° |
| C04 | C09 | C10 | C13 | 118.6° | 119.3° |
| C04 | C09 | C10 | C20 | 120.3° | 121.3° |
| C04 | C09 | C10 | C11 | 97.1° | 142.9° |
| C04 | C09 | C13 | C20 | 120.5° | 121.4° |
| C04 | C09 | C13 | C12 | 97.1° | 119.3° |
| C04 | C09 | C20 | O21 | 59.6° | 66.7° |
| C04 | C09 | C10 | H34 | 143.0° | 24.3° |
| C04 | C09 | C10 | H33 | 22.7° | 98.4° |
| C04 | C09 | C13 | H40 | 22.5° | 0.0° |
| C04 | C09 | C13 | H39 | 143.2° | 121.4° |
| C04 | C09 | C20 | H53 | 60.7° | 53.3° |
| C04 | C09 | C20 | H54 | 179.9° | 173.3° |
| C09 | C10 | C11 | H34 | 119.9° | 118.7° |
| C09 | C10 | C11 | H33 | 119.8° | 118.8° |
| C09 | C10 | C11 | C12 | 14.2° | 37.9° |
| C10 | C09 | C13 | C20 | 121.9° | 119.3° |
| C10 | C09 | C13 | C12 | 20.4° | 0.0° |
| C10 | C09 | C20 | O21 | 179.8° | 172.0° |
| C09 | C10 | H34 | H33 | 120.4° | 122.8° |
| C09 | C10 | C11 | H35 | 133.9° | 80.4° |
| C09 | C10 | C11 | H36 | 105.5° | 156.3° |
| C10 | C09 | C13 | H40 | 140.0° | 119.2° |
| C10 | C09 | C13 | H39 | 99.2° | 119.3° |
| C10 | C09 | C20 | H53 | 59.5° | 68.0° |
| C10 | C09 | C20 | H54 | 60.0° | 52.0° |
| C10 | C11 | C12 | H35 | 119.7° | 118.3° |
| C10 | C11 | C12 | H36 | 119.7° | 118.4° |
| C11 | C10 | C09 | C13 | 21.4° | 23.6° |
| C10 | C11 | C12 | C13 | 1.3° | 37.9° |
| C11 | C10 | C09 | C20 | 142.5° | 95.8° |
| C11 | C10 | H34 | H33 | 120.5° | 122.5° |
| C10 | C11 | H35 | H36 | 120.8° | 123.4° |
| C10 | C11 | C12 | H37 | 118.1° | 156.6° |
| C10 | C11 | C12 | H38 | 120.7° | 80.7° |
| C11 | C12 | C13 | C09 | 11.7° | 23.6° |
| C11 | C12 | C13 | H37 | 119.4° | 118.7° |
| C11 | C12 | C13 | H38 | 119.4° | 118.6° |
| C12 | C11 | C10 | H34 | 105.7° | 80.7° |
| C12 | C11 | C10 | H33 | 134.1° | 156.7° |
| C12 | C11 | H35 | H36 | 120.8° | 123.3° |
| C11 | C12 | C13 | H40 | 131.3° | 142.9° |
| C11 | C12 | C13 | H39 | 107.9° | 95.7° |
| C11 | C12 | H37 | H38 | 121.7° | 122.6° |
| C09 | C13 | C12 | H40 | 119.6° | 119.3° |
| C09 | C13 | C12 | H39 | 119.6° | 119.3° |
| C13 | C09 | C20 | O21 | 61.8° | 54.7° |
| C13 | C09 | C10 | H34 | 98.4° | 95.0° |
| C13 | C09 | C10 | H33 | 141.3° | 142.3° |
| C09 | C13 | H40 | H39 | 121.1° | 121.4° |
| C13 | C09 | C20 | H53 | 177.9° | 174.7° |
| C13 | C09 | C20 | H54 | 58.5° | 65.3° |
| C09 | C13 | C12 | H37 | 131.1° | 142.3° |
| C09 | C13 | C12 | H38 | 107.7° | 95.0° |
| C12 | C13 | C09 | C20 | 142.3° | 119.3° |
| C13 | C12 | C11 | H35 | 121.0° | 80.4° |
| C13 | C12 | C11 | H36 | 118.5° | 156.3° |
| C12 | C13 | H40 | H39 | 121.1° | 121.4° |
| C13 | C12 | H37 | H38 | 121.7° | 122.6° |
| C02 | C14 | C15 | C18 | 122.4° | 118.3° |
| C02 | C14 | C15 | H41 | 119.5° | 123.2° |
| C02 | C14 | C15 | C16 | 106.5° | 156.2° |
| C02 | C14 | C18 | H41 | 120.0° | 123.3° |
| C02 | C14 | C18 | C17 | 127.9° | 156.3° |
| C14 | C02 | C01 | C19 | 1.0° | 0.3° |
| C02 | C14 | C15 | H43 | 134.1° | 37.6° |
| C02 | C14 | C15 | H42 | 12.9° | 85.0° |
| C02 | C14 | C18 | H49 | 8.3° | 85.0° |
| C02 | C14 | C18 | H48 | 112.5° | 37.5° |
| C14 | C15 | C16 | H43 | 119.4° | 118.6° |
| C14 | C15 | C16 | H42 | 119.4° | 118.8° |
| C14 | C15 | C16 | C17 | 30.5° | 23.6° |
| C15 | C14 | C18 | H41 | 117.8° | 118.4° |
| C15 | C14 | C18 | C17 | 5.7° | 37.9° |
| C14 | C15 | H43 | H42 | 121.7° | 122.7° |
| C14 | C15 | C16 | H45 | 149.3° | 95.7° |
| C14 | C15 | C16 | H44 | 88.2° | 142.9° |
| C15 | C14 | C18 | H49 | 113.9° | 156.6° |
| C15 | C14 | C18 | H48 | 125.2° | 80.8° |
| C15 | C16 | C17 | H45 | 118.8° | 119.3° |
| C15 | C16 | C17 | H44 | 118.8° | 119.3° |
| C16 | C15 | C14 | C18 | 15.9° | 37.9° |
| C15 | C16 | C17 | C18 | 34.3° | 0.0° |
| C16 | C15 | H43 | H42 | 121.6° | 122.6° |
| C15 | C16 | H45 | H44 | 123.6° | 121.4° |
| C15 | C16 | C17 | H47 | 85.2° | 119.2° |
| C15 | C16 | C17 | H46 | 153.9° | 119.3° |
| C16 | C15 | C14 | H41 | 134.1° | 80.5° |
| C16 | C17 | C18 | C14 | 25.6° | 23.6° |
| C16 | C17 | C18 | H47 | 119.5° | 119.3° |
| C16 | C17 | C18 | H46 | 119.5° | 119.3° |
| C17 | C16 | C15 | H43 | 88.9° | 95.1° |
| C17 | C16 | C15 | H42 | 149.9° | 142.4° |
| C17 | C16 | H45 | H44 | 123.5° | 121.4° |
| C16 | C17 | H47 | H46 | 121.4° | 121.5° |
| C16 | C17 | C18 | H49 | 94.0° | 142.3° |
| C16 | C17 | C18 | H48 | 145.1° | 95.2° |
| C14 | C18 | C17 | H49 | 119.6° | 118.7° |
| C14 | C18 | C17 | H48 | 119.6° | 118.8° |
| C18 | C14 | C15 | H43 | 103.5° | 80.8° |
| C18 | C14 | C15 | H42 | 135.3° | 156.7° |
| C14 | C18 | C17 | H47 | 93.9° | 95.7° |
| C14 | C18 | C17 | H46 | 145.1° | 142.9° |
| C14 | C18 | H49 | H48 | 121.2° | 122.7° |
| C18 | C17 | C16 | H45 | 153.1° | 119.3° |
| C18 | C17 | C16 | H44 | 84.4° | 119.3° |
| C18 | C17 | H47 | H46 | 121.4° | 121.4° |
| C17 | C18 | H49 | H48 | 121.3° | 122.5° |
| C17 | C18 | C14 | H41 | 112.1° | 80.5° |
| C01 | C19 | H52 | H51 | 120.0° | 120.0° |
| C01 | C19 | H52 | H50 | 120.0° | 120.0° |
| C01 | C19 | H51 | H50 | 120.0° | 120.0° |
| C09 | C20 | O21 | H53 | 120.3° | 120.0° |
| C09 | C20 | O21 | H54 | 120.3° | 120.0° |
| C09 | C20 | O21 | C22 | 179.6° | 180.0° |
| C20 | C09 | C10 | H34 | 22.6° | 145.6° |
| C20 | C09 | C10 | H33 | 97.6° | 22.9° |
| C20 | C09 | C13 | H40 | 98.1° | 121.4° |
| C20 | C09 | C13 | H39 | 22.7° | 0.0° |
| C09 | C20 | H53 | H54 | 119.2° | 120.0° |
| O21 | C20 | H53 | H54 | 119.2° | 120.0° |
| C20 | O21 | C22 | H57 | 180.0° | 60.0° |
| C20 | O21 | C22 | H56 | 60.0° | 60.0° |
| C20 | O21 | C22 | H55 | 60.0° | 180.0° |
| C22 | O21 | C20 | H53 | 59.3° | 60.0° |
| C22 | O21 | C20 | H54 | 60.1° | 60.0° |
| O21 | C22 | H57 | H56 | 120.0° | 120.0° |
| O21 | C22 | H57 | H55 | 120.0° | 120.0° |
| O21 | C22 | H56 | H55 | 120.0° | 120.0° |
| C08 | N23 | N24 | H58 | 180.0° | 180.0° |
| C08 | N23 | N24 | N25 | 0.8° | 0.0° |
| N23 | C08 | N26 | N25 | 0.6° | 0.5° |
| N24 | N23 | C08 | N26 | 0.9° | 0.3° |
| N23 | N24 | N25 | N26 | 0.4° | 0.3° |
| N24 | N25 | N26 | C08 | 0.2° | 0.5° |
| N25 | N24 | N23 | H58 | 179.2° | 180.0° |
| N26 | C08 | N23 | H58 | 179.1° | 179.7° |
| C07 | C27 | C28 | H59 | 180.0° | 180.0° |
| C07 | C27 | C28 | C29 | 0.3° | 0.1° |
| C27 | C07 | C31 | C30 | 0.3° | 0.5° |
| C07 | C27 | C28 | H60 | 179.7° | 180.0° |
| C27 | C07 | C31 | H62 | 179.7° | 179.7° |
| C27 | C28 | C29 | H60 | 180.0° | 179.9° |
| C27 | C28 | C29 | C30 | 0.2° | 0.0° |
| C28 | C27 | C07 | C31 | 0.6° | 0.2° |
| C27 | C28 | C29 | F32 | 179.9° | 179.9° |
| C28 | C29 | C30 | F32 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 0.4° | 0.3° |
| C29 | C28 | C27 | H59 | 179.6° | 180.0° |
| C28 | C29 | C30 | H61 | 179.6° | 180.0° |
| C29 | C30 | C31 | C07 | 0.2° | 0.6° |
| C29 | C30 | C31 | H61 | 180.0° | 179.7° |
| C30 | C29 | C28 | H60 | 179.8° | 179.9° |
| C29 | C30 | C31 | H62 | 179.8° | 179.7° |
| C07 | C31 | C30 | H62 | 180.0° | 179.8° |
| C31 | C07 | C27 | H59 | 179.4° | 179.8° |
| C07 | C31 | C30 | H61 | 179.8° | 179.7° |
| C31 | C30 | C29 | F32 | 179.6° | 179.8° |
| F32 | C29 | C28 | H60 | 0.1° | 0.0° |
| F32 | C29 | C30 | H61 | 0.4° | 0.0° |
| H34 | C10 | C11 | H35 | 14.1° | 161.0° |
| H34 | C10 | C11 | H36 | 134.6° | 37.6° |
| H33 | C10 | C11 | H35 | 106.2° | 38.4° |
| H33 | C10 | C11 | H36 | 14.3° | 84.9° |
| H35 | C11 | C12 | H37 | 1.6° | 38.2° |
| H35 | C11 | C12 | H38 | 119.6° | 160.9° |
| H36 | C11 | C12 | H37 | 122.1° | 85.0° |
| H36 | C11 | C12 | H38 | 1.0° | 37.6° |
| H40 | C13 | C12 | H37 | 109.3° | 98.4° |
| H40 | C13 | C12 | H38 | 11.9° | 24.2° |
| H39 | C13 | C12 | H37 | 11.5° | 22.9° |
| H39 | C13 | C12 | H38 | 132.6° | 145.6° |
| H43 | C15 | C16 | H45 | 29.8° | 145.6° |
| H43 | C15 | C16 | H44 | 152.3° | 24.3° |
| H43 | C15 | C14 | H41 | 14.6° | 160.8° |
| H42 | C15 | C16 | H45 | 91.3° | 23.1° |
| H42 | C15 | C16 | H44 | 31.2° | 98.2° |
| H42 | C15 | C14 | H41 | 106.5° | 38.2° |
| H45 | C16 | C17 | H47 | 33.6° | 0.1° |
| H45 | C16 | C17 | H46 | 87.3° | 121.5° |
| H44 | C16 | C17 | H47 | 156.1° | 121.5° |
| H44 | C16 | C17 | H46 | 35.1° | 0.1° |
| H47 | C17 | C18 | H49 | 146.5° | 23.0° |
| H47 | C17 | C18 | H48 | 25.6° | 145.5° |
| H46 | C17 | C18 | H49 | 25.5° | 98.4° |
| H46 | C17 | C18 | H48 | 95.4° | 24.1° |
| H49 | C18 | C14 | H41 | 128.3° | 38.2° |
| H48 | C18 | C14 | H41 | 7.5° | 160.8° |
| H52 | C19 | H51 | H50 | 120.0° | 120.0° |
| H57 | C22 | H56 | H55 | 120.0° | 120.0° |
| H59 | C27 | C28 | H60 | 0.4° | 0.1° |
| H61 | C30 | C31 | H62 | 0.2° | 0.1° |
