A1CB1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | O4 | sing | 1.43Å | 1.44Å | |
| C2 | C5 | sing | 1.51Å | 1.53Å | |
| C5 | N10 | doub | 1.32Å | 1.34Å | Aromatic |
| C5 | N6 | sing | 1.32Å | 1.34Å | Aromatic |
| N6 | C7 | doub | 1.32Å | 1.33Å | Aromatic |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C8 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C8 | C11 | sing | 1.48Å | 1.47Å | |
| C9 | N10 | sing | 1.32Å | 1.34Å | Aromatic |
| C11 | C29 | sing | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.36Å | 1.38Å | Aromatic |
| C13 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C28 | sing | 1.41Å | 1.39Å | Aromatic |
| C14 | N15 | sing | 1.36Å | 1.40Å | Aromatic |
| N15 | C16 | doub | 1.30Å | 1.31Å | Aromatic |
| C16 | N27 | sing | 1.37Å | 1.37Å | Aromatic |
| C16 | C17 | sing | 1.51Å | 1.50Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C20 | N27 | sing | 1.46Å | 1.48Å | |
| C21 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| N27 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.39Å | 1.38Å | Aromatic |
| C7 | H38 | sing | 1.08Å | 1.08Å | |
| C13 | H41 | sing | 1.08Å | 1.08Å | |
| C17 | H43 | sing | 1.09Å | 1.10Å | |
| C17 | H42 | sing | 1.09Å | 1.10Å | |
| C20 | H30 | sing | 1.09Å | 1.10Å | |
| C22 | H48 | sing | 1.08Å | 1.08Å | |
| C24 | H50 | sing | 1.08Å | 1.08Å | |
| C26 | H52 | sing | 1.08Å | 1.08Å | |
| C1 | H33 | sing | 1.09Å | 1.10Å | |
| C1 | H31 | sing | 1.09Å | 1.10Å | |
| C1 | H32 | sing | 1.09Å | 1.10Å | |
| C3 | H36 | sing | 1.09Å | 1.10Å | |
| C3 | H35 | sing | 1.09Å | 1.10Å | |
| C3 | H34 | sing | 1.09Å | 1.10Å | |
| O4 | H37 | sing | 0.97Å | 0.95Å | |
| C9 | H39 | sing | 1.08Å | 1.08Å | |
| C12 | H40 | sing | 1.08Å | 1.08Å | |
| C18 | H44 | sing | 1.09Å | 1.10Å | |
| C18 | H45 | sing | 1.09Å | 1.10Å | |
| C19 | H47 | sing | 1.09Å | 1.10Å | |
| C19 | H46 | sing | 1.09Å | 1.10Å | |
| C23 | H49 | sing | 1.08Å | 1.08Å | |
| C25 | H51 | sing | 1.08Å | 1.08Å | |
| C29 | H53 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 110.3° | 109.5° |
| C1 | C2 | O4 | 106.5° | 109.5° |
| C1 | C2 | C5 | 112.9° | 109.5° |
| C2 | C1 | H33 | 109.5° | 109.5° |
| C2 | C1 | H31 | 109.5° | 109.4° |
| C2 | C1 | H32 | 109.4° | 109.5° |
| C3 | C2 | O4 | 109.0° | 109.5° |
| C3 | C2 | C5 | 109.0° | 109.5° |
| C2 | C3 | H36 | 109.5° | 109.5° |
| C2 | C3 | H35 | 109.5° | 109.4° |
| C2 | C3 | H34 | 109.4° | 109.5° |
| O4 | C2 | C5 | 109.2° | 109.4° |
| C2 | O4 | H37 | 109.5° | 114.0° |
| C2 | C5 | N10 | 116.9° | 119.0° |
| C2 | C5 | N6 | 116.7° | 118.9° |
| N10 | C5 | N6 | 126.4° | 122.1° |
| C5 | N10 | C9 | 115.8° | 120.9° |
| C5 | N6 | C7 | 115.9° | 120.9° |
| N6 | C7 | C8 | 123.5° | 118.9° |
| N6 | C7 | H38 | 118.3° | 120.5° |
| C7 | C8 | C9 | 115.2° | 118.2° |
| C7 | C8 | C11 | 121.8° | 120.9° |
| C8 | C7 | H38 | 118.2° | 120.6° |
| C9 | C8 | C11 | 123.0° | 120.9° |
| C8 | C9 | N10 | 123.1° | 119.0° |
| C8 | C9 | H39 | 118.4° | 120.5° |
| C8 | C11 | C29 | 120.2° | 119.9° |
| C8 | C11 | C12 | 120.2° | 119.9° |
| N10 | C9 | H39 | 118.4° | 120.5° |
| C29 | C11 | C12 | 119.5° | 120.1° |
| C11 | C29 | C28 | 118.3° | 119.7° |
| C11 | C29 | H53 | 120.9° | 120.1° |
| C11 | C12 | C13 | 121.7° | 120.6° |
| C11 | C12 | H40 | 119.2° | 119.7° |
| C12 | C13 | C14 | 118.8° | 120.1° |
| C12 | C13 | H41 | 120.6° | 120.0° |
| C13 | C12 | H40 | 119.2° | 119.8° |
| C13 | C14 | C28 | 119.4° | 119.7° |
| C13 | C14 | N15 | 130.4° | 133.4° |
| C14 | C13 | H41 | 120.6° | 120.0° |
| C28 | C14 | N15 | 110.2° | 106.9° |
| C14 | C28 | N27 | 105.1° | 105.9° |
| C14 | C28 | C29 | 122.3° | 119.8° |
| C14 | N15 | C16 | 104.6° | 109.8° |
| N15 | C16 | N27 | 113.3° | 109.8° |
| N15 | C16 | C17 | 125.5° | 126.6° |
| N27 | C16 | C17 | 121.1° | 123.6° |
| C16 | N27 | C20 | 125.5° | 124.8° |
| C16 | N27 | C28 | 106.7° | 107.6° |
| C16 | C17 | C18 | 112.2° | 108.2° |
| C16 | C17 | H43 | 108.8° | 109.7° |
| C16 | C17 | H42 | 108.8° | 109.7° |
| C17 | C18 | C19 | 110.2° | 109.3° |
| C18 | C17 | H43 | 108.8° | 109.7° |
| C18 | C17 | H42 | 108.8° | 109.7° |
| C17 | C18 | H44 | 109.3° | 109.5° |
| C17 | C18 | H45 | 109.3° | 109.5° |
| C18 | C19 | C20 | 112.0° | 109.4° |
| C19 | C18 | H44 | 109.3° | 109.5° |
| C19 | C18 | H45 | 109.3° | 109.6° |
| C18 | C19 | H47 | 108.8° | 109.5° |
| C18 | C19 | H46 | 108.9° | 109.4° |
| C19 | C20 | C21 | 114.2° | 109.6° |
| C19 | C20 | N27 | 110.9° | 108.8° |
| C19 | C20 | H30 | 106.1° | 109.7° |
| C20 | C19 | H47 | 108.8° | 109.5° |
| C20 | C19 | H46 | 108.9° | 109.5° |
| C21 | C20 | N27 | 112.3° | 109.6° |
| C20 | C21 | C26 | 120.9° | 120.0° |
| C20 | C21 | C22 | 120.4° | 120.0° |
| C21 | C20 | H30 | 106.2° | 109.6° |
| C20 | N27 | C28 | 127.7° | 127.7° |
| N27 | C20 | H30 | 106.6° | 109.6° |
| C26 | C21 | C22 | 118.7° | 120.0° |
| C21 | C26 | C25 | 120.5° | 120.0° |
| C21 | C26 | H52 | 119.7° | 120.0° |
| C21 | C22 | C23 | 120.6° | 120.0° |
| C21 | C22 | H48 | 119.7° | 120.0° |
| C22 | C23 | C24 | 120.2° | 120.0° |
| C23 | C22 | H48 | 119.7° | 120.0° |
| C22 | C23 | H49 | 119.9° | 120.0° |
| C23 | C24 | C25 | 119.8° | 120.0° |
| C23 | C24 | H50 | 120.1° | 120.1° |
| C24 | C23 | H49 | 119.9° | 120.0° |
| C24 | C25 | C26 | 120.2° | 120.0° |
| C25 | C24 | H50 | 120.1° | 120.0° |
| C24 | C25 | H51 | 119.9° | 120.0° |
| C25 | C26 | H52 | 119.7° | 120.0° |
| C26 | C25 | H51 | 119.9° | 120.0° |
| N27 | C28 | C29 | 132.6° | 134.3° |
| C28 | C29 | H53 | 120.8° | 120.2° |
| H43 | C17 | H42 | 109.4° | 109.7° |
| H33 | C1 | H31 | 109.5° | 109.4° |
| H33 | C1 | H32 | 109.5° | 109.5° |
| H31 | C1 | H32 | 109.5° | 109.4° |
| H36 | C3 | H35 | 109.4° | 109.5° |
| H36 | C3 | H34 | 109.5° | 109.5° |
| H35 | C3 | H34 | 109.5° | 109.5° |
| H44 | C18 | H45 | 109.5° | 109.5° |
| H47 | C19 | H46 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | O4 | 116.5° | 120.0° |
| C1 | C2 | C3 | C5 | 124.4° | 120.0° |
| C1 | C2 | O4 | C5 | 122.2° | 120.1° |
| C1 | C2 | C5 | N10 | 167.3° | 180.0° |
| C1 | C2 | C5 | N6 | 14.4° | 0.3° |
| C2 | C1 | H33 | H31 | 120.0° | 119.9° |
| C2 | C1 | H33 | H32 | 120.0° | 120.1° |
| C2 | C1 | H31 | H32 | 120.0° | 120.0° |
| C1 | C2 | C3 | H36 | 180.0° | 60.0° |
| C1 | C2 | C3 | H35 | 60.0° | 179.9° |
| C1 | C2 | C3 | H34 | 60.0° | 60.0° |
| C1 | C2 | O4 | H37 | 180.0° | 60.0° |
| C3 | C2 | O4 | C5 | 118.9° | 120.0° |
| C3 | C2 | C5 | N10 | 69.8° | 60.0° |
| C3 | C2 | C5 | N6 | 108.5° | 120.3° |
| C3 | C2 | C1 | H33 | 180.0° | 60.1° |
| C3 | C2 | C1 | H31 | 60.0° | 180.0° |
| C3 | C2 | C1 | H32 | 60.0° | 60.0° |
| C2 | C3 | H36 | H35 | 120.0° | 120.0° |
| C2 | C3 | H36 | H34 | 120.0° | 120.0° |
| C2 | C3 | H35 | H34 | 120.0° | 120.0° |
| C3 | C2 | O4 | H37 | 61.1° | 180.0° |
| O4 | C2 | C5 | N10 | 49.1° | 60.0° |
| O4 | C2 | C5 | N6 | 132.6° | 119.7° |
| O4 | C2 | C1 | H33 | 61.9° | 59.9° |
| O4 | C2 | C1 | H31 | 58.1° | 60.0° |
| O4 | C2 | C1 | H32 | 178.1° | 180.0° |
| O4 | C2 | C3 | H36 | 63.5° | 180.0° |
| O4 | C2 | C3 | H35 | 176.5° | 59.9° |
| O4 | C2 | C3 | H34 | 56.5° | 60.0° |
| C2 | C5 | N10 | N6 | 178.1° | 179.7° |
| C2 | C5 | N6 | C7 | 178.0° | 179.7° |
| C2 | C5 | N10 | C9 | 178.3° | 179.7° |
| C5 | C2 | C1 | H33 | 57.8° | 179.9° |
| C5 | C2 | C1 | H31 | 177.8° | 60.0° |
| C5 | C2 | C1 | H32 | 62.2° | 60.0° |
| C5 | C2 | C3 | H36 | 55.5° | 60.0° |
| C5 | C2 | C3 | H35 | 64.4° | 60.0° |
| C5 | C2 | C3 | H34 | 175.6° | 180.0° |
| C5 | C2 | O4 | H37 | 57.8° | 60.1° |
| N10 | C5 | N6 | C7 | 0.1° | 0.0° |
| C5 | N10 | C9 | C8 | 0.5° | 0.1° |
| C5 | N10 | C9 | H39 | 179.5° | 179.9° |
| C5 | N6 | C7 | C8 | 0.2° | 0.0° |
| N6 | C5 | N10 | C9 | 0.2° | 0.0° |
| C5 | N6 | C7 | H38 | 179.9° | 180.0° |
| N6 | C7 | C8 | H38 | 180.0° | 179.9° |
| N6 | C7 | C8 | C9 | 0.1° | 0.1° |
| N6 | C7 | C8 | C11 | 179.5° | 180.0° |
| C7 | C8 | C9 | C11 | 179.6° | 179.9° |
| C7 | C8 | C9 | N10 | 0.5° | 0.1° |
| C7 | C8 | C11 | C29 | 137.3° | 179.9° |
| C7 | C8 | C11 | C12 | 43.4° | 0.7° |
| C7 | C8 | C9 | H39 | 179.5° | 180.0° |
| C8 | C9 | N10 | H39 | 180.0° | 179.9° |
| C9 | C8 | C11 | C29 | 42.3° | 0.0° |
| C9 | C8 | C11 | C12 | 137.1° | 179.2° |
| C9 | C8 | C7 | H38 | 179.8° | 180.0° |
| C11 | C8 | C9 | N10 | 179.1° | 180.0° |
| C8 | C11 | C29 | C12 | 179.3° | 179.2° |
| C8 | C11 | C12 | C13 | 178.8° | 179.8° |
| C8 | C11 | C29 | C28 | 179.2° | 180.0° |
| C11 | C8 | C7 | H38 | 0.5° | 0.0° |
| C11 | C8 | C9 | H39 | 0.9° | 0.1° |
| C8 | C11 | C12 | H40 | 1.2° | 0.3° |
| C8 | C11 | C29 | H53 | 0.8° | 0.5° |
| C29 | C11 | C12 | C13 | 0.6° | 0.6° |
| C11 | C29 | C28 | C14 | 0.3° | 0.4° |
| C11 | C29 | C28 | N27 | 179.5° | 179.6° |
| C11 | C29 | C28 | H53 | 180.0° | 179.5° |
| C29 | C11 | C12 | H40 | 179.5° | 179.5° |
| C11 | C12 | C13 | H40 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 0.5° | 0.1° |
| C12 | C11 | C29 | C28 | 0.2° | 0.7° |
| C11 | C12 | C13 | H41 | 179.5° | 179.7° |
| C12 | C11 | C29 | H53 | 179.8° | 179.7° |
| C12 | C13 | C14 | H41 | 180.0° | 179.8° |
| C12 | C13 | C14 | C28 | 0.1° | 0.2° |
| C12 | C13 | C14 | N15 | 179.6° | 179.7° |
| C13 | C14 | C28 | N15 | 179.7° | 180.0° |
| C13 | C14 | N15 | C16 | 179.4° | 179.9° |
| C13 | C14 | C28 | N27 | 179.5° | 179.9° |
| C13 | C14 | C28 | C29 | 0.3° | 0.0° |
| C14 | C13 | C12 | H40 | 179.5° | 180.0° |
| C28 | C14 | N15 | C16 | 0.2° | 0.1° |
| C14 | C28 | N27 | C16 | 0.1° | 0.1° |
| C14 | C28 | N27 | C20 | 175.2° | 180.0° |
| C14 | C28 | N27 | C29 | 179.8° | 180.0° |
| C28 | C14 | C13 | H41 | 179.9° | 180.0° |
| C14 | C28 | C29 | H53 | 179.7° | 180.0° |
| C14 | N15 | C16 | N27 | 0.2° | 0.1° |
| C14 | N15 | C16 | C17 | 176.8° | 179.8° |
| N15 | C14 | C28 | N27 | 0.2° | 0.1° |
| N15 | C14 | C28 | C29 | 180.0° | 179.9° |
| N15 | C14 | C13 | H41 | 0.4° | 0.1° |
| N15 | C16 | N27 | C17 | 177.2° | 179.9° |
| N15 | C16 | C17 | C18 | 165.7° | 163.8° |
| N15 | C16 | N27 | C20 | 175.5° | 179.9° |
| N15 | C16 | N27 | C28 | 0.1° | 0.0° |
| N15 | C16 | C17 | H43 | 45.3° | 76.5° |
| N15 | C16 | C17 | H42 | 73.8° | 44.1° |
| N27 | C16 | C17 | C18 | 17.4° | 16.1° |
| C16 | N27 | C20 | C19 | 10.7° | 17.0° |
| C16 | N27 | C20 | C21 | 118.4° | 136.8° |
| C16 | N27 | C20 | C28 | 174.4° | 179.9° |
| C16 | N27 | C28 | C29 | 179.9° | 180.0° |
| N27 | C16 | C17 | H43 | 137.9° | 103.6° |
| N27 | C16 | C17 | H42 | 103.0° | 135.8° |
| C16 | N27 | C20 | H30 | 125.7° | 102.9° |
| C16 | C17 | C18 | H43 | 120.4° | 119.7° |
| C16 | C17 | C18 | H42 | 120.4° | 119.7° |
| C16 | C17 | C18 | C19 | 47.9° | 49.2° |
| C17 | C16 | N27 | C20 | 1.7° | 0.2° |
| C17 | C16 | N27 | C28 | 177.1° | 179.9° |
| C16 | C17 | H43 | H42 | 118.7° | 120.6° |
| C16 | C17 | C18 | H44 | 72.2° | 169.2° |
| C16 | C17 | C18 | H45 | 168.0° | 70.8° |
| C17 | C18 | C19 | H44 | 120.1° | 119.9° |
| C17 | C18 | C19 | H45 | 120.1° | 120.0° |
| C17 | C18 | C19 | C20 | 62.0° | 69.9° |
| C18 | C17 | H43 | H42 | 118.8° | 120.6° |
| C17 | C18 | H44 | H45 | 119.7° | 120.1° |
| C17 | C18 | C19 | H47 | 177.6° | 170.1° |
| C17 | C18 | C19 | H46 | 58.4° | 50.1° |
| C18 | C19 | C20 | H47 | 120.4° | 120.0° |
| C18 | C19 | C20 | H46 | 120.4° | 119.9° |
| C18 | C19 | C20 | C21 | 86.2° | 170.2° |
| C18 | C19 | C20 | N27 | 41.9° | 50.5° |
| C19 | C18 | C17 | H43 | 168.3° | 70.5° |
| C19 | C18 | C17 | H42 | 72.5° | 168.9° |
| C18 | C19 | C20 | H30 | 157.2° | 69.4° |
| C19 | C18 | H44 | H45 | 119.7° | 120.1° |
| C18 | C19 | H47 | H46 | 118.9° | 119.9° |
| C19 | C20 | C21 | N27 | 127.4° | 119.3° |
| C19 | C20 | C21 | H30 | 116.6° | 120.4° |
| C19 | C20 | N27 | H30 | 115.0° | 119.9° |
| C19 | C20 | C21 | C26 | 99.3° | 120.6° |
| C19 | C20 | C21 | C22 | 80.3° | 59.0° |
| C19 | C20 | N27 | C28 | 163.7° | 162.8° |
| C20 | C19 | C18 | H44 | 58.1° | 170.2° |
| C20 | C19 | C18 | H45 | 177.9° | 50.1° |
| C20 | C19 | H47 | H46 | 118.9° | 120.1° |
| C21 | C20 | N27 | H30 | 115.9° | 120.3° |
| C20 | C21 | C26 | C22 | 179.6° | 179.6° |
| C20 | C21 | C22 | C23 | 179.6° | 180.0° |
| C20 | C21 | C26 | C25 | 179.6° | 180.0° |
| C21 | C20 | N27 | C28 | 67.2° | 43.1° |
| C20 | C21 | C22 | H48 | 0.4° | 0.1° |
| C20 | C21 | C26 | H52 | 0.4° | 0.0° |
| C21 | C20 | C19 | H47 | 34.2° | 69.7° |
| C21 | C20 | C19 | H46 | 153.4° | 50.3° |
| N27 | C20 | C21 | C26 | 28.0° | 120.0° |
| N27 | C20 | C21 | C22 | 152.4° | 60.3° |
| C20 | N27 | C28 | C29 | 4.6° | 0.1° |
| N27 | C20 | C19 | H47 | 162.3° | 170.5° |
| N27 | C20 | C19 | H46 | 78.5° | 69.5° |
| C26 | C21 | C22 | C23 | 0.0° | 0.4° |
| C21 | C26 | C25 | C24 | 0.1° | 0.0° |
| C21 | C26 | C25 | H52 | 180.0° | 180.0° |
| C26 | C21 | C20 | H30 | 144.1° | 0.2° |
| C26 | C21 | C22 | H48 | 180.0° | 179.7° |
| C21 | C26 | C25 | H51 | 180.0° | 179.7° |
| C21 | C22 | C23 | H48 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.1° |
| C22 | C21 | C26 | C25 | 0.0° | 0.3° |
| C22 | C21 | C20 | H30 | 36.3° | 179.4° |
| C22 | C21 | C26 | H52 | 180.0° | 179.7° |
| C21 | C22 | C23 | H49 | 179.9° | 179.9° |
| C22 | C23 | C24 | H49 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.1° | 0.2° |
| C22 | C23 | C24 | H50 | 179.9° | 179.9° |
| C23 | C24 | C25 | H50 | 180.0° | 179.7° |
| C23 | C24 | C25 | C26 | 0.1° | 0.2° |
| C24 | C23 | C22 | H48 | 179.9° | 180.0° |
| C23 | C24 | C25 | H51 | 179.9° | 180.0° |
| C24 | C25 | C26 | H51 | 180.0° | 179.8° |
| C24 | C25 | C26 | H52 | 179.9° | 180.0° |
| C25 | C24 | C23 | H49 | 179.9° | 179.8° |
| C26 | C25 | C24 | H50 | 179.9° | 180.0° |
| C28 | N27 | C20 | H30 | 48.7° | 77.2° |
| N27 | C28 | C29 | H53 | 0.4° | 0.1° |
| H41 | C13 | C12 | H40 | 0.5° | 0.2° |
| H43 | C17 | C18 | H44 | 48.2° | 49.5° |
| H43 | C17 | C18 | H45 | 71.6° | 169.5° |
| H42 | C17 | C18 | H44 | 167.4° | 71.1° |
| H42 | C17 | C18 | H45 | 47.6° | 48.9° |
| H30 | C20 | C19 | H47 | 82.4° | 50.6° |
| H30 | C20 | C19 | H46 | 36.8° | 170.6° |
| H48 | C22 | C23 | H49 | 0.0° | 0.0° |
| H50 | C24 | C23 | H49 | 0.1° | 0.1° |
| H50 | C24 | C25 | H51 | 0.1° | 0.3° |
| H52 | C26 | C25 | H51 | 0.1° | 0.2° |
| H33 | C1 | H31 | H32 | 120.0° | 120.0° |
| H36 | C3 | H35 | H34 | 120.0° | 120.0° |
| H44 | C18 | C19 | H47 | 62.2° | 50.1° |
| H44 | C18 | C19 | H46 | 178.5° | 69.8° |
| H45 | C18 | C19 | H47 | 57.6° | 69.9° |
| H45 | C18 | C19 | H46 | 61.7° | 170.1° |






