76K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O22 | C20 | doub | 1.21Å | 1.26Å | |
| C20 | O21 | sing | 1.34Å | 1.25Å | |
| C20 | C18 | sing | 1.51Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| O27 | C26 | sing | 1.43Å | 1.42Å | |
| C18 | N19 | sing | 1.47Å | 1.49Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | N23 | sing | 1.47Å | 1.51Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.53Å | 1.50Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| N23 | C24 | sing | 1.47Å | 1.49Å | |
| O29 | C28 | sing | 1.43Å | 1.42Å | |
| O31 | C30 | sing | 1.43Å | 1.42Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | O12 | sing | 1.44Å | 1.45Å | |
| C13 | C28 | sing | 1.55Å | 1.53Å | |
| O12 | C11 | sing | 1.44Å | 1.44Å | |
| C28 | C30 | sing | 1.55Å | 1.55Å | |
| C30 | C11 | sing | 1.54Å | 1.55Å | |
| C11 | N7 | sing | 1.46Å | 1.46Å | |
| N7 | C8 | sing | 1.36Å | 1.38Å | Aromatic |
| N7 | C6 | sing | 1.37Å | 1.38Å | Aromatic |
| C8 | N9 | doub | 1.30Å | 1.31Å | Aromatic |
| N5 | C6 | doub | 1.33Å | 1.35Å | Aromatic |
| N5 | C4 | sing | 1.32Å | 1.33Å | Aromatic |
| C6 | C10 | sing | 1.41Å | 1.37Å | Aromatic |
| N9 | C10 | sing | 1.35Å | 1.39Å | Aromatic |
| C10 | C2 | doub | 1.41Å | 1.40Å | Aromatic |
| C4 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| N3 | C2 | sing | 1.33Å | 1.36Å | Aromatic |
| C2 | N1 | sing | 1.38Å | 1.34Å | |
| C8 | H46 | sing | 1.08Å | 1.08Å | |
| C11 | H32 | sing | 1.09Å | 1.10Å | |
| C13 | H33 | sing | 1.09Å | 1.10Å | |
| C14 | H47 | sing | 1.09Å | 1.10Å | |
| C14 | H48 | sing | 1.09Å | 1.10Å | |
| C15 | H34 | sing | 1.09Å | 1.10Å | |
| C16 | H49 | sing | 1.09Å | 1.10Å | |
| C16 | H50 | sing | 1.09Å | 1.10Å | |
| C24 | H54 | sing | 1.09Å | 1.10Å | |
| C24 | H53 | sing | 1.09Å | 1.10Å | |
| C25 | H55 | sing | 1.09Å | 1.10Å | |
| C25 | H56 | sing | 1.09Å | 1.10Å | |
| C26 | H57 | sing | 1.09Å | 1.10Å | |
| C26 | H58 | sing | 1.09Å | 1.10Å | |
| C28 | H41 | sing | 1.09Å | 1.10Å | |
| N1 | H43 | sing | 0.97Å | 1.00Å | |
| N1 | H44 | sing | 0.97Å | 1.00Å | |
| C4 | H45 | sing | 1.08Å | 1.08Å | |
| C17 | H52 | sing | 1.09Å | 1.10Å | |
| C17 | H51 | sing | 1.09Å | 1.10Å | |
| C18 | H35 | sing | 1.09Å | 1.10Å | |
| N19 | H36 | sing | 1.01Å | 1.00Å | |
| N19 | H37 | sing | 1.01Å | 1.00Å | |
| N19 | H38 | sing | 1.01Å | 1.00Å | |
| O21 | H1 | sing | 0.97Å | 0.95Å | |
| N23 | H39 | sing | 1.01Å | 1.00Å | |
| N23 | H40 | sing | 1.01Å | 1.00Å | |
| O27 | H59 | sing | 0.97Å | 0.95Å | |
| O29 | H60 | sing | 0.97Å | 0.95Å | |
| C30 | H42 | sing | 1.09Å | 1.10Å | |
| O31 | H61 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O22 | C20 | O21 | 125.6° | 119.9° |
| O22 | C20 | C18 | 117.2° | 120.0° |
| O21 | C20 | C18 | 117.2° | 120.1° |
| C20 | O21 | H1 | 109.5° | 117.0° |
| C20 | C18 | C17 | 112.1° | 109.5° |
| C20 | C18 | N19 | 110.4° | 109.5° |
| C20 | C18 | H35 | 107.7° | 109.4° |
| C18 | C17 | C16 | 113.0° | 109.5° |
| C17 | C18 | N19 | 110.5° | 109.5° |
| C18 | C17 | H52 | 108.6° | 109.4° |
| C18 | C17 | H51 | 108.6° | 109.5° |
| C17 | C18 | H35 | 107.8° | 109.5° |
| C17 | C16 | C15 | 114.6° | 109.5° |
| C17 | C16 | H49 | 108.2° | 109.5° |
| C17 | C16 | H50 | 108.2° | 109.5° |
| C16 | C17 | H52 | 108.6° | 109.4° |
| C16 | C17 | H51 | 108.6° | 109.5° |
| O27 | C26 | C25 | 110.1° | 109.4° |
| O27 | C26 | H57 | 109.3° | 109.4° |
| O27 | C26 | H58 | 109.3° | 109.4° |
| C26 | O27 | H59 | 109.5° | 114.0° |
| N19 | C18 | H35 | 108.2° | 109.4° |
| C18 | N19 | H36 | 109.5° | 109.4° |
| C18 | N19 | H37 | 109.5° | 109.4° |
| C18 | N19 | H38 | 109.5° | 109.5° |
| C16 | C15 | N23 | 106.7° | 109.4° |
| C16 | C15 | C14 | 113.2° | 109.4° |
| C16 | C15 | H34 | 108.5° | 109.5° |
| C15 | C16 | H49 | 108.2° | 109.5° |
| C15 | C16 | H50 | 108.2° | 109.5° |
| N23 | C15 | C14 | 111.1° | 109.5° |
| C15 | N23 | C24 | 117.5° | 109.5° |
| N23 | C15 | H34 | 108.7° | 109.5° |
| C15 | N23 | H39 | 107.4° | 109.4° |
| C15 | N23 | H40 | 107.4° | 109.5° |
| C15 | C14 | C13 | 115.8° | 109.5° |
| C15 | C14 | H47 | 107.9° | 109.5° |
| C15 | C14 | H48 | 107.9° | 109.5° |
| C14 | C15 | H34 | 108.5° | 109.5° |
| C26 | C25 | C24 | 112.8° | 109.4° |
| C26 | C25 | H55 | 108.6° | 109.5° |
| C26 | C25 | H56 | 108.6° | 109.5° |
| C25 | C26 | H57 | 109.3° | 109.5° |
| C25 | C26 | H58 | 109.3° | 109.5° |
| C25 | C24 | N23 | 110.4° | 109.5° |
| C25 | C24 | H54 | 109.2° | 109.5° |
| C25 | C24 | H53 | 109.2° | 109.5° |
| C24 | C25 | H55 | 108.6° | 109.5° |
| C24 | C25 | H56 | 108.6° | 109.5° |
| N23 | C24 | H54 | 109.2° | 109.4° |
| N23 | C24 | H53 | 109.3° | 109.4° |
| C24 | N23 | H39 | 107.4° | 109.5° |
| C24 | N23 | H40 | 107.4° | 109.5° |
| O29 | C28 | C13 | 110.5° | 110.5° |
| O29 | C28 | C30 | 113.4° | 110.5° |
| O29 | C28 | H41 | 111.3° | 110.6° |
| C28 | O29 | H60 | 109.5° | 114.0° |
| O31 | C30 | C28 | 111.9° | 110.5° |
| O31 | C30 | C11 | 111.1° | 110.5° |
| O31 | C30 | H42 | 111.7° | 110.6° |
| C30 | O31 | H61 | 109.5° | 113.9° |
| C14 | C13 | O12 | 111.1° | 110.4° |
| C14 | C13 | C28 | 113.4° | 110.5° |
| C14 | C13 | H33 | 108.7° | 110.3° |
| C13 | C14 | H47 | 107.9° | 109.4° |
| C13 | C14 | H48 | 107.9° | 109.4° |
| O12 | C13 | C28 | 105.5° | 104.8° |
| C13 | O12 | C11 | 111.0° | 105.3° |
| O12 | C13 | H33 | 109.6° | 110.3° |
| C13 | C28 | C30 | 101.9° | 104.0° |
| C28 | C13 | H33 | 108.5° | 110.4° |
| C13 | C28 | H41 | 109.8° | 110.5° |
| O12 | C11 | C30 | 105.5° | 104.9° |
| O12 | C11 | N7 | 108.7° | 110.3° |
| O12 | C11 | H32 | 111.0° | 110.3° |
| C28 | C30 | C11 | 101.8° | 104.1° |
| C30 | C28 | H41 | 109.6° | 110.5° |
| C28 | C30 | H42 | 109.9° | 110.5° |
| C30 | C11 | N7 | 111.4° | 110.4° |
| C30 | C11 | H32 | 109.5° | 110.4° |
| C11 | C30 | H42 | 109.9° | 110.5° |
| C11 | N7 | C8 | 126.0° | 126.3° |
| C11 | N7 | C6 | 127.4° | 126.3° |
| N7 | C11 | H32 | 110.7° | 110.4° |
| C8 | N7 | C6 | 106.6° | 107.4° |
| N7 | C8 | N9 | 112.2° | 110.0° |
| N7 | C8 | H46 | 123.9° | 125.0° |
| N7 | C6 | N5 | 127.9° | 134.9° |
| N7 | C6 | C10 | 105.6° | 106.0° |
| C8 | N9 | C10 | 105.1° | 109.5° |
| N9 | C8 | H46 | 123.9° | 125.0° |
| C6 | N5 | C4 | 111.8° | 120.7° |
| N5 | C6 | C10 | 126.5° | 119.1° |
| N5 | C4 | N3 | 128.0° | 122.4° |
| N5 | C4 | H45 | 116.0° | 118.8° |
| C6 | C10 | N9 | 110.4° | 107.1° |
| C6 | C10 | C2 | 117.0° | 118.1° |
| N9 | C10 | C2 | 132.5° | 134.7° |
| C10 | C2 | N3 | 118.4° | 118.5° |
| C10 | C2 | N1 | 122.6° | 120.8° |
| C4 | N3 | C2 | 118.3° | 121.2° |
| N3 | C4 | H45 | 116.0° | 118.8° |
| N3 | C2 | N1 | 119.0° | 120.8° |
| C2 | N1 | H43 | 109.5° | 120.0° |
| C2 | N1 | H44 | 109.5° | 120.0° |
| H47 | C14 | H48 | 109.5° | 109.5° |
| H49 | C16 | H50 | 109.5° | 109.5° |
| H54 | C24 | H53 | 109.5° | 109.5° |
| H55 | C25 | H56 | 109.5° | 109.5° |
| H57 | C26 | H58 | 109.4° | 109.5° |
| H43 | N1 | H44 | 109.5° | 120.0° |
| H52 | C17 | H51 | 109.5° | 109.5° |
| H36 | N19 | H37 | 109.5° | 109.5° |
| H36 | N19 | H38 | 109.5° | 109.5° |
| H37 | N19 | H38 | 109.5° | 109.5° |
| H39 | N23 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O22 | C20 | O21 | C18 | 179.9° | 180.0° |
| O22 | C20 | C18 | C17 | 52.5° | 100.0° |
| O22 | C20 | C18 | N19 | 176.2° | 20.0° |
| O22 | C20 | C18 | H35 | 65.9° | 140.0° |
| O22 | C20 | O21 | H1 | 0.0° | 0.0° |
| O21 | C20 | C18 | C17 | 127.6° | 79.9° |
| O21 | C20 | C18 | N19 | 3.9° | 160.0° |
| O21 | C20 | C18 | H35 | 114.0° | 40.1° |
| C20 | C18 | C17 | N19 | 123.6° | 120.1° |
| C20 | C18 | C17 | H35 | 118.3° | 120.0° |
| C20 | C18 | C17 | C16 | 161.8° | 175.0° |
| C20 | C18 | N19 | H35 | 117.6° | 119.9° |
| C20 | C18 | C17 | H52 | 41.3° | 65.0° |
| C20 | C18 | C17 | H51 | 77.6° | 54.9° |
| C20 | C18 | N19 | H36 | 180.0° | 180.0° |
| C20 | C18 | N19 | H37 | 60.0° | 60.0° |
| C20 | C18 | N19 | H38 | 60.0° | 60.0° |
| C18 | C20 | O21 | H1 | 179.9° | 180.0° |
| C18 | C17 | C16 | H52 | 120.5° | 120.0° |
| C18 | C17 | C16 | H51 | 120.5° | 120.0° |
| C17 | C18 | N19 | H35 | 117.8° | 120.0° |
| C18 | C17 | C16 | C15 | 176.3° | 177.1° |
| C18 | C17 | C16 | H49 | 63.0° | 62.9° |
| C18 | C17 | C16 | H50 | 55.5° | 57.1° |
| C18 | C17 | H52 | H51 | 118.4° | 120.0° |
| C17 | C18 | N19 | H36 | 55.4° | 59.9° |
| C17 | C18 | N19 | H37 | 64.6° | 60.0° |
| C17 | C18 | N19 | H38 | 175.4° | 180.0° |
| C16 | C17 | C18 | N19 | 74.5° | 64.9° |
| C17 | C16 | C15 | H49 | 120.7° | 120.0° |
| C17 | C16 | C15 | H50 | 120.8° | 120.0° |
| C17 | C16 | C15 | N23 | 143.8° | 174.0° |
| C17 | C16 | C15 | C14 | 93.7° | 66.0° |
| C17 | C16 | C15 | H34 | 26.8° | 54.0° |
| C17 | C16 | H49 | H50 | 117.7° | 120.0° |
| C16 | C17 | H52 | H51 | 118.4° | 120.0° |
| C16 | C17 | C18 | H35 | 43.5° | 55.0° |
| O27 | C26 | C25 | H57 | 120.1° | 119.9° |
| O27 | C26 | C25 | H58 | 120.1° | 119.9° |
| O27 | C26 | C25 | C24 | 63.4° | 180.0° |
| O27 | C26 | C25 | H55 | 57.1° | 60.0° |
| O27 | C26 | C25 | H56 | 176.1° | 60.0° |
| O27 | C26 | H57 | H58 | 119.7° | 120.0° |
| N19 | C18 | C17 | H52 | 164.9° | 55.0° |
| N19 | C18 | C17 | H51 | 46.0° | 175.0° |
| C18 | N19 | H36 | H37 | 120.0° | 119.9° |
| C18 | N19 | H36 | H38 | 120.0° | 120.0° |
| C18 | N19 | H37 | H38 | 120.0° | 120.0° |
| C16 | C15 | N23 | C14 | 123.8° | 120.0° |
| C16 | C15 | N23 | H34 | 116.8° | 120.0° |
| C16 | C15 | C14 | H34 | 120.5° | 120.0° |
| C16 | C15 | N23 | C24 | 171.8° | 65.8° |
| C16 | C15 | C14 | C13 | 59.6° | 175.0° |
| C16 | C15 | C14 | H47 | 61.3° | 65.0° |
| C16 | C15 | C14 | H48 | 179.5° | 55.0° |
| C15 | C16 | H49 | H50 | 117.7° | 120.0° |
| C15 | C16 | C17 | H52 | 55.8° | 57.1° |
| C15 | C16 | C17 | H51 | 63.2° | 62.9° |
| C16 | C15 | N23 | H39 | 50.7° | 174.3° |
| C16 | C15 | N23 | H40 | 67.0° | 54.3° |
| N23 | C15 | C14 | H34 | 119.5° | 120.0° |
| C15 | N23 | C24 | C25 | 163.8° | 174.7° |
| C15 | N23 | C24 | H39 | 121.1° | 120.0° |
| C15 | N23 | C24 | H40 | 121.2° | 120.0° |
| N23 | C15 | C14 | C13 | 179.7° | 65.0° |
| N23 | C15 | C14 | H47 | 58.7° | 54.9° |
| N23 | C15 | C14 | H48 | 59.4° | 175.0° |
| N23 | C15 | C16 | H49 | 95.5° | 54.0° |
| N23 | C15 | C16 | H50 | 23.0° | 66.0° |
| C15 | N23 | C24 | H54 | 76.0° | 54.7° |
| C15 | N23 | C24 | H53 | 43.7° | 65.3° |
| C15 | N23 | H39 | H40 | 116.3° | 120.0° |
| C14 | C15 | N23 | C24 | 48.0° | 174.3° |
| C15 | C14 | C13 | H47 | 120.9° | 120.0° |
| C15 | C14 | C13 | H48 | 120.9° | 120.0° |
| C15 | C14 | C13 | O12 | 77.0° | 66.4° |
| C15 | C14 | C13 | C28 | 164.4° | 178.1° |
| C15 | C14 | C13 | H33 | 43.7° | 55.7° |
| C15 | C14 | H47 | H48 | 117.1° | 120.1° |
| C14 | C15 | C16 | H49 | 27.0° | 174.0° |
| C14 | C15 | C16 | H50 | 145.5° | 54.0° |
| C14 | C15 | N23 | H39 | 73.1° | 54.3° |
| C14 | C15 | N23 | H40 | 169.2° | 65.7° |
| C26 | C25 | C24 | H55 | 120.5° | 120.0° |
| C26 | C25 | C24 | H56 | 120.5° | 120.0° |
| C26 | C25 | C24 | N23 | 178.6° | 180.0° |
| C26 | C25 | C24 | H54 | 61.3° | 60.0° |
| C26 | C25 | C24 | H53 | 58.5° | 60.0° |
| C26 | C25 | H55 | H56 | 118.5° | 120.0° |
| C25 | C26 | H57 | H58 | 119.7° | 120.1° |
| C25 | C26 | O27 | H59 | 180.0° | 180.0° |
| C25 | C24 | N23 | H54 | 120.1° | 120.0° |
| C25 | C24 | N23 | H53 | 120.1° | 120.1° |
| C25 | C24 | H54 | H53 | 119.6° | 120.1° |
| C24 | C25 | H55 | H56 | 118.4° | 120.0° |
| C24 | C25 | C26 | H57 | 176.5° | 60.1° |
| C24 | C25 | C26 | H58 | 56.7° | 60.0° |
| C25 | C24 | N23 | H39 | 75.1° | 54.7° |
| C25 | C24 | N23 | H40 | 42.7° | 65.3° |
| C24 | N23 | C15 | H34 | 71.4° | 54.3° |
| N23 | C24 | H54 | H53 | 119.6° | 119.9° |
| N23 | C24 | C25 | H55 | 58.1° | 60.0° |
| N23 | C24 | C25 | H56 | 60.9° | 60.0° |
| C24 | N23 | H39 | H40 | 116.4° | 120.0° |
| O29 | C28 | C30 | O31 | 37.2° | 0.0° |
| O29 | C28 | C13 | C14 | 85.6° | 98.6° |
| O29 | C28 | C13 | O12 | 152.6° | 142.6° |
| O29 | C28 | C13 | C30 | 120.8° | 118.6° |
| O29 | C28 | C13 | H41 | 123.2° | 122.7° |
| O29 | C28 | C30 | H41 | 125.1° | 122.7° |
| O29 | C28 | C30 | C11 | 155.9° | 118.7° |
| O29 | C28 | C13 | H33 | 35.3° | 23.8° |
| O29 | C28 | C30 | H42 | 87.6° | 122.7° |
| O31 | C30 | C28 | C13 | 81.6° | 118.6° |
| O31 | C30 | C11 | O12 | 89.2° | 142.6° |
| O31 | C30 | C28 | C11 | 118.8° | 118.7° |
| O31 | C30 | C28 | H42 | 124.8° | 122.7° |
| O31 | C30 | C11 | H42 | 124.2° | 122.7° |
| O31 | C30 | C11 | N7 | 153.0° | 98.5° |
| O31 | C30 | C11 | H32 | 30.3° | 23.8° |
| O31 | C30 | C28 | H41 | 162.2° | 122.7° |
| C14 | C13 | O12 | C28 | 123.2° | 119.0° |
| C14 | C13 | O12 | H33 | 120.1° | 122.2° |
| C14 | C13 | C28 | H33 | 120.9° | 122.3° |
| C14 | C13 | O12 | C11 | 136.8° | 159.3° |
| C14 | C13 | C28 | C30 | 153.6° | 142.8° |
| C13 | C14 | H47 | H48 | 117.1° | 119.9° |
| C13 | C14 | C15 | H34 | 60.9° | 55.0° |
| C14 | C13 | C28 | H41 | 37.5° | 24.2° |
| O12 | C13 | C28 | H33 | 117.4° | 118.8° |
| O12 | C13 | C28 | C30 | 31.8° | 23.9° |
| C13 | O12 | C11 | C30 | 10.7° | 40.4° |
| C13 | O12 | C11 | N7 | 108.8° | 159.3° |
| C13 | O12 | C11 | H32 | 129.2° | 78.5° |
| O12 | C13 | C14 | H47 | 43.9° | 173.6° |
| O12 | C13 | C14 | H48 | 162.1° | 53.6° |
| O12 | C13 | C28 | H41 | 84.2° | 94.7° |
| C28 | C13 | O12 | C11 | 13.6° | 40.4° |
| C13 | C28 | C30 | H41 | 116.2° | 118.6° |
| C13 | C28 | C30 | C11 | 37.2° | 0.0° |
| C28 | C13 | C14 | H47 | 74.6° | 58.1° |
| C28 | C13 | C14 | H48 | 43.5° | 61.8° |
| C13 | C28 | O29 | H60 | 180.0° | 180.0° |
| C13 | C28 | C30 | H42 | 153.6° | 118.6° |
| O12 | C11 | C30 | C28 | 30.1° | 23.9° |
| O12 | C11 | C30 | N7 | 117.8° | 118.9° |
| O12 | C11 | C30 | H32 | 119.5° | 118.8° |
| O12 | C11 | N7 | H32 | 122.2° | 122.1° |
| O12 | C11 | N7 | C8 | 3.3° | 22.1° |
| O12 | C11 | N7 | C6 | 176.9° | 158.0° |
| C11 | O12 | C13 | H33 | 103.1° | 78.5° |
| O12 | C11 | C30 | H42 | 146.6° | 94.7° |
| C28 | C30 | C11 | H42 | 116.5° | 118.6° |
| C28 | C30 | C11 | N7 | 87.6° | 142.8° |
| C28 | C30 | C11 | H32 | 149.6° | 94.9° |
| C30 | C28 | C13 | H33 | 85.5° | 94.9° |
| C30 | C28 | O29 | H60 | 66.4° | 65.4° |
| C28 | C30 | O31 | H61 | 180.0° | 61.4° |
| C30 | C11 | N7 | H32 | 122.0° | 122.3° |
| C30 | C11 | N7 | C8 | 112.5° | 93.4° |
| C30 | C11 | N7 | C6 | 67.3° | 86.5° |
| C11 | C30 | C28 | H41 | 79.0° | 118.6° |
| C11 | C30 | O31 | H61 | 66.9° | 176.1° |
| C11 | N7 | C8 | C6 | 179.8° | 179.9° |
| C11 | N7 | C8 | N9 | 179.9° | 180.0° |
| C11 | N7 | C6 | N5 | 0.2° | 0.1° |
| C11 | N7 | C6 | C10 | 179.8° | 180.0° |
| C11 | N7 | C8 | H46 | 0.1° | 0.1° |
| N7 | C11 | C30 | H42 | 28.8° | 24.1° |
| N7 | C8 | N9 | H46 | 180.0° | 179.9° |
| C8 | N7 | C6 | N5 | 180.0° | 180.0° |
| C8 | N7 | C6 | C10 | 0.0° | 0.1° |
| N7 | C8 | N9 | C10 | 0.0° | 0.0° |
| C8 | N7 | C11 | H32 | 125.5° | 144.2° |
| C6 | N7 | C8 | N9 | 0.0° | 0.1° |
| N7 | C6 | N5 | C10 | 180.0° | 179.9° |
| N7 | C6 | N5 | C4 | 180.0° | 179.8° |
| N7 | C6 | C10 | N9 | 0.0° | 0.0° |
| N7 | C6 | C10 | C2 | 180.0° | 180.0° |
| C6 | N7 | C8 | H46 | 180.0° | 180.0° |
| C6 | N7 | C11 | H32 | 54.7° | 35.9° |
| C8 | N9 | C10 | C6 | 0.0° | 0.0° |
| C8 | N9 | C10 | C2 | 180.0° | 180.0° |
| N5 | C6 | C10 | N9 | 180.0° | 180.0° |
| N5 | C6 | C10 | C2 | 0.0° | 0.0° |
| C6 | N5 | C4 | N3 | 0.1° | 0.2° |
| C6 | N5 | C4 | H45 | 180.0° | 179.7° |
| C4 | N5 | C6 | C10 | 0.0° | 0.3° |
| N5 | C4 | N3 | H45 | 180.0° | 179.9° |
| N5 | C4 | N3 | C2 | 0.0° | 0.1° |
| C6 | C10 | N9 | C2 | 179.9° | 180.0° |
| C6 | C10 | C2 | N3 | 0.1° | 0.3° |
| C6 | C10 | C2 | N1 | 180.0° | 180.0° |
| N9 | C10 | C2 | N3 | 180.0° | 179.7° |
| N9 | C10 | C2 | N1 | 0.1° | 0.0° |
| C10 | N9 | C8 | H46 | 180.0° | 180.0° |
| C10 | C2 | N3 | C4 | 0.1° | 0.3° |
| C10 | C2 | N3 | N1 | 179.9° | 179.7° |
| C10 | C2 | N1 | H43 | 179.9° | 0.0° |
| C10 | C2 | N1 | H44 | 60.1° | 180.0° |
| C4 | N3 | C2 | N1 | 180.0° | 180.0° |
| N3 | C2 | N1 | H43 | 0.0° | 179.7° |
| N3 | C2 | N1 | H44 | 120.0° | 0.3° |
| C2 | N3 | C4 | H45 | 180.0° | 180.0° |
| C2 | N1 | H43 | H44 | 120.0° | 180.0° |
| H32 | C11 | C30 | H42 | 93.9° | 146.4° |
| H33 | C13 | C14 | H47 | 164.6° | 64.2° |
| H33 | C13 | C14 | H48 | 77.2° | 175.8° |
| H33 | C13 | C28 | H41 | 158.4° | 146.5° |
| H47 | C14 | C15 | H34 | 178.2° | 175.0° |
| H48 | C14 | C15 | H34 | 60.1° | 65.0° |
| H34 | C15 | C16 | H49 | 147.5° | 66.0° |
| H34 | C15 | C16 | H50 | 94.0° | 174.0° |
| H34 | C15 | N23 | H39 | 167.5° | 65.7° |
| H34 | C15 | N23 | H40 | 49.8° | 174.3° |
| H49 | C16 | C17 | H52 | 176.5° | 177.1° |
| H49 | C16 | C17 | H51 | 57.5° | 57.1° |
| H50 | C16 | C17 | H52 | 65.0° | 62.9° |
| H50 | C16 | C17 | H51 | 176.0° | 177.1° |
| H54 | C24 | C25 | H55 | 178.2° | 59.9° |
| H54 | C24 | C25 | H56 | 59.2° | 180.0° |
| H54 | C24 | N23 | H39 | 45.1° | 65.3° |
| H54 | C24 | N23 | H40 | 162.8° | 174.7° |
| H53 | C24 | C25 | H55 | 62.0° | 180.0° |
| H53 | C24 | C25 | H56 | 179.0° | 60.0° |
| H53 | C24 | N23 | H39 | 164.8° | 174.8° |
| H53 | C24 | N23 | H40 | 77.5° | 54.8° |
| H55 | C25 | C26 | H57 | 63.0° | 180.0° |
| H55 | C25 | C26 | H58 | 177.2° | 59.9° |
| H56 | C25 | C26 | H57 | 56.1° | 59.9° |
| H56 | C25 | C26 | H58 | 63.7° | 180.0° |
| H57 | C26 | O27 | H59 | 59.9° | 60.0° |
| H58 | C26 | O27 | H59 | 59.9° | 60.0° |
| H41 | C28 | O29 | H60 | 57.7° | 57.3° |
| H41 | C28 | C30 | H42 | 37.5° | 0.0° |
| H52 | C17 | C18 | H35 | 77.0° | 175.0° |
| H51 | C17 | C18 | H35 | 164.0° | 65.0° |
| H35 | C18 | N19 | H36 | 62.4° | 60.1° |
| H35 | C18 | N19 | H37 | 177.6° | 180.0° |
| H35 | C18 | N19 | H38 | 57.6° | 60.0° |
| H36 | N19 | H37 | H38 | 120.0° | 120.1° |
| H42 | C30 | O31 | H61 | 56.2° | 61.3° |
