G9B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.41Å | 1.36Å | Aromatic |
| C1 | C3 | sing | 1.39Å | 1.38Å | Aromatic |
| C1 | N7 | sing | 1.38Å | 1.33Å | Aromatic |
| C2 | C4 | sing | 1.40Å | 1.38Å | Aromatic |
| C2 | N9 | sing | 1.35Å | 1.34Å | Aromatic |
| C3 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C6 | doub | 1.37Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| N7 | C8 | sing | 1.37Å | 1.36Å | Aromatic |
| N7 | C10 | sing | 1.40Å | 1.47Å | |
| C8 | N9 | doub | 1.31Å | 1.35Å | Aromatic |
| C8 | C21 | sing | 1.48Å | 1.50Å | |
| C10 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C12 | sing | 1.39Å | 1.38Å | Aromatic |
| C11 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | N16 | sing | 1.40Å | 1.41Å | |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| N16 | C17 | sing | 1.35Å | 1.38Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| C17 | O19 | doub | 1.21Å | 1.21Å | |
| C18 | C20 | sing | 1.53Å | 1.52Å | |
| C21 | N22 | doub | 1.33Å | 1.40Å | Aromatic |
| C21 | C23 | sing | 1.41Å | 1.39Å | Aromatic |
| N22 | C24 | sing | 1.33Å | 1.39Å | Aromatic |
| C23 | N25 | doub | 1.33Å | 1.38Å | Aromatic |
| C23 | N27 | sing | 1.39Å | 1.40Å | |
| C24 | C26 | doub | 1.40Å | 1.39Å | Aromatic |
| C24 | C28 | sing | 1.48Å | 1.50Å | |
| N25 | C26 | sing | 1.32Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.36Å | 1.38Å | Aromatic |
| C28 | C30 | sing | 1.41Å | 1.37Å | Aromatic |
| C29 | N31 | sing | 1.35Å | 1.35Å | Aromatic |
| C30 | N32 | doub | 1.31Å | 1.35Å | Aromatic |
| N31 | N32 | sing | 1.40Å | 1.26Å | Aromatic |
| N31 | C33 | sing | 1.46Å | 1.48Å | |
| C33 | C34 | sing | 1.53Å | 1.50Å | |
| C33 | C35 | sing | 1.53Å | 1.58Å | |
| C34 | C36 | sing | 1.53Å | 1.53Å | |
| C35 | C37 | sing | 1.53Å | 1.54Å | |
| C36 | N38 | sing | 1.47Å | 1.47Å | |
| C37 | N38 | sing | 1.47Å | 1.48Å | |
| N38 | C39 | sing | 1.47Å | 1.48Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| N16 | HN16 | sing | 0.97Å | 1.00Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| N27 | HN27 | sing | 0.97Å | 1.00Å | |
| N27 | HN2A | sing | 0.97Å | 1.00Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H39A | sing | 1.09Å | 1.10Å | |
| C39 | H39B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C3 | 121.8° | 119.8° |
| C2 | C1 | N7 | 107.5° | 106.2° |
| C1 | C2 | C4 | 120.8° | 119.4° |
| C1 | C2 | N9 | 109.5° | 107.2° |
| C3 | C1 | N7 | 130.6° | 133.9° |
| C1 | C3 | C5 | 118.0° | 119.7° |
| C1 | C3 | H3 | 121.0° | 120.1° |
| C1 | N7 | C8 | 107.6° | 107.1° |
| C1 | N7 | C10 | 122.4° | 126.4° |
| C4 | C2 | N9 | 129.7° | 133.3° |
| C2 | C4 | C6 | 118.5° | 119.9° |
| C2 | C4 | H4 | 120.8° | 120.1° |
| C2 | N9 | C8 | 106.1° | 109.7° |
| C3 | C5 | C6 | 120.3° | 120.5° |
| C5 | C3 | H3 | 121.0° | 120.2° |
| C3 | C5 | H5 | 119.8° | 119.8° |
| C4 | C6 | C5 | 120.6° | 120.7° |
| C6 | C4 | H4 | 120.8° | 120.1° |
| C4 | C6 | H6 | 119.7° | 119.7° |
| C6 | C5 | H5 | 119.8° | 119.7° |
| C5 | C6 | H6 | 119.7° | 119.7° |
| C8 | N7 | C10 | 129.9° | 126.5° |
| N7 | C8 | N9 | 109.2° | 109.7° |
| N7 | C8 | C21 | 128.5° | 125.1° |
| N7 | C10 | C11 | 118.8° | 120.0° |
| N7 | C10 | C12 | 121.1° | 120.1° |
| N9 | C8 | C21 | 122.3° | 125.1° |
| C8 | C21 | N22 | 118.2° | 120.1° |
| C8 | C21 | C23 | 122.7° | 120.1° |
| C11 | C10 | C12 | 120.1° | 119.9° |
| C10 | C11 | C13 | 120.6° | 119.9° |
| C10 | C11 | H11 | 119.7° | 120.0° |
| C10 | C12 | C14 | 119.5° | 120.1° |
| C10 | C12 | H12 | 120.3° | 119.9° |
| C11 | C13 | C15 | 119.1° | 119.9° |
| C11 | C13 | N16 | 118.3° | 120.0° |
| C13 | C11 | H11 | 119.7° | 120.1° |
| C12 | C14 | C15 | 120.4° | 120.1° |
| C14 | C12 | H12 | 120.2° | 120.0° |
| C12 | C14 | H14 | 119.8° | 119.9° |
| C15 | C13 | N16 | 122.6° | 120.0° |
| C13 | C15 | C14 | 120.2° | 120.1° |
| C13 | C15 | H15 | 119.9° | 120.0° |
| C13 | N16 | C17 | 130.1° | 120.0° |
| C13 | N16 | HN16 | 115.0° | 120.0° |
| C15 | C14 | H14 | 119.8° | 120.0° |
| C14 | C15 | H15 | 119.9° | 120.0° |
| N16 | C17 | C18 | 118.0° | 120.0° |
| N16 | C17 | O19 | 122.6° | 120.0° |
| C17 | N16 | HN16 | 114.9° | 120.0° |
| C18 | C17 | O19 | 119.4° | 120.0° |
| C17 | C18 | C20 | 108.9° | 109.4° |
| C17 | C18 | H18 | 109.6° | 109.5° |
| C17 | C18 | H18A | 109.6° | 109.5° |
| C20 | C18 | H18 | 109.6° | 109.5° |
| C20 | C18 | H18A | 109.6° | 109.5° |
| C18 | C20 | H20 | 109.5° | 109.4° |
| C18 | C20 | H20A | 109.5° | 109.5° |
| C18 | C20 | H20B | 109.5° | 109.5° |
| N22 | C21 | C23 | 119.1° | 119.8° |
| C21 | N22 | C24 | 121.6° | 119.9° |
| C21 | C23 | N25 | 119.8° | 119.9° |
| C21 | C23 | N27 | 121.2° | 120.1° |
| N22 | C24 | C26 | 118.2° | 120.1° |
| N22 | C24 | C28 | 120.9° | 120.0° |
| N25 | C23 | N27 | 119.0° | 120.1° |
| C23 | N25 | C26 | 120.5° | 120.1° |
| C23 | N27 | HN27 | 109.5° | 120.0° |
| C23 | N27 | HN2A | 109.5° | 120.0° |
| C26 | C24 | C28 | 120.9° | 119.9° |
| C24 | C26 | N25 | 120.7° | 120.2° |
| C24 | C26 | H26 | 119.6° | 119.9° |
| C24 | C28 | C29 | 129.6° | 126.3° |
| C24 | C28 | C30 | 126.5° | 126.2° |
| N25 | C26 | H26 | 119.7° | 119.9° |
| C29 | C28 | C30 | 103.9° | 107.5° |
| C28 | C29 | N31 | 107.9° | 107.7° |
| C28 | C29 | H29 | 126.1° | 126.2° |
| C28 | C30 | N32 | 108.9° | 108.1° |
| C28 | C30 | H30 | 125.5° | 126.0° |
| C29 | N31 | N32 | 110.4° | 108.2° |
| C29 | N31 | C33 | 125.5° | 125.9° |
| N31 | C29 | H29 | 126.0° | 126.2° |
| C30 | N32 | N31 | 108.8° | 108.5° |
| N32 | C30 | H30 | 125.6° | 125.9° |
| N32 | N31 | C33 | 124.1° | 125.8° |
| N31 | C33 | C34 | 112.4° | 109.5° |
| N31 | C33 | C35 | 111.2° | 109.5° |
| N31 | C33 | H33 | 109.3° | 109.6° |
| C34 | C33 | C35 | 106.8° | 109.1° |
| C33 | C34 | C36 | 111.7° | 109.3° |
| C34 | C33 | H33 | 109.0° | 109.5° |
| C33 | C34 | H34 | 108.9° | 109.5° |
| C33 | C34 | H34A | 108.9° | 109.5° |
| C33 | C35 | C37 | 109.7° | 109.3° |
| C35 | C33 | H33 | 108.0° | 109.6° |
| C33 | C35 | H35 | 109.4° | 109.5° |
| C33 | C35 | H35A | 109.4° | 109.5° |
| C34 | C36 | N38 | 111.5° | 109.5° |
| C36 | C34 | H34 | 108.9° | 109.5° |
| C36 | C34 | H34A | 108.9° | 109.5° |
| C34 | C36 | H36 | 109.0° | 109.5° |
| C34 | C36 | H36A | 109.0° | 109.5° |
| C35 | C37 | N38 | 111.2° | 109.5° |
| C37 | C35 | H35 | 109.4° | 109.5° |
| C37 | C35 | H35A | 109.4° | 109.5° |
| C35 | C37 | H37 | 109.0° | 109.4° |
| C35 | C37 | H37A | 109.0° | 109.5° |
| C36 | N38 | C37 | 111.1° | 111.2° |
| C36 | N38 | C39 | 110.9° | 111.0° |
| N38 | C36 | H36 | 109.0° | 109.4° |
| N38 | C36 | H36A | 109.0° | 109.5° |
| C37 | N38 | C39 | 110.9° | 111.0° |
| N38 | C37 | H37 | 109.1° | 109.4° |
| N38 | C37 | H37A | 109.0° | 109.5° |
| N38 | C39 | H39 | 109.5° | 109.5° |
| N38 | C39 | H39A | 109.5° | 109.5° |
| N38 | C39 | H39B | 109.5° | 109.5° |
| H18 | C18 | H18A | 109.4° | 109.5° |
| H20 | C20 | H20A | 109.4° | 109.5° |
| H20 | C20 | H20B | 109.5° | 109.4° |
| H20A | C20 | H20B | 109.5° | 109.5° |
| HN27 | N27 | HN2A | 109.5° | 120.0° |
| H34 | C34 | H34A | 109.5° | 109.5° |
| H35 | C35 | H35A | 109.5° | 109.5° |
| H36 | C36 | H36A | 109.5° | 109.4° |
| H37 | C37 | H37A | 109.5° | 109.5° |
| H39 | C39 | H39A | 109.5° | 109.5° |
| H39 | C39 | H39B | 109.5° | 109.4° |
| H39A | C39 | H39B | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C3 | N7 | 179.6° | 179.7° |
| C1 | C2 | C4 | N9 | 179.7° | 180.0° |
| C2 | C1 | C3 | C5 | 0.1° | 0.1° |
| C1 | C2 | C4 | C6 | 0.2° | 0.0° |
| C2 | C1 | N7 | C8 | 0.9° | 0.0° |
| C2 | C1 | N7 | C10 | 179.7° | 180.0° |
| C1 | C2 | N9 | C8 | 0.1° | 0.4° |
| C2 | C1 | C3 | H3 | 179.9° | 180.0° |
| C1 | C2 | C4 | H4 | 179.9° | 180.0° |
| C3 | C1 | C2 | C4 | 0.1° | 0.0° |
| C3 | C1 | C2 | N9 | 179.8° | 180.0° |
| C1 | C3 | C5 | H3 | 180.0° | 179.9° |
| C1 | C3 | C5 | C6 | 0.3° | 0.0° |
| C3 | C1 | N7 | C8 | 179.4° | 179.7° |
| C3 | C1 | N7 | C10 | 0.6° | 0.3° |
| C1 | C3 | C5 | H5 | 179.7° | 180.0° |
| N7 | C1 | C2 | C4 | 179.8° | 179.8° |
| N7 | C1 | C2 | N9 | 0.5° | 0.2° |
| N7 | C1 | C3 | C5 | 179.5° | 179.7° |
| C1 | N7 | C8 | C10 | 178.7° | 180.0° |
| C1 | N7 | C8 | N9 | 1.0° | 0.2° |
| C1 | N7 | C8 | C21 | 179.8° | 180.0° |
| C1 | N7 | C10 | C11 | 80.0° | 115.0° |
| C1 | N7 | C10 | C12 | 99.1° | 65.3° |
| N7 | C1 | C3 | H3 | 0.5° | 0.4° |
| C2 | C4 | C6 | H4 | 180.0° | 180.0° |
| C2 | C4 | C6 | C5 | 0.0° | 0.1° |
| C4 | C2 | N9 | C8 | 179.6° | 179.6° |
| C2 | C4 | C6 | H6 | 180.0° | 180.0° |
| N9 | C2 | C4 | C6 | 179.8° | 180.0° |
| C2 | N9 | C8 | N7 | 0.7° | 0.4° |
| C2 | N9 | C8 | C21 | 179.6° | 179.9° |
| N9 | C2 | C4 | H4 | 0.2° | 0.0° |
| C3 | C5 | C6 | C4 | 0.2° | 0.0° |
| C3 | C5 | C6 | H5 | 180.0° | 179.9° |
| C3 | C5 | C6 | H6 | 179.8° | 180.0° |
| C4 | C6 | C5 | H6 | 180.0° | 179.9° |
| C4 | C6 | C5 | H5 | 179.8° | 179.9° |
| C6 | C5 | C3 | H3 | 179.7° | 179.9° |
| C5 | C6 | C4 | H4 | 180.0° | 180.0° |
| N7 | C8 | N9 | C21 | 178.9° | 179.8° |
| C8 | N7 | C10 | C11 | 98.5° | 65.0° |
| C8 | N7 | C10 | C12 | 82.4° | 114.7° |
| N7 | C8 | C21 | N22 | 4.0° | 7.5° |
| N7 | C8 | C21 | C23 | 175.6° | 172.2° |
| C10 | N7 | C8 | N9 | 179.6° | 179.8° |
| C10 | N7 | C8 | C21 | 1.5° | 0.0° |
| N7 | C10 | C11 | C12 | 179.1° | 179.7° |
| N7 | C10 | C11 | C13 | 179.9° | 180.0° |
| N7 | C10 | C12 | C14 | 179.7° | 180.0° |
| N7 | C10 | C11 | H11 | 0.1° | 0.1° |
| N7 | C10 | C12 | H12 | 0.3° | 0.1° |
| N9 | C8 | C21 | N22 | 177.3° | 172.8° |
| N9 | C8 | C21 | C23 | 3.1° | 7.5° |
| C8 | C21 | N22 | C23 | 179.6° | 179.7° |
| C8 | C21 | N22 | C24 | 179.7° | 180.0° |
| C8 | C21 | C23 | N25 | 179.5° | 180.0° |
| C8 | C21 | C23 | N27 | 0.6° | 0.0° |
| C10 | C11 | C13 | H11 | 180.0° | 180.0° |
| C11 | C10 | C12 | C14 | 0.6° | 0.3° |
| C10 | C11 | C13 | C15 | 0.5° | 0.0° |
| C10 | C11 | C13 | N16 | 179.9° | 180.0° |
| C11 | C10 | C12 | H12 | 179.4° | 179.8° |
| C12 | C10 | C11 | C13 | 0.8° | 0.3° |
| C10 | C12 | C14 | H12 | 180.0° | 180.0° |
| C10 | C12 | C14 | C15 | 0.2° | 0.0° |
| C12 | C10 | C11 | H11 | 179.2° | 179.8° |
| C10 | C12 | C14 | H14 | 179.8° | 179.9° |
| C11 | C13 | C15 | N16 | 179.5° | 180.0° |
| C11 | C13 | C15 | C14 | 0.1° | 0.3° |
| C11 | C13 | N16 | C17 | 178.5° | 145.5° |
| C11 | C13 | C15 | H15 | 179.9° | 180.0° |
| C11 | C13 | N16 | HN16 | 1.5° | 34.5° |
| C12 | C14 | C15 | C13 | 0.0° | 0.3° |
| C12 | C14 | C15 | H14 | 180.0° | 179.9° |
| C12 | C14 | C15 | H15 | 180.0° | 180.0° |
| C13 | C15 | C14 | H15 | 180.0° | 179.7° |
| C15 | C13 | N16 | C17 | 1.1° | 34.4° |
| C15 | C13 | C11 | H11 | 179.5° | 180.0° |
| C13 | C15 | C14 | H14 | 180.0° | 179.7° |
| C15 | C13 | N16 | HN16 | 179.0° | 145.5° |
| N16 | C13 | C15 | C14 | 179.7° | 179.8° |
| C13 | N16 | C17 | HN16 | 180.0° | 179.9° |
| C13 | N16 | C17 | C18 | 179.9° | 174.8° |
| C13 | N16 | C17 | O19 | 1.3° | 5.2° |
| N16 | C13 | C11 | H11 | 0.1° | 0.0° |
| N16 | C13 | C15 | H15 | 0.4° | 0.0° |
| C15 | C14 | C12 | H12 | 179.7° | 180.0° |
| N16 | C17 | C18 | O19 | 178.9° | 180.0° |
| N16 | C17 | C18 | C20 | 105.0° | 180.0° |
| N16 | C17 | C18 | H18 | 14.9° | 60.0° |
| N16 | C17 | C18 | H18A | 135.1° | 60.0° |
| C17 | C18 | C20 | H18 | 120.0° | 120.0° |
| C17 | C18 | C20 | H18A | 119.9° | 120.0° |
| C18 | C17 | N16 | HN16 | 0.1° | 5.1° |
| C17 | C18 | H18 | H18A | 120.2° | 120.0° |
| C17 | C18 | C20 | H20 | 180.0° | 180.0° |
| C17 | C18 | C20 | H20A | 60.0° | 60.0° |
| C17 | C18 | C20 | H20B | 60.0° | 60.1° |
| O19 | C17 | C18 | C20 | 73.9° | 0.0° |
| O19 | C17 | N16 | HN16 | 178.8° | 174.8° |
| O19 | C17 | C18 | H18 | 166.2° | 120.0° |
| O19 | C17 | C18 | H18A | 46.1° | 120.0° |
| C20 | C18 | H18 | H18A | 120.2° | 120.0° |
| C18 | C20 | H20 | H20A | 120.0° | 120.0° |
| C18 | C20 | H20 | H20B | 120.0° | 120.0° |
| C18 | C20 | H20A | H20B | 120.0° | 120.1° |
| N22 | C21 | C23 | N25 | 0.1° | 0.4° |
| N22 | C21 | C23 | N27 | 179.8° | 179.7° |
| C21 | N22 | C24 | C26 | 0.3° | 0.0° |
| C21 | N22 | C24 | C28 | 179.6° | 180.0° |
| C23 | C21 | N22 | C24 | 0.0° | 0.3° |
| C21 | C23 | N25 | N27 | 179.9° | 179.9° |
| C21 | C23 | N25 | C26 | 0.1° | 0.1° |
| C21 | C23 | N27 | HN27 | 179.9° | 5.5° |
| C21 | C23 | N27 | HN2A | 60.0° | 174.4° |
| N22 | C24 | C26 | C28 | 179.4° | 180.0° |
| N22 | C24 | C26 | N25 | 0.3° | 0.3° |
| N22 | C24 | C28 | C29 | 174.2° | 175.0° |
| N22 | C24 | C28 | C30 | 6.1° | 4.7° |
| N22 | C24 | C26 | H26 | 179.7° | 180.0° |
| C23 | N25 | C26 | C24 | 0.1° | 0.2° |
| C23 | N25 | C26 | H26 | 179.9° | 180.0° |
| N25 | C23 | N27 | HN27 | 0.0° | 174.5° |
| N25 | C23 | N27 | HN2A | 120.0° | 5.5° |
| N27 | C23 | N25 | C26 | 179.8° | 180.0° |
| C23 | N27 | HN27 | HN2A | 120.0° | 179.9° |
| C24 | C26 | N25 | H26 | 180.0° | 179.7° |
| C26 | C24 | C28 | C29 | 6.5° | 5.0° |
| C26 | C24 | C28 | C30 | 173.3° | 175.4° |
| C28 | C24 | C26 | N25 | 179.7° | 179.7° |
| C24 | C28 | C29 | C30 | 179.8° | 179.7° |
| C24 | C28 | C29 | N31 | 180.0° | 180.0° |
| C24 | C28 | C30 | N32 | 179.8° | 180.0° |
| C28 | C24 | C26 | H26 | 0.4° | 0.0° |
| C24 | C28 | C29 | H29 | 0.1° | 0.0° |
| C24 | C28 | C30 | H30 | 0.2° | 0.0° |
| C28 | C29 | N31 | H29 | 180.0° | 180.0° |
| C29 | C28 | C30 | N32 | 0.3° | 0.3° |
| C28 | C29 | N31 | N32 | 0.0° | 0.1° |
| C28 | C29 | N31 | C33 | 179.7° | 179.9° |
| C29 | C28 | C30 | H30 | 179.7° | 179.7° |
| C30 | C28 | C29 | N31 | 0.2° | 0.2° |
| C28 | C30 | N32 | H30 | 180.0° | 180.0° |
| C28 | C30 | N32 | N31 | 0.3° | 0.2° |
| C30 | C28 | C29 | H29 | 179.7° | 179.7° |
| C29 | N31 | N32 | C30 | 0.2° | 0.1° |
| C29 | N31 | N32 | C33 | 179.6° | 180.0° |
| C29 | N31 | C33 | C34 | 80.3° | 85.1° |
| C29 | N31 | C33 | C35 | 160.0° | 34.6° |
| C29 | N31 | C33 | H33 | 40.9° | 154.8° |
| C30 | N32 | N31 | C33 | 179.5° | 179.9° |
| N32 | N31 | C33 | C34 | 99.3° | 94.9° |
| N32 | N31 | C33 | C35 | 20.4° | 145.5° |
| N32 | N31 | C29 | H29 | 179.9° | 179.8° |
| N31 | N32 | C30 | H30 | 179.7° | 179.8° |
| N32 | N31 | C33 | H33 | 139.5° | 25.2° |
| N31 | C33 | C34 | C35 | 122.3° | 119.9° |
| N31 | C33 | C34 | H33 | 121.3° | 120.2° |
| N31 | C33 | C35 | H33 | 119.9° | 120.3° |
| N31 | C33 | C34 | C36 | 179.8° | 177.6° |
| N31 | C33 | C35 | C37 | 179.2° | 177.5° |
| C33 | N31 | C29 | H29 | 0.3° | 0.1° |
| N31 | C33 | C34 | H34 | 59.9° | 57.5° |
| N31 | C33 | C34 | H34A | 59.4° | 62.5° |
| N31 | C33 | C35 | H35 | 59.2° | 62.5° |
| N31 | C33 | C35 | H35A | 60.7° | 57.5° |
| C34 | C33 | C35 | H33 | 117.1° | 119.9° |
| C33 | C34 | C36 | H34 | 120.3° | 120.0° |
| C33 | C34 | C36 | H34A | 120.3° | 119.9° |
| C34 | C33 | C35 | C37 | 57.8° | 57.7° |
| C33 | C34 | C36 | N38 | 58.9° | 59.2° |
| C33 | C34 | H34 | H34A | 119.0° | 120.1° |
| C34 | C33 | C35 | H35 | 177.8° | 177.6° |
| C34 | C33 | C35 | H35A | 62.3° | 62.3° |
| C33 | C34 | C36 | H36 | 179.2° | 179.2° |
| C33 | C34 | C36 | H36A | 61.4° | 60.8° |
| C35 | C33 | C34 | C36 | 57.9° | 57.7° |
| C33 | C35 | C37 | H35 | 120.0° | 119.9° |
| C33 | C35 | C37 | H35A | 120.0° | 120.0° |
| C33 | C35 | C37 | N38 | 58.4° | 59.2° |
| C35 | C33 | C34 | H34 | 62.4° | 62.3° |
| C35 | C33 | C34 | H34A | 178.3° | 177.6° |
| C33 | C35 | H35 | H35A | 119.9° | 120.1° |
| C33 | C35 | C37 | H37 | 61.9° | 60.7° |
| C33 | C35 | C37 | H37A | 178.6° | 179.2° |
| C34 | C36 | N38 | H36 | 120.3° | 120.0° |
| C34 | C36 | N38 | H36A | 120.3° | 120.0° |
| C34 | C36 | N38 | C37 | 56.6° | 61.8° |
| C34 | C36 | N38 | C39 | 179.6° | 174.2° |
| C36 | C34 | C33 | H33 | 58.5° | 62.3° |
| C36 | C34 | H34 | H34A | 119.0° | 120.1° |
| C34 | C36 | H36 | H36A | 119.1° | 120.0° |
| C35 | C37 | N38 | C36 | 57.5° | 61.7° |
| C35 | C37 | N38 | H37 | 120.3° | 119.9° |
| C35 | C37 | N38 | H37A | 120.2° | 120.0° |
| C35 | C37 | N38 | C39 | 178.8° | 174.2° |
| C37 | C35 | C33 | H33 | 59.3° | 62.2° |
| C37 | C35 | H35 | H35A | 119.9° | 120.1° |
| C35 | C37 | H37 | H37A | 119.2° | 120.0° |
| C36 | N38 | C37 | C39 | 123.8° | 124.1° |
| N38 | C36 | C34 | H34 | 61.4° | 60.8° |
| N38 | C36 | C34 | H34A | 179.3° | 179.2° |
| N38 | C36 | H36 | H36A | 119.1° | 120.0° |
| C36 | N38 | C37 | H37 | 62.8° | 58.2° |
| C36 | N38 | C37 | H37A | 177.7° | 178.2° |
| C36 | N38 | C39 | H39 | 180.0° | 60.0° |
| C36 | N38 | C39 | H39A | 60.0° | 180.0° |
| C36 | N38 | C39 | H39B | 60.0° | 60.0° |
| N38 | C37 | C35 | H35 | 178.4° | 179.1° |
| N38 | C37 | C35 | H35A | 61.7° | 60.8° |
| C37 | N38 | C36 | H36 | 176.9° | 178.2° |
| C37 | N38 | C36 | H36A | 63.7° | 58.3° |
| N38 | C37 | H37 | H37A | 119.2° | 120.0° |
| C37 | N38 | C39 | H39 | 56.1° | 64.2° |
| C37 | N38 | C39 | H39A | 176.1° | 55.8° |
| C37 | N38 | C39 | H39B | 63.9° | 175.8° |
| C39 | N38 | C36 | H36 | 59.4° | 54.2° |
| C39 | N38 | C36 | H36A | 60.1° | 65.8° |
| C39 | N38 | C37 | H37 | 61.0° | 65.9° |
| C39 | N38 | C37 | H37A | 58.5° | 54.1° |
| N38 | C39 | H39 | H39A | 120.0° | 120.0° |
| N38 | C39 | H39 | H39B | 120.0° | 120.0° |
| N38 | C39 | H39A | H39B | 120.0° | 120.0° |
| H3 | C3 | C5 | H5 | 0.3° | 0.1° |
| H4 | C4 | C6 | H6 | 0.0° | 0.1° |
| H5 | C5 | C6 | H6 | 0.2° | 0.0° |
| H12 | C12 | C14 | H14 | 0.3° | 0.1° |
| H14 | C14 | C15 | H15 | 0.0° | 0.1° |
| H18 | C18 | C20 | H20 | 60.1° | 60.0° |
| H18 | C18 | C20 | H20A | 179.9° | 180.0° |
| H18 | C18 | C20 | H20B | 60.0° | 59.9° |
| H18A | C18 | C20 | H20 | 60.1° | 60.0° |
| H18A | C18 | C20 | H20A | 59.9° | 60.0° |
| H18A | C18 | C20 | H20B | 179.9° | 179.9° |
| H20 | C20 | H20A | H20B | 120.0° | 120.0° |
| H33 | C33 | C34 | H34 | 178.8° | 177.7° |
| H33 | C33 | C34 | H34A | 61.9° | 57.7° |
| H33 | C33 | C35 | H35 | 60.7° | 57.7° |
| H33 | C33 | C35 | H35A | 179.4° | 177.7° |
| H34 | C34 | C36 | H36 | 58.9° | 59.2° |
| H34 | C34 | C36 | H36A | 178.3° | 179.2° |
| H34A | C34 | C36 | H36 | 60.5° | 60.9° |
| H34A | C34 | C36 | H36A | 58.9° | 59.1° |
| H35 | C35 | C37 | H37 | 58.1° | 59.2° |
| H35 | C35 | C37 | H37A | 61.3° | 60.8° |
| H35A | C35 | C37 | H37 | 178.1° | 179.2° |
| H35A | C35 | C37 | H37A | 58.6° | 59.2° |
| H39 | C39 | H39A | H39B | 120.0° | 120.0° |
