76O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O22 | C20 | doub | 1.21Å | 1.25Å | |
| N19 | C18 | sing | 1.47Å | 1.49Å | |
| C20 | C18 | sing | 1.51Å | 1.54Å | |
| C20 | O21 | sing | 1.34Å | 1.25Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| N3 | C4 | doub | 1.32Å | 1.35Å | Aromatic |
| N3 | C2 | sing | 1.33Å | 1.36Å | Aromatic |
| N1 | C2 | sing | 1.38Å | 1.33Å | |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| C4 | N5 | sing | 1.32Å | 1.33Å | Aromatic |
| C2 | C10 | doub | 1.41Å | 1.40Å | Aromatic |
| N5 | C6 | doub | 1.33Å | 1.34Å | Aromatic |
| C10 | C6 | sing | 1.41Å | 1.37Å | Aromatic |
| C10 | N9 | sing | 1.35Å | 1.38Å | Aromatic |
| C6 | N7 | sing | 1.37Å | 1.37Å | Aromatic |
| N9 | C8 | doub | 1.30Å | 1.32Å | Aromatic |
| N7 | C8 | sing | 1.36Å | 1.37Å | Aromatic |
| N7 | C11 | sing | 1.46Å | 1.46Å | |
| C11 | O12 | sing | 1.44Å | 1.43Å | |
| C11 | C33 | sing | 1.54Å | 1.54Å | |
| O12 | C13 | sing | 1.44Å | 1.43Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| O34 | C33 | sing | 1.43Å | 1.42Å | |
| C33 | C31 | sing | 1.55Å | 1.54Å | |
| C15 | N23 | sing | 1.47Å | 1.50Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C31 | sing | 1.55Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C31 | O32 | sing | 1.43Å | 1.42Å | |
| N23 | C24 | sing | 1.47Å | 1.49Å | |
| C24 | C25 | sing | 1.51Å | 1.51Å | |
| C30 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.37Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.37Å | Aromatic |
| C8 | H49 | sing | 1.08Å | 1.08Å | |
| C11 | H35 | sing | 1.09Å | 1.10Å | |
| C13 | H36 | sing | 1.09Å | 1.10Å | |
| C14 | H51 | sing | 1.09Å | 1.10Å | |
| C14 | H50 | sing | 1.09Å | 1.10Å | |
| C15 | H37 | sing | 1.09Å | 1.10Å | |
| C16 | H52 | sing | 1.09Å | 1.10Å | |
| C16 | H53 | sing | 1.09Å | 1.10Å | |
| C24 | H56 | sing | 1.09Å | 1.10Å | |
| C24 | H57 | sing | 1.09Å | 1.10Å | |
| C26 | H58 | sing | 1.08Å | 1.08Å | |
| C27 | H59 | sing | 1.08Å | 1.08Å | |
| C28 | H60 | sing | 1.08Å | 1.08Å | |
| C31 | H44 | sing | 1.09Å | 1.10Å | |
| N1 | H47 | sing | 0.97Å | 1.00Å | |
| N1 | H46 | sing | 0.97Å | 1.00Å | |
| C4 | H48 | sing | 1.08Å | 1.08Å | |
| C17 | H54 | sing | 1.09Å | 1.10Å | |
| C17 | H55 | sing | 1.09Å | 1.10Å | |
| C18 | H38 | sing | 1.09Å | 1.10Å | |
| N19 | H39 | sing | 1.01Å | 1.00Å | |
| N19 | H41 | sing | 1.01Å | 1.00Å | |
| N19 | H40 | sing | 1.01Å | 1.00Å | |
| O21 | H1 | sing | 0.97Å | 0.95Å | |
| N23 | H43 | sing | 1.01Å | 1.00Å | |
| N23 | H42 | sing | 1.01Å | 1.00Å | |
| C29 | H61 | sing | 1.08Å | 1.08Å | |
| C30 | H62 | sing | 1.08Å | 1.08Å | |
| O32 | H63 | sing | 0.97Å | 0.95Å | |
| C33 | H45 | sing | 1.09Å | 1.10Å | |
| O34 | H64 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O22 | C20 | C18 | 117.6° | 120.0° |
| O22 | C20 | O21 | 125.4° | 120.0° |
| N19 | C18 | C20 | 109.5° | 109.5° |
| N19 | C18 | C17 | 110.1° | 109.5° |
| N19 | C18 | H38 | 108.7° | 109.5° |
| C18 | N19 | H39 | 109.5° | 109.5° |
| C18 | N19 | H41 | 109.5° | 109.5° |
| C18 | N19 | H40 | 109.5° | 109.5° |
| C18 | C20 | O21 | 117.0° | 120.0° |
| C20 | C18 | C17 | 112.1° | 109.5° |
| C20 | C18 | H38 | 108.1° | 109.5° |
| C20 | O21 | H1 | 109.5° | 117.0° |
| C18 | C17 | C16 | 114.2° | 109.4° |
| C18 | C17 | H54 | 108.3° | 109.4° |
| C18 | C17 | H55 | 108.3° | 109.5° |
| C17 | C18 | H38 | 108.2° | 109.4° |
| C4 | N3 | C2 | 118.1° | 121.1° |
| N3 | C4 | N5 | 128.1° | 122.5° |
| N3 | C4 | H48 | 116.0° | 118.7° |
| N3 | C2 | N1 | 118.4° | 120.7° |
| N3 | C2 | C10 | 118.5° | 118.5° |
| N1 | C2 | C10 | 123.1° | 120.7° |
| C2 | N1 | H47 | 109.5° | 120.0° |
| C2 | N1 | H46 | 109.4° | 120.0° |
| C17 | C16 | C15 | 114.6° | 109.4° |
| C17 | C16 | H52 | 108.2° | 109.5° |
| C17 | C16 | H53 | 108.1° | 109.4° |
| C16 | C17 | H54 | 108.3° | 109.5° |
| C16 | C17 | H55 | 108.3° | 109.5° |
| C4 | N5 | C6 | 111.9° | 120.6° |
| N5 | C4 | H48 | 116.0° | 118.8° |
| C2 | C10 | C6 | 116.7° | 118.1° |
| C2 | C10 | N9 | 132.9° | 134.7° |
| N5 | C6 | C10 | 126.7° | 119.1° |
| N5 | C6 | N7 | 127.2° | 134.9° |
| C6 | C10 | N9 | 110.4° | 107.1° |
| C10 | C6 | N7 | 106.1° | 106.0° |
| C10 | N9 | C8 | 104.7° | 109.4° |
| C6 | N7 | C8 | 106.6° | 107.4° |
| C6 | N7 | C11 | 126.4° | 126.3° |
| N9 | C8 | N7 | 112.1° | 110.0° |
| N9 | C8 | H49 | 123.9° | 125.0° |
| C8 | N7 | C11 | 127.0° | 126.3° |
| N7 | C8 | H49 | 123.9° | 125.0° |
| N7 | C11 | O12 | 108.0° | 110.4° |
| N7 | C11 | C33 | 114.1° | 110.4° |
| N7 | C11 | H35 | 109.6° | 110.4° |
| O12 | C11 | C33 | 106.7° | 104.8° |
| C11 | O12 | C13 | 110.5° | 105.3° |
| O12 | C11 | H35 | 110.0° | 110.4° |
| C11 | C33 | O34 | 111.4° | 110.5° |
| C11 | C33 | C31 | 102.1° | 104.1° |
| C33 | C11 | H35 | 108.5° | 110.4° |
| C11 | C33 | H45 | 109.8° | 110.5° |
| O12 | C13 | C31 | 104.7° | 104.8° |
| O12 | C13 | C14 | 109.4° | 110.4° |
| O12 | C13 | H36 | 109.9° | 110.4° |
| C16 | C15 | N23 | 108.2° | 109.5° |
| C16 | C15 | C14 | 114.8° | 109.5° |
| C16 | C15 | H37 | 108.1° | 109.5° |
| C15 | C16 | H52 | 108.2° | 109.5° |
| C15 | C16 | H53 | 108.2° | 109.5° |
| O34 | C33 | C31 | 111.4° | 110.5° |
| O34 | C33 | H45 | 111.7° | 110.6° |
| C33 | O34 | H64 | 109.5° | 114.0° |
| C33 | C31 | C13 | 101.3° | 104.1° |
| C33 | C31 | O32 | 112.6° | 110.5° |
| C33 | C31 | H44 | 110.0° | 110.6° |
| C31 | C33 | H45 | 110.0° | 110.4° |
| N23 | C15 | C14 | 109.0° | 109.5° |
| C15 | N23 | C24 | 115.0° | 109.5° |
| N23 | C15 | H37 | 108.4° | 109.5° |
| C15 | N23 | H43 | 108.1° | 109.5° |
| C15 | N23 | H42 | 108.1° | 109.5° |
| C15 | C14 | C13 | 115.4° | 109.5° |
| C15 | C14 | H51 | 108.0° | 109.5° |
| C15 | C14 | H50 | 108.0° | 109.4° |
| C14 | C15 | H37 | 108.1° | 109.4° |
| C31 | C13 | C14 | 115.6° | 110.4° |
| C13 | C31 | O32 | 110.6° | 110.5° |
| C31 | C13 | H36 | 108.5° | 110.3° |
| C13 | C31 | H44 | 110.1° | 110.5° |
| C14 | C13 | H36 | 108.7° | 110.4° |
| C13 | C14 | H51 | 108.0° | 109.5° |
| C13 | C14 | H50 | 108.0° | 109.5° |
| O32 | C31 | H44 | 111.7° | 110.5° |
| C31 | O32 | H63 | 109.5° | 114.0° |
| N23 | C24 | C25 | 111.9° | 109.4° |
| N23 | C24 | H56 | 108.9° | 109.5° |
| N23 | C24 | H57 | 108.9° | 109.5° |
| C24 | N23 | H43 | 108.1° | 109.5° |
| C24 | N23 | H42 | 108.1° | 109.5° |
| C24 | C25 | C30 | 120.6° | 120.0° |
| C24 | C25 | C26 | 120.6° | 120.0° |
| C25 | C24 | H56 | 108.9° | 109.4° |
| C25 | C24 | H57 | 108.9° | 109.5° |
| C25 | C30 | C29 | 120.4° | 120.0° |
| C30 | C25 | C26 | 118.8° | 120.0° |
| C25 | C30 | H62 | 119.8° | 120.0° |
| C30 | C29 | C28 | 120.1° | 120.0° |
| C30 | C29 | H61 | 119.9° | 120.0° |
| C29 | C30 | H62 | 119.8° | 120.0° |
| C25 | C26 | C27 | 120.5° | 120.0° |
| C25 | C26 | H58 | 119.8° | 120.0° |
| C29 | C28 | C27 | 120.1° | 120.0° |
| C29 | C28 | H60 | 119.9° | 120.0° |
| C28 | C29 | H61 | 120.0° | 120.0° |
| C26 | C27 | C28 | 120.1° | 120.1° |
| C27 | C26 | H58 | 119.8° | 120.0° |
| C26 | C27 | H59 | 120.0° | 120.0° |
| C28 | C27 | H59 | 120.0° | 120.0° |
| C27 | C28 | H60 | 119.9° | 120.1° |
| H51 | C14 | H50 | 109.5° | 109.5° |
| H52 | C16 | H53 | 109.5° | 109.5° |
| H56 | C24 | H57 | 109.5° | 109.5° |
| H47 | N1 | H46 | 109.4° | 120.0° |
| H54 | C17 | H55 | 109.5° | 109.5° |
| H39 | N19 | H41 | 109.5° | 109.5° |
| H39 | N19 | H40 | 109.4° | 109.5° |
| H41 | N19 | H40 | 109.5° | 109.4° |
| H43 | N23 | H42 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O22 | C20 | C18 | N19 | 22.3° | 20.0° |
| O22 | C20 | C18 | O21 | 179.9° | 180.0° |
| O22 | C20 | C18 | C17 | 144.8° | 100.0° |
| O22 | C20 | C18 | H38 | 96.0° | 140.0° |
| O22 | C20 | O21 | H1 | 0.0° | 0.0° |
| N19 | C18 | C20 | C17 | 122.5° | 120.0° |
| N19 | C18 | C20 | H38 | 118.3° | 120.0° |
| N19 | C18 | C20 | O21 | 157.8° | 160.0° |
| N19 | C18 | C17 | H38 | 118.6° | 120.0° |
| N19 | C18 | C17 | C16 | 152.8° | 65.0° |
| N19 | C18 | C17 | H54 | 32.1° | 175.0° |
| N19 | C18 | C17 | H55 | 86.5° | 55.0° |
| C18 | N19 | H39 | H41 | 120.0° | 120.0° |
| C18 | N19 | H39 | H40 | 120.0° | 120.1° |
| C18 | N19 | H41 | H40 | 120.0° | 120.0° |
| C20 | C18 | C17 | H38 | 119.2° | 120.0° |
| C20 | C18 | C17 | C16 | 85.0° | 175.0° |
| C20 | C18 | C17 | H54 | 154.3° | 55.0° |
| C20 | C18 | C17 | H55 | 35.7° | 65.0° |
| C20 | C18 | N19 | H39 | 180.0° | 60.0° |
| C20 | C18 | N19 | H41 | 60.0° | 180.0° |
| C20 | C18 | N19 | H40 | 60.0° | 60.0° |
| C18 | C20 | O21 | H1 | 179.9° | 180.0° |
| O21 | C20 | C18 | C17 | 35.3° | 80.0° |
| O21 | C20 | C18 | H38 | 84.0° | 40.0° |
| C18 | C17 | C16 | H54 | 120.7° | 120.0° |
| C18 | C17 | C16 | H55 | 120.7° | 120.0° |
| C18 | C17 | C16 | C15 | 122.0° | 174.6° |
| C18 | C17 | C16 | H52 | 117.3° | 65.4° |
| C18 | C17 | C16 | H53 | 1.2° | 54.7° |
| C18 | C17 | H54 | H55 | 117.8° | 120.0° |
| C17 | C18 | N19 | H39 | 56.3° | 60.0° |
| C17 | C18 | N19 | H41 | 176.3° | 60.0° |
| C17 | C18 | N19 | H40 | 63.7° | 180.0° |
| C4 | N3 | C2 | N1 | 180.0° | 179.8° |
| N3 | C4 | N5 | H48 | 180.0° | 179.9° |
| C4 | N3 | C2 | C10 | 0.0° | 0.0° |
| N3 | C4 | N5 | C6 | 0.0° | 0.2° |
| N3 | C2 | N1 | C10 | 180.0° | 179.8° |
| C2 | N3 | C4 | N5 | 0.0° | 0.0° |
| N3 | C2 | C10 | C6 | 0.0° | 0.2° |
| N3 | C2 | C10 | N9 | 180.0° | 179.7° |
| N3 | C2 | N1 | H47 | 0.0° | 179.7° |
| N3 | C2 | N1 | H46 | 120.0° | 0.2° |
| C2 | N3 | C4 | H48 | 180.0° | 179.9° |
| N1 | C2 | C10 | C6 | 180.0° | 180.0° |
| N1 | C2 | C10 | N9 | 0.0° | 0.1° |
| C2 | N1 | H47 | H46 | 120.0° | 179.9° |
| C17 | C16 | C15 | H52 | 120.8° | 120.0° |
| C17 | C16 | C15 | H53 | 120.8° | 119.9° |
| C17 | C16 | C15 | N23 | 112.0° | 174.1° |
| C17 | C16 | C15 | C14 | 126.1° | 65.9° |
| C17 | C16 | C15 | H37 | 5.3° | 54.1° |
| C17 | C16 | H52 | H53 | 117.6° | 120.0° |
| C16 | C17 | H54 | H55 | 117.9° | 120.1° |
| C16 | C17 | C18 | H38 | 34.2° | 55.0° |
| C4 | N5 | C6 | C10 | 0.0° | 0.5° |
| C4 | N5 | C6 | N7 | 180.0° | 179.9° |
| C2 | C10 | C6 | N5 | 0.0° | 0.4° |
| C2 | C10 | C6 | N9 | 180.0° | 180.0° |
| C2 | C10 | C6 | N7 | 180.0° | 180.0° |
| C2 | C10 | N9 | C8 | 180.0° | 180.0° |
| C10 | C2 | N1 | H47 | 179.9° | 0.1° |
| C10 | C2 | N1 | H46 | 60.0° | 180.0° |
| N5 | C6 | C10 | N7 | 180.0° | 179.5° |
| N5 | C6 | C10 | N9 | 180.0° | 179.5° |
| N5 | C6 | N7 | C8 | 180.0° | 179.4° |
| N5 | C6 | N7 | C11 | 0.0° | 0.5° |
| C6 | N5 | C4 | H48 | 180.0° | 179.7° |
| C6 | C10 | N9 | C8 | 0.0° | 0.0° |
| C10 | C6 | N7 | C8 | 0.0° | 0.0° |
| C10 | C6 | N7 | C11 | 180.0° | 180.0° |
| N9 | C10 | C6 | N7 | 0.0° | 0.0° |
| C10 | N9 | C8 | N7 | 0.0° | 0.0° |
| C10 | N9 | C8 | H49 | 180.0° | 180.0° |
| C6 | N7 | C8 | N9 | 0.0° | 0.0° |
| C6 | N7 | C8 | C11 | 180.0° | 179.9° |
| C6 | N7 | C11 | O12 | 177.8° | 156.5° |
| C6 | N7 | C11 | C33 | 59.5° | 88.1° |
| C6 | N7 | C8 | H49 | 180.0° | 180.0° |
| C6 | N7 | C11 | H35 | 62.4° | 34.2° |
| N9 | C8 | N7 | H49 | 180.0° | 180.0° |
| N9 | C8 | N7 | C11 | 180.0° | 180.0° |
| C8 | N7 | C11 | O12 | 2.2° | 23.6° |
| C8 | N7 | C11 | C33 | 120.5° | 91.8° |
| C8 | N7 | C11 | H35 | 117.7° | 145.8° |
| N7 | C11 | O12 | C33 | 123.0° | 118.9° |
| N7 | C11 | O12 | H35 | 119.6° | 122.3° |
| N7 | C11 | C33 | H35 | 122.4° | 122.3° |
| N7 | C11 | O12 | C13 | 124.6° | 159.4° |
| N7 | C11 | C33 | O34 | 143.8° | 98.6° |
| N7 | C11 | C33 | C31 | 97.2° | 142.8° |
| C11 | N7 | C8 | H49 | 0.0° | 0.0° |
| N7 | C11 | C33 | H45 | 19.4° | 24.2° |
| O12 | C11 | C33 | H35 | 118.5° | 118.8° |
| O12 | C11 | C33 | O34 | 97.2° | 142.6° |
| O12 | C11 | C33 | C31 | 21.9° | 24.0° |
| C11 | O12 | C13 | C31 | 24.7° | 40.5° |
| C11 | O12 | C13 | C14 | 149.2° | 159.3° |
| C11 | O12 | C13 | H36 | 91.6° | 78.3° |
| O12 | C11 | C33 | H45 | 138.5° | 94.6° |
| C33 | C11 | O12 | C13 | 1.6° | 40.5° |
| C11 | C33 | O34 | C31 | 113.3° | 114.6° |
| C11 | C33 | O34 | H45 | 123.3° | 122.7° |
| C11 | C33 | C31 | H45 | 116.6° | 118.6° |
| C11 | C33 | C31 | C13 | 35.1° | 0.0° |
| C11 | C33 | C31 | O32 | 153.4° | 118.6° |
| C11 | C33 | C31 | H44 | 81.3° | 118.7° |
| C11 | C33 | O34 | H64 | 180.0° | 180.0° |
| O12 | C13 | C31 | C33 | 37.3° | 24.0° |
| O12 | C13 | C14 | C15 | 36.7° | 69.6° |
| O12 | C13 | C31 | C14 | 120.5° | 118.9° |
| O12 | C13 | C31 | H36 | 117.3° | 118.9° |
| O12 | C13 | C14 | H36 | 120.0° | 122.4° |
| O12 | C13 | C31 | O32 | 156.9° | 142.6° |
| C13 | O12 | C11 | H35 | 115.9° | 78.3° |
| O12 | C13 | C14 | H51 | 84.2° | 170.4° |
| O12 | C13 | C14 | H50 | 157.5° | 50.3° |
| O12 | C13 | C31 | H44 | 79.2° | 94.8° |
| C16 | C15 | N23 | C14 | 125.5° | 120.0° |
| C16 | C15 | N23 | H37 | 117.0° | 120.0° |
| C16 | C15 | C14 | H37 | 120.8° | 120.0° |
| C16 | C15 | C14 | C13 | 50.5° | 175.0° |
| C16 | C15 | N23 | C24 | 169.3° | 64.4° |
| C16 | C15 | C14 | H51 | 171.4° | 55.0° |
| C16 | C15 | C14 | H50 | 70.4° | 65.0° |
| C15 | C16 | H52 | H53 | 117.7° | 120.0° |
| C15 | C16 | C17 | H54 | 1.2° | 54.7° |
| C15 | C16 | C17 | H55 | 117.4° | 65.4° |
| C16 | C15 | N23 | H43 | 48.5° | 55.6° |
| C16 | C15 | N23 | H42 | 69.9° | 175.6° |
| O34 | C33 | C31 | H45 | 124.4° | 122.7° |
| O34 | C33 | C31 | C13 | 83.9° | 118.7° |
| O34 | C33 | C31 | O32 | 34.3° | 0.0° |
| O34 | C33 | C11 | H35 | 21.3° | 23.8° |
| O34 | C33 | C31 | H44 | 159.6° | 122.6° |
| C33 | C31 | C13 | O32 | 119.7° | 118.6° |
| C33 | C31 | C13 | H44 | 116.4° | 118.8° |
| C33 | C31 | C13 | C14 | 157.7° | 142.8° |
| C33 | C31 | O32 | H44 | 124.4° | 122.8° |
| C31 | C33 | C11 | H35 | 140.4° | 94.9° |
| C33 | C31 | C13 | H36 | 80.0° | 94.9° |
| C33 | C31 | O32 | H63 | 180.0° | 65.4° |
| C31 | C33 | O34 | H64 | 66.7° | 65.4° |
| N23 | C15 | C14 | H37 | 117.7° | 119.9° |
| N23 | C15 | C14 | C13 | 172.0° | 65.0° |
| C15 | N23 | C24 | H43 | 120.8° | 120.0° |
| C15 | N23 | C24 | H42 | 120.8° | 120.0° |
| C15 | N23 | C24 | C25 | 174.1° | 177.3° |
| N23 | C15 | C14 | H51 | 67.1° | 175.0° |
| N23 | C15 | C14 | H50 | 51.1° | 55.0° |
| N23 | C15 | C16 | H52 | 8.8° | 65.9° |
| N23 | C15 | C16 | H53 | 127.3° | 54.2° |
| C15 | N23 | C24 | H56 | 65.5° | 57.3° |
| C15 | N23 | C24 | H57 | 53.8° | 62.8° |
| C15 | N23 | H43 | H42 | 117.5° | 120.0° |
| C15 | C14 | C13 | C31 | 154.5° | 175.0° |
| C15 | C14 | C13 | H51 | 120.9° | 120.0° |
| C15 | C14 | C13 | H50 | 120.9° | 119.9° |
| C14 | C15 | N23 | C24 | 65.2° | 175.6° |
| C15 | C14 | C13 | H36 | 83.3° | 52.8° |
| C15 | C14 | H51 | H50 | 117.3° | 119.9° |
| C14 | C15 | C16 | H52 | 113.2° | 54.1° |
| C14 | C15 | C16 | H53 | 5.3° | 174.2° |
| C14 | C15 | N23 | H43 | 173.9° | 64.4° |
| C14 | C15 | N23 | H42 | 55.6° | 55.6° |
| C31 | C13 | C14 | H36 | 122.2° | 122.3° |
| C13 | C31 | O32 | H44 | 123.0° | 122.6° |
| C31 | C13 | C14 | H51 | 33.6° | 55.0° |
| C31 | C13 | C14 | H50 | 84.6° | 65.0° |
| C13 | C31 | O32 | H63 | 67.4° | 180.0° |
| C13 | C31 | C33 | H45 | 151.7° | 118.6° |
| C14 | C13 | C31 | O32 | 82.6° | 98.5° |
| C13 | C14 | H51 | H50 | 117.3° | 120.1° |
| C13 | C14 | C15 | H37 | 70.3° | 55.0° |
| C14 | C13 | C31 | H44 | 41.3° | 24.0° |
| O32 | C31 | C13 | H36 | 39.6° | 23.7° |
| O32 | C31 | C33 | H45 | 90.1° | 122.8° |
| N23 | C24 | C25 | H56 | 120.3° | 120.0° |
| N23 | C24 | C25 | H57 | 120.3° | 120.0° |
| N23 | C24 | C25 | C30 | 82.9° | 90.3° |
| N23 | C24 | C25 | C26 | 97.1° | 90.0° |
| C24 | N23 | C15 | H37 | 52.3° | 55.6° |
| N23 | C24 | H56 | H57 | 118.9° | 120.0° |
| C24 | N23 | H43 | H42 | 117.5° | 120.0° |
| C24 | C25 | C30 | C26 | 180.0° | 179.7° |
| C24 | C25 | C30 | C29 | 180.0° | 179.7° |
| C24 | C25 | C26 | C27 | 180.0° | 180.0° |
| C25 | C24 | H56 | H57 | 118.9° | 120.0° |
| C24 | C25 | C26 | H58 | 0.0° | 0.1° |
| C25 | C24 | N23 | H43 | 53.3° | 57.3° |
| C25 | C24 | N23 | H42 | 65.0° | 62.7° |
| C24 | C25 | C30 | H62 | 0.0° | 0.1° |
| C25 | C30 | C29 | H62 | 180.0° | 179.6° |
| C25 | C30 | C29 | C28 | 0.0° | 0.6° |
| C30 | C25 | C26 | C27 | 0.0° | 0.3° |
| C30 | C25 | C24 | H56 | 156.8° | 29.7° |
| C30 | C25 | C24 | H57 | 37.5° | 149.7° |
| C30 | C25 | C26 | H58 | 180.0° | 179.7° |
| C25 | C30 | C29 | H61 | 179.9° | 179.7° |
| C29 | C30 | C25 | C26 | 0.1° | 0.6° |
| C30 | C29 | C28 | H61 | 180.0° | 179.7° |
| C30 | C29 | C28 | C27 | 0.0° | 0.3° |
| C30 | C29 | C28 | H60 | 180.0° | 179.7° |
| C25 | C26 | C27 | H58 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.0° | 0.0° |
| C26 | C25 | C24 | H56 | 23.3° | 150.0° |
| C26 | C25 | C24 | H57 | 142.6° | 29.9° |
| C25 | C26 | C27 | H59 | 180.0° | 180.0° |
| C26 | C25 | C30 | H62 | 179.9° | 179.7° |
| C29 | C28 | C27 | C26 | 0.0° | 0.0° |
| C29 | C28 | C27 | H60 | 180.0° | 180.0° |
| C29 | C28 | C27 | H59 | 180.0° | 180.0° |
| C28 | C29 | C30 | H62 | 180.0° | 179.7° |
| C26 | C27 | C28 | H59 | 180.0° | 180.0° |
| C26 | C27 | C28 | H60 | 180.0° | 180.0° |
| C28 | C27 | C26 | H58 | 180.0° | 179.9° |
| C27 | C28 | C29 | H61 | 180.0° | 180.0° |
| H35 | C11 | C33 | H45 | 103.0° | 146.6° |
| H36 | C13 | C14 | H51 | 155.8° | 67.2° |
| H36 | C13 | C14 | H50 | 37.5° | 172.7° |
| H36 | C13 | C31 | H44 | 163.6° | 146.3° |
| H51 | C14 | C15 | H37 | 50.6° | 65.1° |
| H50 | C14 | C15 | H37 | 168.9° | 175.0° |
| H37 | C15 | C16 | H52 | 126.0° | 174.1° |
| H37 | C15 | C16 | H53 | 115.5° | 65.8° |
| H37 | C15 | N23 | H43 | 68.5° | 175.7° |
| H37 | C15 | N23 | H42 | 173.1° | 64.4° |
| H52 | C16 | C17 | H54 | 122.0° | 174.7° |
| H52 | C16 | C17 | H55 | 3.4° | 54.6° |
| H53 | C16 | C17 | H54 | 119.5° | 65.3° |
| H53 | C16 | C17 | H55 | 121.8° | 174.7° |
| H56 | C24 | N23 | H43 | 173.7° | 62.7° |
| H56 | C24 | N23 | H42 | 55.3° | 177.3° |
| H57 | C24 | N23 | H43 | 67.0° | 177.2° |
| H57 | C24 | N23 | H42 | 174.6° | 57.3° |
| H58 | C26 | C27 | H59 | 0.0° | 0.1° |
| H59 | C27 | C28 | H60 | 0.0° | 0.1° |
| H60 | C28 | C29 | H61 | 0.0° | 0.1° |
| H44 | C31 | O32 | H63 | 55.6° | 57.3° |
| H44 | C31 | C33 | H45 | 35.2° | 0.1° |
| H54 | C17 | C18 | H38 | 86.5° | 65.0° |
| H55 | C17 | C18 | H38 | 154.9° | 175.0° |
| H38 | C18 | N19 | H39 | 62.1° | 180.0° |
| H38 | C18 | N19 | H41 | 57.9° | 60.0° |
| H38 | C18 | N19 | H40 | 178.0° | 60.0° |
| H39 | N19 | H41 | H40 | 120.0° | 120.0° |
| H61 | C29 | C30 | H62 | 0.1° | 0.1° |
| H45 | C33 | O34 | H64 | 56.7° | 57.3° |
