A1H3C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.55Å | 1.54Å | |
| C1 | C5 | sing | 1.55Å | 1.54Å | |
| O7 | C1 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.54Å | 1.54Å | |
| O6 | C2 | sing | 1.43Å | 1.42Å | |
| O4 | C3 | sing | 1.44Å | 1.43Å | |
| C3 | C9 | sing | 1.53Å | 1.53Å | |
| C5 | O4 | sing | 1.44Å | 1.38Å | |
| N8 | C5 | sing | 1.47Å | 1.50Å | |
| C11 | N8 | sing | 1.37Å | 1.38Å | Aromatic |
| C14 | N8 | sing | 1.36Å | 1.38Å | Aromatic |
| C9 | S10 | sing | 1.81Å | 1.81Å | |
| S10 | C20 | sing | 1.81Å | 1.81Å | |
| C11 | C12 | doub | 1.40Å | 1.42Å | Aromatic |
| N15 | C11 | sing | 1.33Å | 1.37Å | Aromatic |
| C12 | N13 | sing | 1.35Å | 1.39Å | Aromatic |
| C12 | C18 | sing | 1.41Å | 1.43Å | Aromatic |
| N13 | C14 | doub | 1.30Å | 1.31Å | Aromatic |
| C16 | N15 | doub | 1.32Å | 1.34Å | Aromatic |
| N17 | C16 | sing | 1.32Å | 1.34Å | Aromatic |
| C18 | N17 | doub | 1.33Å | 1.36Å | Aromatic |
| N19 | C18 | sing | 1.38Å | 1.34Å | |
| C20 | C21 | sing | 1.51Å | 1.53Å | |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C23 | C24 | doub | 1.39Å | 1.41Å | Aromatic |
| C24 | C25 | sing | 1.41Å | 1.45Å | Aromatic |
| C30 | C24 | sing | 1.48Å | 1.50Å | |
| C26 | C25 | doub | 1.40Å | 1.42Å | Aromatic |
| C25 | C27 | sing | 1.48Å | 1.51Å | |
| O28 | C27 | sing | 1.35Å | 1.26Å | |
| C27 | O29 | doub | 1.21Å | 1.26Å | |
| C30 | C31 | doub | 1.39Å | 1.42Å | Aromatic |
| C35 | C30 | sing | 1.39Å | 1.42Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.41Å | Aromatic |
| C32 | C33 | doub | 1.38Å | 1.41Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.41Å | Aromatic |
| C34 | C35 | doub | 1.38Å | 1.42Å | Aromatic |
| C1 | H36 | sing | 1.09Å | 1.10Å | |
| C14 | H44 | sing | 1.08Å | 1.08Å | |
| C16 | H45 | sing | 1.08Å | 1.08Å | |
| C2 | H37 | sing | 1.09Å | 1.10Å | |
| C20 | H48 | sing | 1.09Å | 1.10Å | |
| C20 | H49 | sing | 1.09Å | 1.10Å | |
| C22 | H50 | sing | 1.08Å | 1.08Å | |
| C23 | H51 | sing | 1.08Å | 1.08Å | |
| C26 | H52 | sing | 1.08Å | 1.08Å | |
| C3 | H38 | sing | 1.09Å | 1.10Å | |
| C31 | H53 | sing | 1.08Å | 1.08Å | |
| C32 | H54 | sing | 1.08Å | 1.08Å | |
| C33 | H55 | sing | 1.08Å | 1.08Å | |
| C34 | H56 | sing | 1.08Å | 1.08Å | |
| C35 | H57 | sing | 1.08Å | 1.08Å | |
| C5 | H39 | sing | 1.09Å | 1.10Å | |
| C9 | H43 | sing | 1.09Å | 1.10Å | |
| C9 | H42 | sing | 1.09Å | 1.10Å | |
| N19 | H47 | sing | 0.97Å | 1.00Å | |
| N19 | H46 | sing | 0.97Å | 1.00Å | |
| O28 | H1 | sing | 0.97Å | 0.95Å | |
| O6 | H40 | sing | 0.97Å | 0.95Å | |
| O7 | H41 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C5 | 101.0° | 102.1° |
| C2 | C1 | O7 | 113.6° | 110.9° |
| C1 | C2 | C3 | 103.8° | 104.2° |
| C1 | C2 | O6 | 114.3° | 110.5° |
| C2 | C1 | H36 | 108.3° | 110.9° |
| C1 | C2 | H37 | 109.0° | 110.5° |
| C5 | C1 | O7 | 115.2° | 110.9° |
| C1 | C5 | O4 | 103.3° | 103.5° |
| C1 | C5 | N8 | 114.9° | 110.7° |
| C5 | C1 | H36 | 108.3° | 110.9° |
| C1 | C5 | H39 | 109.1° | 110.6° |
| O7 | C1 | H36 | 109.9° | 110.8° |
| C1 | O7 | H41 | 109.5° | 114.0° |
| C3 | C2 | O6 | 109.8° | 110.5° |
| C2 | C3 | O4 | 104.7° | 107.3° |
| C2 | C3 | C9 | 113.6° | 109.9° |
| C3 | C2 | H37 | 109.0° | 110.5° |
| C2 | C3 | H38 | 108.7° | 109.9° |
| O6 | C2 | H37 | 110.7° | 110.5° |
| C2 | O6 | H40 | 109.5° | 114.0° |
| O4 | C3 | C9 | 110.4° | 109.9° |
| C3 | O4 | C5 | 105.9° | 106.9° |
| O4 | C3 | H38 | 110.4° | 110.0° |
| C3 | C9 | S10 | 110.8° | 109.5° |
| C9 | C3 | H38 | 109.0° | 109.9° |
| C3 | C9 | H43 | 109.1° | 109.5° |
| C3 | C9 | H42 | 109.1° | 109.4° |
| O4 | C5 | N8 | 108.5° | 110.6° |
| O4 | C5 | H39 | 111.3° | 110.6° |
| C5 | N8 | C11 | 124.0° | 126.3° |
| C5 | N8 | C14 | 130.9° | 126.3° |
| N8 | C5 | H39 | 109.6° | 110.6° |
| C11 | N8 | C14 | 105.1° | 107.4° |
| N8 | C11 | C12 | 106.2° | 106.0° |
| N8 | C11 | N15 | 128.1° | 134.9° |
| N8 | C14 | N13 | 114.7° | 109.9° |
| N8 | C14 | H44 | 122.7° | 125.0° |
| C9 | S10 | C20 | 102.2° | 103.0° |
| S10 | C9 | H43 | 109.1° | 109.5° |
| S10 | C9 | H42 | 109.1° | 109.5° |
| S10 | C20 | C21 | 117.0° | 109.5° |
| S10 | C20 | H48 | 107.6° | 109.4° |
| S10 | C20 | H49 | 107.6° | 109.4° |
| C12 | C11 | N15 | 125.7° | 119.0° |
| C11 | C12 | N13 | 109.3° | 107.1° |
| C11 | C12 | C18 | 115.9° | 118.2° |
| C11 | N15 | C16 | 111.6° | 120.7° |
| N13 | C12 | C18 | 134.8° | 134.7° |
| C12 | N13 | C14 | 104.7° | 109.5° |
| C12 | C18 | N17 | 118.5° | 118.4° |
| C12 | C18 | N19 | 122.9° | 120.8° |
| N13 | C14 | H44 | 122.7° | 125.0° |
| N15 | C16 | N17 | 129.2° | 122.4° |
| N15 | C16 | H45 | 115.4° | 118.8° |
| C16 | N17 | C18 | 119.1° | 121.2° |
| N17 | C16 | H45 | 115.4° | 118.8° |
| N17 | C18 | N19 | 118.6° | 120.8° |
| C18 | N19 | H47 | 109.5° | 120.1° |
| C18 | N19 | H46 | 109.5° | 120.1° |
| C20 | C21 | C22 | 120.0° | 119.8° |
| C20 | C21 | C26 | 122.5° | 119.8° |
| C21 | C20 | H48 | 107.6° | 109.5° |
| C21 | C20 | H49 | 107.6° | 109.5° |
| C22 | C21 | C26 | 117.5° | 120.4° |
| C21 | C22 | C23 | 121.9° | 120.4° |
| C21 | C22 | H50 | 119.1° | 119.8° |
| C21 | C26 | C25 | 121.8° | 119.9° |
| C21 | C26 | H52 | 119.1° | 120.0° |
| C22 | C23 | C24 | 122.2° | 120.1° |
| C23 | C22 | H50 | 119.0° | 119.8° |
| C22 | C23 | H51 | 118.9° | 120.0° |
| C23 | C24 | C25 | 116.1° | 119.6° |
| C23 | C24 | C30 | 115.1° | 120.2° |
| C24 | C23 | H51 | 118.9° | 119.9° |
| C25 | C24 | C30 | 128.8° | 120.2° |
| C24 | C25 | C26 | 120.5° | 119.6° |
| C24 | C25 | C27 | 126.4° | 120.2° |
| C24 | C30 | C31 | 123.3° | 120.1° |
| C24 | C30 | C35 | 120.1° | 120.1° |
| C26 | C25 | C27 | 113.1° | 120.2° |
| C25 | C26 | H52 | 119.1° | 120.1° |
| C25 | C27 | O28 | 120.0° | 120.0° |
| C25 | C27 | O29 | 118.1° | 120.0° |
| O28 | C27 | O29 | 121.9° | 120.0° |
| C27 | O28 | H1 | 109.5° | 116.9° |
| C31 | C30 | C35 | 116.7° | 119.8° |
| C30 | C31 | C32 | 122.0° | 119.9° |
| C30 | C31 | H53 | 119.0° | 120.1° |
| C30 | C35 | C34 | 121.7° | 119.8° |
| C30 | C35 | H57 | 119.2° | 120.1° |
| C31 | C32 | C33 | 120.3° | 120.1° |
| C32 | C31 | H53 | 119.0° | 120.0° |
| C31 | C32 | H54 | 119.8° | 120.0° |
| C32 | C33 | C34 | 119.1° | 120.2° |
| C33 | C32 | H54 | 119.9° | 119.9° |
| C32 | C33 | H55 | 120.4° | 119.9° |
| C33 | C34 | C35 | 120.3° | 120.2° |
| C34 | C33 | H55 | 120.5° | 119.9° |
| C33 | C34 | H56 | 119.9° | 119.9° |
| C35 | C34 | H56 | 119.8° | 119.9° |
| C34 | C35 | H57 | 119.1° | 120.1° |
| H48 | C20 | H49 | 109.5° | 109.5° |
| H43 | C9 | H42 | 109.5° | 109.4° |
| H47 | N19 | H46 | 109.5° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C5 | O7 | 122.8° | 118.2° |
| C2 | C1 | C5 | H36 | 113.7° | 118.2° |
| C2 | C1 | O7 | H36 | 121.5° | 123.7° |
| C1 | C2 | C3 | O6 | 122.6° | 118.7° |
| C1 | C2 | C3 | H37 | 116.0° | 118.7° |
| C1 | C2 | O6 | H37 | 123.5° | 122.6° |
| C1 | C2 | C3 | O4 | 10.8° | 2.0° |
| C1 | C2 | C3 | C9 | 131.3° | 121.5° |
| C2 | C1 | C5 | O4 | 38.4° | 37.0° |
| C2 | C1 | C5 | N8 | 156.3° | 155.5° |
| C1 | C2 | C3 | H38 | 107.2° | 117.6° |
| C2 | C1 | C5 | H39 | 80.1° | 81.5° |
| C1 | C2 | O6 | H40 | 180.0° | 61.4° |
| C2 | C1 | O7 | H41 | 180.0° | 61.5° |
| C5 | C1 | O7 | H36 | 122.7° | 123.6° |
| C5 | C1 | C2 | C3 | 15.6° | 20.9° |
| C5 | C1 | C2 | O6 | 103.9° | 97.8° |
| C1 | C5 | O4 | C3 | 47.9° | 40.1° |
| C1 | C5 | O4 | N8 | 122.4° | 118.5° |
| C1 | C5 | O4 | H39 | 116.9° | 118.5° |
| C1 | C5 | N8 | H39 | 123.2° | 123.0° |
| C1 | C5 | N8 | C11 | 119.1° | 85.0° |
| C1 | C5 | N8 | C14 | 61.3° | 94.9° |
| C5 | C1 | C2 | H37 | 131.7° | 139.6° |
| C5 | C1 | O7 | H41 | 64.1° | 174.2° |
| O7 | C1 | C2 | C3 | 139.6° | 139.0° |
| O7 | C1 | C2 | O6 | 20.0° | 20.3° |
| O7 | C1 | C5 | O4 | 161.2° | 155.2° |
| O7 | C1 | C5 | N8 | 80.8° | 86.3° |
| O7 | C1 | C2 | H37 | 104.4° | 102.3° |
| O7 | C1 | C5 | H39 | 42.7° | 36.7° |
| C3 | C2 | O6 | H37 | 120.3° | 122.6° |
| C2 | C3 | O4 | C9 | 122.6° | 119.4° |
| C2 | C3 | O4 | H38 | 116.9° | 119.5° |
| C2 | C3 | C9 | H38 | 121.4° | 121.0° |
| C2 | C3 | O4 | C5 | 36.9° | 26.5° |
| C2 | C3 | C9 | S10 | 62.6° | 175.0° |
| C3 | C2 | C1 | H36 | 98.0° | 97.3° |
| C2 | C3 | C9 | H43 | 177.2° | 55.0° |
| C2 | C3 | C9 | H42 | 57.6° | 65.0° |
| C3 | C2 | O6 | H40 | 63.8° | 176.2° |
| O6 | C2 | C3 | O4 | 133.4° | 120.7° |
| O6 | C2 | C3 | C9 | 106.1° | 119.8° |
| O6 | C2 | C1 | H36 | 142.4° | 144.0° |
| O6 | C2 | C3 | H38 | 15.4° | 1.1° |
| O4 | C3 | C9 | H38 | 121.4° | 121.2° |
| C3 | O4 | C5 | N8 | 170.3° | 158.6° |
| O4 | C3 | C9 | S10 | 54.7° | 67.1° |
| O4 | C3 | C2 | H37 | 105.2° | 116.6° |
| C3 | O4 | C5 | H39 | 69.0° | 78.5° |
| O4 | C3 | C9 | H43 | 65.6° | 172.8° |
| O4 | C3 | C9 | H42 | 174.9° | 52.8° |
| C9 | C3 | O4 | C5 | 159.5° | 145.9° |
| C3 | C9 | S10 | H43 | 120.2° | 120.1° |
| C3 | C9 | S10 | H42 | 120.2° | 120.0° |
| C3 | C9 | S10 | C20 | 96.7° | 180.0° |
| C9 | C3 | C2 | H37 | 15.3° | 2.8° |
| C3 | C9 | H43 | H42 | 119.4° | 120.0° |
| O4 | C5 | N8 | H39 | 121.7° | 122.9° |
| O4 | C5 | N8 | C11 | 125.8° | 161.0° |
| O4 | C5 | N8 | C14 | 53.7° | 19.1° |
| O4 | C5 | C1 | H36 | 75.3° | 81.2° |
| C5 | O4 | C3 | H38 | 80.0° | 93.0° |
| C5 | N8 | C11 | C14 | 179.6° | 179.9° |
| C5 | N8 | C11 | C12 | 179.6° | 180.0° |
| C5 | N8 | C11 | N15 | 0.5° | 0.2° |
| C5 | N8 | C14 | N13 | 179.8° | 179.9° |
| N8 | C5 | C1 | H36 | 42.7° | 37.3° |
| C5 | N8 | C14 | H44 | 0.2° | 0.0° |
| N8 | C11 | C12 | N15 | 179.1° | 179.8° |
| N8 | C11 | C12 | N13 | 0.7° | 0.0° |
| N8 | C11 | C12 | C18 | 179.7° | 180.0° |
| C11 | N8 | C14 | N13 | 0.6° | 0.0° |
| N8 | C11 | N15 | C16 | 179.4° | 180.0° |
| C11 | N8 | C14 | H44 | 179.4° | 179.9° |
| C11 | N8 | C5 | H39 | 4.1° | 38.0° |
| C14 | N8 | C11 | C12 | 0.8° | 0.0° |
| C14 | N8 | C11 | N15 | 179.8° | 179.8° |
| N8 | C14 | N13 | C12 | 0.1° | 0.0° |
| N8 | C14 | N13 | H44 | 180.0° | 179.9° |
| C14 | N8 | C5 | H39 | 175.4° | 142.0° |
| C9 | S10 | C20 | C21 | 122.7° | 180.0° |
| C9 | S10 | C20 | H48 | 1.6° | 60.0° |
| C9 | S10 | C20 | H49 | 116.2° | 60.0° |
| S10 | C9 | C3 | H38 | 176.1° | 54.0° |
| S10 | C9 | H43 | H42 | 119.4° | 120.0° |
| S10 | C20 | C21 | H48 | 121.1° | 120.0° |
| S10 | C20 | C21 | H49 | 121.1° | 120.0° |
| S10 | C20 | C21 | C22 | 43.3° | 90.0° |
| S10 | C20 | C21 | C26 | 137.2° | 90.3° |
| S10 | C20 | H48 | H49 | 116.6° | 119.9° |
| C20 | S10 | C9 | H43 | 143.1° | 60.0° |
| C20 | S10 | C9 | H42 | 23.5° | 60.0° |
| C11 | C12 | N13 | C18 | 179.5° | 180.0° |
| C11 | C12 | N13 | C14 | 0.4° | 0.0° |
| C12 | C11 | N15 | C16 | 0.5° | 0.2° |
| C11 | C12 | C18 | N17 | 0.1° | 0.1° |
| C11 | C12 | C18 | N19 | 179.8° | 180.0° |
| N15 | C11 | C12 | N13 | 179.8° | 179.8° |
| N15 | C11 | C12 | C18 | 0.6° | 0.2° |
| C11 | N15 | C16 | N17 | 0.0° | 0.0° |
| C11 | N15 | C16 | H45 | 180.0° | 180.0° |
| N13 | C12 | C18 | N17 | 179.6° | 180.0° |
| N13 | C12 | C18 | N19 | 0.4° | 0.1° |
| C12 | N13 | C14 | H44 | 179.9° | 179.9° |
| C18 | C12 | N13 | C14 | 179.8° | 180.0° |
| C12 | C18 | N17 | C16 | 0.3° | 0.3° |
| C12 | C18 | N17 | N19 | 180.0° | 179.9° |
| C12 | C18 | N19 | H47 | 179.9° | 0.1° |
| C12 | C18 | N19 | H46 | 59.9° | 180.0° |
| N15 | C16 | N17 | H45 | 180.0° | 179.9° |
| N15 | C16 | N17 | C18 | 0.5° | 0.2° |
| C16 | N17 | C18 | N19 | 179.7° | 179.8° |
| C18 | N17 | C16 | H45 | 179.5° | 179.7° |
| N17 | C18 | N19 | H47 | 0.0° | 180.0° |
| N17 | C18 | N19 | H46 | 120.0° | 0.1° |
| C18 | N19 | H47 | H46 | 120.0° | 180.0° |
| C20 | C21 | C22 | C26 | 179.5° | 179.7° |
| C20 | C21 | C22 | C23 | 179.9° | 180.0° |
| C20 | C21 | C26 | C25 | 179.8° | 179.8° |
| C21 | C20 | H48 | H49 | 116.6° | 120.1° |
| C20 | C21 | C22 | H50 | 0.2° | 0.1° |
| C20 | C21 | C26 | H52 | 0.2° | 0.0° |
| C21 | C22 | C23 | H50 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C22 | C21 | C26 | C25 | 0.4° | 0.5° |
| C22 | C21 | C20 | H48 | 164.4° | 150.0° |
| C22 | C21 | C20 | H49 | 77.7° | 29.9° |
| C21 | C22 | C23 | H51 | 179.9° | 179.9° |
| C22 | C21 | C26 | H52 | 179.6° | 179.7° |
| C26 | C21 | C22 | C23 | 0.4° | 0.3° |
| C21 | C26 | C25 | C24 | 0.0° | 0.4° |
| C21 | C26 | C25 | H52 | 180.0° | 179.8° |
| C21 | C26 | C25 | C27 | 179.7° | 179.7° |
| C26 | C21 | C20 | H48 | 16.1° | 29.7° |
| C26 | C21 | C20 | H49 | 101.7° | 149.7° |
| C26 | C21 | C22 | H50 | 179.6° | 179.8° |
| C22 | C23 | C24 | H51 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 0.2° | 0.1° |
| C22 | C23 | C24 | C30 | 179.7° | 180.0° |
| C23 | C24 | C25 | C30 | 179.4° | 180.0° |
| C23 | C24 | C25 | C26 | 0.2° | 0.2° |
| C23 | C24 | C25 | C27 | 180.0° | 180.0° |
| C23 | C24 | C30 | C31 | 136.4° | 121.9° |
| C23 | C24 | C30 | C35 | 42.9° | 57.8° |
| C24 | C23 | C22 | H50 | 179.9° | 179.9° |
| C24 | C25 | C26 | C27 | 179.8° | 179.8° |
| C24 | C25 | C27 | O28 | 100.8° | 173.7° |
| C24 | C25 | C27 | O29 | 81.1° | 6.3° |
| C25 | C24 | C30 | C31 | 44.2° | 58.2° |
| C25 | C24 | C30 | C35 | 136.6° | 122.2° |
| C25 | C24 | C23 | H51 | 179.8° | 180.0° |
| C24 | C25 | C26 | H52 | 179.9° | 179.7° |
| C30 | C24 | C25 | C26 | 179.7° | 179.8° |
| C30 | C24 | C25 | C27 | 0.6° | 0.0° |
| C24 | C30 | C31 | C35 | 179.3° | 179.7° |
| C24 | C30 | C31 | C32 | 179.9° | 179.9° |
| C24 | C30 | C35 | C34 | 179.8° | 179.7° |
| C30 | C24 | C23 | H51 | 0.3° | 0.0° |
| C24 | C30 | C31 | H53 | 0.1° | 0.1° |
| C24 | C30 | C35 | H57 | 0.2° | 0.3° |
| C26 | C25 | C27 | O28 | 79.4° | 6.5° |
| C26 | C25 | C27 | O29 | 98.6° | 173.5° |
| C25 | C27 | O28 | O29 | 178.0° | 179.9° |
| C27 | C25 | C26 | H52 | 0.3° | 0.1° |
| C25 | C27 | O28 | H1 | 178.0° | 180.0° |
| O29 | C27 | O28 | H1 | 0.0° | 0.1° |
| C30 | C31 | C32 | H53 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.5° | 0.0° |
| C31 | C30 | C35 | C34 | 0.5° | 0.6° |
| C30 | C31 | C32 | H54 | 179.6° | 180.0° |
| C31 | C30 | C35 | H57 | 179.5° | 180.0° |
| C35 | C30 | C31 | C32 | 0.6° | 0.3° |
| C30 | C35 | C34 | C33 | 0.2° | 0.6° |
| C30 | C35 | C34 | H57 | 180.0° | 179.4° |
| C35 | C30 | C31 | H53 | 179.4° | 179.8° |
| C30 | C35 | C34 | H56 | 179.8° | 179.7° |
| C31 | C32 | C33 | H54 | 180.0° | 179.9° |
| C31 | C32 | C33 | C34 | 0.1° | 0.0° |
| C31 | C32 | C33 | H55 | 179.9° | 179.9° |
| C32 | C33 | C34 | H55 | 180.0° | 179.9° |
| C32 | C33 | C34 | C35 | 0.0° | 0.3° |
| C33 | C32 | C31 | H53 | 179.6° | 179.9° |
| C32 | C33 | C34 | H56 | 180.0° | 180.0° |
| C33 | C34 | C35 | H56 | 180.0° | 179.8° |
| C34 | C33 | C32 | H54 | 179.9° | 180.0° |
| C33 | C34 | C35 | H57 | 179.8° | 180.0° |
| C35 | C34 | C33 | H55 | 180.0° | 179.8° |
| H36 | C1 | C2 | H37 | 18.0° | 21.4° |
| H36 | C1 | C5 | H39 | 166.2° | 160.3° |
| H36 | C1 | O7 | H41 | 58.5° | 62.2° |
| H37 | C2 | C3 | H38 | 136.8° | 123.8° |
| H37 | C2 | O6 | H40 | 56.5° | 61.2° |
| H50 | C22 | C23 | H51 | 0.1° | 0.0° |
| H38 | C3 | C9 | H43 | 55.9° | 66.0° |
| H38 | C3 | C9 | H42 | 63.7° | 174.0° |
| H53 | C31 | C32 | H54 | 0.4° | 0.0° |
| H54 | C32 | C33 | H55 | 0.1° | 0.0° |
| H55 | C33 | C34 | H56 | 0.0° | 0.0° |
| H56 | C34 | C35 | H57 | 0.2° | 0.3° |
