A1JD0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C2 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.52Å | 1.46Å | |
| C3 | C4 | doub | 1.33Å | 1.32Å | |
| C3 | C5 | sing | 1.48Å | 1.46Å | |
| C5 | C6 | doub | 1.35Å | 1.36Å | |
| C6 | C7 | sing | 1.46Å | 1.45Å | |
| C7 | C8 | doub | 1.33Å | 1.34Å | |
| C8 | C9 | sing | 1.52Å | 1.50Å | |
| C9 | C10 | sing | 1.53Å | 1.54Å | |
| C10 | C11 | sing | 1.54Å | 1.53Å | |
| C11 | C12 | sing | 1.51Å | 1.54Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C12 | C14 | sing | 1.56Å | 1.55Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.55Å | 1.53Å | |
| C16 | C17 | sing | 1.56Å | 1.55Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C23 | C25 | sing | 1.53Å | 1.53Å | |
| C23 | N26 | sing | 1.47Å | 1.54Å | |
| N26 | O27 | sing | 1.46Å | 1.34Å | |
| N26 | O28 | sing | 1.46Å | 1.42Å | |
| C5 | C29 | sing | 1.52Å | 1.51Å | |
| C29 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | O31 | sing | 1.43Å | 1.44Å | |
| C30 | C32 | sing | 1.53Å | 1.52Å | |
| C32 | C2 | sing | 1.53Å | 1.52Å | |
| C14 | C8 | sing | 1.50Å | 1.51Å | |
| C17 | C12 | sing | 1.52Å | 1.55Å | |
| C4 | H4B | sing | 1.08Å | 1.08Å | |
| C4 | H4A | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C13 | H13C | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C24 | H24C | sing | 1.09Å | 1.10Å | |
| C24 | H24B | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C11 | H11B | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19C | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C25 | H25C | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C29 | H29B | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C9 | H9B | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| O27 | H3 | sing | 0.97Å | 0.95Å | |
| O28 | H28 | sing | 0.97Å | 0.95Å | |
| O31 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C2 | C3 | 110.4° | 109.7° |
| O1 | C2 | C32 | 109.0° | 109.7° |
| O1 | C2 | H2 | 109.3° | 109.6° |
| C2 | O1 | H1 | 109.5° | 114.0° |
| C2 | C3 | C4 | 119.6° | 121.6° |
| C2 | C3 | C5 | 118.0° | 116.8° |
| C3 | C2 | C32 | 111.1° | 108.3° |
| C3 | C2 | H2 | 108.8° | 109.7° |
| C4 | C3 | C5 | 122.3° | 121.6° |
| C3 | C4 | H4B | 120.0° | 120.0° |
| C3 | C4 | H4A | 120.0° | 120.0° |
| C3 | C5 | C6 | 126.3° | 121.6° |
| C3 | C5 | C29 | 112.0° | 116.8° |
| C5 | C6 | C7 | 126.7° | 120.0° |
| C6 | C5 | C29 | 121.2° | 121.6° |
| C5 | C6 | H6 | 116.6° | 120.0° |
| C6 | C7 | C8 | 126.9° | 120.0° |
| C7 | C6 | H6 | 116.6° | 120.0° |
| C6 | C7 | H7 | 116.6° | 119.9° |
| C7 | C8 | C9 | 125.4° | 122.4° |
| C7 | C8 | C14 | 123.5° | 122.4° |
| C8 | C7 | H7 | 116.6° | 120.0° |
| C8 | C9 | C10 | 109.4° | 110.7° |
| C9 | C8 | C14 | 110.5° | 115.2° |
| C8 | C9 | H9B | 109.5° | 109.2° |
| C8 | C9 | H9A | 109.5° | 109.2° |
| C9 | C10 | C11 | 112.4° | 111.8° |
| C9 | C10 | H10B | 108.7° | 108.8° |
| C9 | C10 | H10A | 108.8° | 109.1° |
| C10 | C9 | H9B | 109.5° | 109.2° |
| C10 | C9 | H9A | 109.5° | 109.2° |
| C10 | C11 | C12 | 113.0° | 107.7° |
| C11 | C10 | H10B | 108.8° | 109.0° |
| C11 | C10 | H10A | 108.7° | 109.0° |
| C10 | C11 | H11B | 108.6° | 109.8° |
| C10 | C11 | H11A | 108.6° | 109.8° |
| C11 | C12 | C13 | 110.6° | 109.3° |
| C11 | C12 | C14 | 105.7° | 107.6° |
| C11 | C12 | C17 | 117.7° | 118.3° |
| C12 | C11 | H11B | 108.6° | 109.7° |
| C12 | C11 | H11A | 108.6° | 109.8° |
| C13 | C12 | C14 | 109.6° | 108.4° |
| C13 | C12 | C17 | 111.9° | 109.3° |
| C12 | C13 | H13C | 109.5° | 109.5° |
| C12 | C13 | H13A | 109.5° | 109.5° |
| C12 | C13 | H13B | 109.5° | 109.5° |
| C12 | C14 | C15 | 103.9° | 101.3° |
| C12 | C14 | C8 | 112.2° | 105.5° |
| C14 | C12 | C17 | 100.4° | 103.5° |
| C12 | C14 | H14 | 106.2° | 110.9° |
| C14 | C15 | C16 | 102.6° | 102.8° |
| C15 | C14 | C8 | 120.7° | 116.7° |
| C14 | C15 | H15A | 111.2° | 110.8° |
| C14 | C15 | H15B | 111.1° | 110.7° |
| C15 | C14 | H14 | 106.4° | 111.2° |
| C15 | C16 | C17 | 107.7° | 106.3° |
| C16 | C15 | H15A | 111.2° | 110.8° |
| C16 | C15 | H15B | 111.2° | 110.7° |
| C15 | C16 | H16A | 109.9° | 110.1° |
| C15 | C16 | H16B | 109.9° | 110.1° |
| C16 | C17 | C18 | 111.0° | 110.4° |
| C16 | C17 | C12 | 104.9° | 104.8° |
| C16 | C17 | H17 | 106.9° | 110.5° |
| C17 | C16 | H16A | 109.9° | 109.9° |
| C17 | C16 | H16B | 109.9° | 110.2° |
| C17 | C18 | C19 | 112.7° | 109.5° |
| C17 | C18 | C20 | 113.9° | 109.5° |
| C18 | C17 | C12 | 119.8° | 110.3° |
| C18 | C17 | H17 | 106.9° | 110.3° |
| C17 | C18 | H18 | 106.5° | 109.5° |
| C19 | C18 | C20 | 110.1° | 109.5° |
| C19 | C18 | H18 | 106.6° | 109.5° |
| C18 | C19 | H19A | 109.5° | 109.5° |
| C18 | C19 | H19C | 109.4° | 109.5° |
| C18 | C19 | H19B | 109.5° | 109.5° |
| C18 | C20 | C21 | 112.6° | 109.5° |
| C18 | C20 | H20B | 108.7° | 109.4° |
| C18 | C20 | H20A | 108.7° | 109.4° |
| C20 | C18 | H18 | 106.6° | 109.4° |
| C20 | C21 | C22 | 113.7° | 109.4° |
| C21 | C20 | H20B | 108.7° | 109.5° |
| C21 | C20 | H20A | 108.7° | 109.5° |
| C20 | C21 | H21A | 108.4° | 109.5° |
| C20 | C21 | H21B | 108.4° | 109.4° |
| C21 | C22 | C23 | 115.5° | 109.4° |
| C22 | C21 | H21A | 108.4° | 109.5° |
| C22 | C21 | H21B | 108.4° | 109.5° |
| C21 | C22 | H22B | 108.0° | 109.5° |
| C21 | C22 | H22A | 107.9° | 109.5° |
| C22 | C23 | C24 | 112.1° | 109.5° |
| C22 | C23 | C25 | 110.3° | 109.5° |
| C22 | C23 | N26 | 109.3° | 109.5° |
| C23 | C22 | H22B | 107.9° | 109.5° |
| C23 | C22 | H22A | 107.9° | 109.5° |
| C24 | C23 | C25 | 110.6° | 109.5° |
| C24 | C23 | N26 | 105.7° | 109.5° |
| C23 | C24 | H24C | 109.5° | 109.5° |
| C23 | C24 | H24B | 109.4° | 109.4° |
| C23 | C24 | H24A | 109.4° | 109.4° |
| C25 | C23 | N26 | 108.7° | 109.5° |
| C23 | C25 | H25C | 109.5° | 109.5° |
| C23 | C25 | H25A | 109.5° | 109.4° |
| C23 | C25 | H25B | 109.4° | 109.5° |
| C23 | N26 | O27 | 114.8° | 111.0° |
| C23 | N26 | O28 | 108.1° | 111.0° |
| O27 | N26 | O28 | 107.1° | 111.0° |
| N26 | O27 | H3 | 109.5° | 114.0° |
| N26 | O28 | H28 | 109.5° | 114.0° |
| C5 | C29 | C30 | 112.5° | 108.4° |
| C5 | C29 | H29A | 108.7° | 109.7° |
| C5 | C29 | H29B | 108.7° | 109.7° |
| C29 | C30 | O31 | 109.2° | 109.4° |
| C29 | C30 | C32 | 110.0° | 109.8° |
| C30 | C29 | H29A | 108.7° | 109.7° |
| C30 | C29 | H29B | 108.7° | 109.6° |
| C29 | C30 | H30 | 108.8° | 109.4° |
| O31 | C30 | C32 | 109.8° | 109.4° |
| O31 | C30 | H30 | 110.0° | 109.4° |
| C30 | O31 | H31 | 109.5° | 114.0° |
| C30 | C32 | C2 | 110.5° | 109.9° |
| C32 | C30 | H30 | 108.9° | 109.4° |
| C30 | C32 | H32B | 109.2° | 109.4° |
| C30 | C32 | H32A | 109.2° | 109.4° |
| C32 | C2 | H2 | 108.1° | 109.7° |
| C2 | C32 | H32B | 109.2° | 109.2° |
| C2 | C32 | H32A | 109.2° | 109.5° |
| C8 | C14 | H14 | 106.6° | 110.7° |
| C12 | C17 | H17 | 106.8° | 110.4° |
| H4B | C4 | H4A | 120.0° | 120.0° |
| H10B | C10 | H10A | 109.5° | 109.0° |
| H13C | C13 | H13A | 109.5° | 109.5° |
| H13C | C13 | H13B | 109.4° | 109.4° |
| H13A | C13 | H13B | 109.5° | 109.5° |
| H15A | C15 | H15B | 109.4° | 110.8° |
| H20B | C20 | H20A | 109.5° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.5° |
| H22B | C22 | H22A | 109.5° | 109.5° |
| H24C | C24 | H24B | 109.5° | 109.5° |
| H24C | C24 | H24A | 109.5° | 109.5° |
| H24B | C24 | H24A | 109.5° | 109.5° |
| H11B | C11 | H11A | 109.5° | 109.9° |
| H16A | C16 | H16B | 109.5° | 110.1° |
| H19A | C19 | H19C | 109.5° | 109.5° |
| H19A | C19 | H19B | 109.5° | 109.5° |
| H19C | C19 | H19B | 109.5° | 109.5° |
| H25C | C25 | H25A | 109.4° | 109.5° |
| H25C | C25 | H25B | 109.5° | 109.5° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H29A | C29 | H29B | 109.5° | 109.7° |
| H32B | C32 | H32A | 109.4° | 109.3° |
| H9B | C9 | H9A | 109.5° | 109.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C2 | C3 | C32 | 121.1° | 119.7° |
| O1 | C2 | C3 | H2 | 120.0° | 120.5° |
| O1 | C2 | C3 | C4 | 5.0° | 106.8° |
| O1 | C2 | C3 | C5 | 170.7° | 73.2° |
| O1 | C2 | C32 | C30 | 175.9° | 62.3° |
| O1 | C2 | C32 | H2 | 118.7° | 120.5° |
| O1 | C2 | C32 | H32B | 55.8° | 177.7° |
| O1 | C2 | C32 | H32A | 63.9° | 58.0° |
| C2 | C3 | C4 | C5 | 175.5° | 180.0° |
| C2 | C3 | C5 | C6 | 141.9° | 136.9° |
| C2 | C3 | C5 | C29 | 46.4° | 43.3° |
| C3 | C2 | C32 | C30 | 54.0° | 57.5° |
| C3 | C2 | C32 | H2 | 119.3° | 119.7° |
| C2 | C3 | C4 | H4B | 175.5° | 0.1° |
| C2 | C3 | C4 | H4A | 4.5° | 179.7° |
| C3 | C2 | C32 | H32B | 66.2° | 62.6° |
| C3 | C2 | C32 | H32A | 174.2° | 177.7° |
| C3 | C2 | O1 | H1 | 180.0° | 59.9° |
| C4 | C3 | C5 | C6 | 42.5° | 43.1° |
| C4 | C3 | C5 | C29 | 129.2° | 136.7° |
| C4 | C3 | C2 | C32 | 126.1° | 133.4° |
| C3 | C4 | H4B | H4A | 180.0° | 179.7° |
| C4 | C3 | C2 | H2 | 115.0° | 13.7° |
| C3 | C5 | C6 | C29 | 171.0° | 179.8° |
| C3 | C5 | C6 | C7 | 11.7° | 0.3° |
| C3 | C5 | C29 | C30 | 48.0° | 46.8° |
| C5 | C3 | C2 | C32 | 49.6° | 46.5° |
| C5 | C3 | C4 | H4B | 0.0° | 179.9° |
| C5 | C3 | C4 | H4A | 180.0° | 0.3° |
| C3 | C5 | C6 | H6 | 168.3° | 179.8° |
| C5 | C3 | C2 | H2 | 69.3° | 166.3° |
| C3 | C5 | C29 | H29A | 72.5° | 166.5° |
| C3 | C5 | C29 | H29B | 168.4° | 72.9° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 154.3° | 180.0° |
| C6 | C5 | C29 | C30 | 139.8° | 133.5° |
| C5 | C6 | C7 | H7 | 25.7° | 0.0° |
| C6 | C5 | C29 | H29A | 99.7° | 13.7° |
| C6 | C5 | C29 | H29B | 19.4° | 106.9° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 2.2° | 0.0° |
| C7 | C6 | C5 | C29 | 177.3° | 180.0° |
| C6 | C7 | C8 | C14 | 172.7° | 179.7° |
| C7 | C8 | C9 | C14 | 171.5° | 179.8° |
| C7 | C8 | C9 | C10 | 114.3° | 129.8° |
| C7 | C8 | C14 | C12 | 108.3° | 121.8° |
| C7 | C8 | C14 | C15 | 14.5° | 10.4° |
| C8 | C7 | C6 | H6 | 25.7° | 0.0° |
| C7 | C8 | C14 | H14 | 135.8° | 118.1° |
| C7 | C8 | C9 | H9B | 125.7° | 109.9° |
| C7 | C8 | C9 | H9A | 5.6° | 9.5° |
| C8 | C9 | C10 | H9B | 120.0° | 120.3° |
| C8 | C9 | C10 | H9A | 120.0° | 120.3° |
| C8 | C9 | C10 | C11 | 53.3° | 48.6° |
| C9 | C8 | C14 | C12 | 63.4° | 58.4° |
| C9 | C8 | C14 | C15 | 173.8° | 169.9° |
| C9 | C8 | C7 | H7 | 177.8° | 180.0° |
| C8 | C9 | C10 | H10B | 173.7° | 71.9° |
| C8 | C9 | C10 | H10A | 67.2° | 169.3° |
| C9 | C8 | C14 | H14 | 52.5° | 61.6° |
| C8 | C9 | H9B | H9A | 120.1° | 119.4° |
| C9 | C10 | C11 | H10B | 120.4° | 120.3° |
| C9 | C10 | C11 | H10A | 120.4° | 120.8° |
| C9 | C10 | C11 | C12 | 54.5° | 58.8° |
| C10 | C9 | C8 | C14 | 57.2° | 50.5° |
| C9 | C10 | H10B | H10A | 118.7° | 118.9° |
| C9 | C10 | C11 | H11B | 66.1° | 60.7° |
| C9 | C10 | C11 | H11A | 175.0° | 178.3° |
| C10 | C9 | H9B | H9A | 120.0° | 119.4° |
| C10 | C11 | C12 | H11B | 120.5° | 119.5° |
| C10 | C11 | C12 | H11A | 120.5° | 119.6° |
| C10 | C11 | C12 | C13 | 63.5° | 49.8° |
| C10 | C11 | C12 | C14 | 55.1° | 67.7° |
| C10 | C11 | C12 | C17 | 166.2° | 175.6° |
| C11 | C10 | H10B | H10A | 118.7° | 118.9° |
| C10 | C11 | H11B | H11A | 118.3° | 120.9° |
| C11 | C10 | C9 | H9B | 66.7° | 71.7° |
| C11 | C10 | C9 | H9A | 173.2° | 168.9° |
| C11 | C12 | C13 | C14 | 116.2° | 117.0° |
| C11 | C12 | C13 | C17 | 133.3° | 130.9° |
| C11 | C12 | C14 | C17 | 122.9° | 126.0° |
| C11 | C12 | C14 | C15 | 168.4° | 171.6° |
| C11 | C12 | C17 | C16 | 147.2° | 148.9° |
| C11 | C12 | C17 | C18 | 87.5° | 92.2° |
| C11 | C12 | C14 | C8 | 59.7° | 66.4° |
| C12 | C11 | C10 | H10B | 174.9° | 61.6° |
| C12 | C11 | C10 | H10A | 66.0° | 179.6° |
| C11 | C12 | C13 | H13C | 180.0° | 62.8° |
| C11 | C12 | C13 | H13A | 60.0° | 57.2° |
| C11 | C12 | C13 | H13B | 60.0° | 177.2° |
| C11 | C12 | C17 | H17 | 34.0° | 29.9° |
| C12 | C11 | H11B | H11A | 118.4° | 120.8° |
| C11 | C12 | C14 | H14 | 56.4° | 53.5° |
| C13 | C12 | C14 | C17 | 117.9° | 115.9° |
| C13 | C12 | C14 | C15 | 72.4° | 70.3° |
| C13 | C12 | C17 | C16 | 83.1° | 85.2° |
| C13 | C12 | C17 | C18 | 42.2° | 33.6° |
| C13 | C12 | C14 | C8 | 59.5° | 51.7° |
| C12 | C13 | H13C | H13A | 120.0° | 120.0° |
| C12 | C13 | H13C | H13B | 120.0° | 120.0° |
| C12 | C13 | H13A | H13B | 120.0° | 120.1° |
| C13 | C12 | C17 | H17 | 163.7° | 155.8° |
| C13 | C12 | C11 | H11B | 176.0° | 169.3° |
| C13 | C12 | C11 | H11A | 57.0° | 69.8° |
| C13 | C12 | C14 | H14 | 175.7° | 171.6° |
| C12 | C14 | C15 | C8 | 126.8° | 113.9° |
| C12 | C14 | C15 | H14 | 111.8° | 117.9° |
| C12 | C14 | C15 | C16 | 39.7° | 42.3° |
| C14 | C12 | C17 | C16 | 33.1° | 30.1° |
| C14 | C12 | C17 | C18 | 158.4° | 148.9° |
| C12 | C14 | C8 | H14 | 115.8° | 120.0° |
| C14 | C12 | C13 | H13C | 63.8° | 179.8° |
| C14 | C12 | C13 | H13A | 176.2° | 59.8° |
| C14 | C12 | C13 | H13B | 56.2° | 60.2° |
| C12 | C14 | C15 | H15A | 79.2° | 76.0° |
| C12 | C14 | C15 | H15B | 158.7° | 160.6° |
| C14 | C12 | C17 | H17 | 80.1° | 88.9° |
| C14 | C12 | C11 | H11B | 65.5° | 51.8° |
| C14 | C12 | C11 | H11A | 175.6° | 172.7° |
| C14 | C15 | C16 | H15A | 118.9° | 118.3° |
| C14 | C15 | C16 | H15B | 118.9° | 118.3° |
| C14 | C15 | C16 | C17 | 18.3° | 24.3° |
| C15 | C14 | C8 | H14 | 121.3° | 128.5° |
| C15 | C14 | C12 | C17 | 45.5° | 45.6° |
| C14 | C15 | H15A | H15B | 123.2° | 123.3° |
| C14 | C15 | C16 | H16A | 138.0° | 143.4° |
| C14 | C15 | C16 | H16B | 101.4° | 95.0° |
| C15 | C16 | C17 | H16A | 119.7° | 119.1° |
| C15 | C16 | C17 | H16B | 119.7° | 119.3° |
| C15 | C16 | C17 | C18 | 140.4° | 122.6° |
| C16 | C15 | C14 | C8 | 166.5° | 156.3° |
| C15 | C16 | C17 | C12 | 9.7° | 3.8° |
| C16 | C15 | H15A | H15B | 123.2° | 123.3° |
| C15 | C16 | C17 | H17 | 103.5° | 115.1° |
| C16 | C15 | C14 | H14 | 72.1° | 75.5° |
| C15 | C16 | H16A | H16B | 120.8° | 121.6° |
| C16 | C17 | C18 | C12 | 122.4° | 115.3° |
| C16 | C17 | C18 | H17 | 116.2° | 122.5° |
| C16 | C17 | C18 | C19 | 62.3° | 64.6° |
| C16 | C17 | C18 | C20 | 171.4° | 175.4° |
| C16 | C17 | C12 | H17 | 113.2° | 119.0° |
| C17 | C16 | C15 | H15A | 100.6° | 94.0° |
| C17 | C16 | C15 | H15B | 137.2° | 142.6° |
| C17 | C16 | H16A | H16B | 120.8° | 121.6° |
| C16 | C17 | C18 | H18 | 54.3° | 55.4° |
| C17 | C18 | C19 | C20 | 128.3° | 120.0° |
| C17 | C18 | C19 | H18 | 116.4° | 120.0° |
| C17 | C18 | C20 | H18 | 117.1° | 120.0° |
| C17 | C18 | C20 | C21 | 169.3° | 175.0° |
| C18 | C17 | C12 | H17 | 121.5° | 122.2° |
| C17 | C18 | C20 | H20B | 70.3° | 55.0° |
| C17 | C18 | C20 | H20A | 48.8° | 65.0° |
| C18 | C17 | C16 | H16A | 20.6° | 3.4° |
| C18 | C17 | C16 | H16B | 99.9° | 118.1° |
| C17 | C18 | C19 | H19A | 180.0° | 180.0° |
| C17 | C18 | C19 | H19C | 60.0° | 60.0° |
| C17 | C18 | C19 | H19B | 60.0° | 60.0° |
| C19 | C18 | C20 | H18 | 115.3° | 120.0° |
| C19 | C18 | C20 | C21 | 63.1° | 65.0° |
| C19 | C18 | C17 | C12 | 175.4° | 180.0° |
| C19 | C18 | C17 | H17 | 53.9° | 57.8° |
| C19 | C18 | C20 | H20B | 57.4° | 175.0° |
| C19 | C18 | C20 | H20A | 176.4° | 55.0° |
| C18 | C19 | H19A | H19C | 120.0° | 120.0° |
| C18 | C19 | H19A | H19B | 120.0° | 120.0° |
| C18 | C19 | H19C | H19B | 120.0° | 120.0° |
| C18 | C20 | C21 | H20B | 120.4° | 120.0° |
| C18 | C20 | C21 | H20A | 120.5° | 120.0° |
| C18 | C20 | C21 | C22 | 162.0° | 180.0° |
| C20 | C18 | C17 | C12 | 49.0° | 60.0° |
| C20 | C18 | C17 | H17 | 72.4° | 62.2° |
| C18 | C20 | H20B | H20A | 118.6° | 119.9° |
| C18 | C20 | C21 | H21A | 41.4° | 60.0° |
| C18 | C20 | C21 | H21B | 77.4° | 60.0° |
| C20 | C18 | C19 | H19A | 51.7° | 60.0° |
| C20 | C18 | C19 | H19C | 171.7° | 180.0° |
| C20 | C18 | C19 | H19B | 68.3° | 60.0° |
| C20 | C21 | C22 | H21A | 120.6° | 120.0° |
| C20 | C21 | C22 | H21B | 120.6° | 120.0° |
| C20 | C21 | C22 | C23 | 166.5° | 180.0° |
| C21 | C20 | H20B | H20A | 118.6° | 120.1° |
| C20 | C21 | H21A | H21B | 118.1° | 120.0° |
| C20 | C21 | C22 | H22B | 72.6° | 60.0° |
| C20 | C21 | C22 | H22A | 45.6° | 60.0° |
| C21 | C20 | C18 | H18 | 52.2° | 55.0° |
| C21 | C22 | C23 | H22B | 120.9° | 120.0° |
| C21 | C22 | C23 | H22A | 120.9° | 120.0° |
| C21 | C22 | C23 | C24 | 51.2° | 60.0° |
| C21 | C22 | C23 | C25 | 175.0° | 60.0° |
| C21 | C22 | C23 | N26 | 65.6° | 180.0° |
| C22 | C21 | C20 | H20B | 77.6° | 60.0° |
| C22 | C21 | C20 | H20A | 41.5° | 60.0° |
| C22 | C21 | H21A | H21B | 118.0° | 120.0° |
| C21 | C22 | H22B | H22A | 117.3° | 120.0° |
| C22 | C23 | C24 | C25 | 123.5° | 120.0° |
| C22 | C23 | C24 | N26 | 119.0° | 120.0° |
| C22 | C23 | C25 | N26 | 119.8° | 120.0° |
| C22 | C23 | N26 | O27 | 33.1° | 56.1° |
| C22 | C23 | N26 | O28 | 86.4° | 180.0° |
| C23 | C22 | C21 | H21A | 45.9° | 60.0° |
| C23 | C22 | C21 | H21B | 72.9° | 60.0° |
| C23 | C22 | H22B | H22A | 117.3° | 120.0° |
| C22 | C23 | C24 | H24C | 180.0° | 60.0° |
| C22 | C23 | C24 | H24B | 60.0° | 180.0° |
| C22 | C23 | C24 | H24A | 60.0° | 60.0° |
| C22 | C23 | C25 | H25C | 180.0° | 60.0° |
| C22 | C23 | C25 | H25A | 60.0° | 180.0° |
| C22 | C23 | C25 | H25B | 60.0° | 60.0° |
| C24 | C23 | C25 | N26 | 115.6° | 120.0° |
| C24 | C23 | N26 | O27 | 153.8° | 63.9° |
| C24 | C23 | N26 | O28 | 34.4° | 60.0° |
| C24 | C23 | C22 | H22B | 172.1° | 180.0° |
| C24 | C23 | C22 | H22A | 69.6° | 60.0° |
| C23 | C24 | H24C | H24B | 120.0° | 120.0° |
| C23 | C24 | H24C | H24A | 120.0° | 120.0° |
| C23 | C24 | H24B | H24A | 120.0° | 119.9° |
| C24 | C23 | C25 | H25C | 55.5° | 180.0° |
| C24 | C23 | C25 | H25A | 175.4° | 60.0° |
| C24 | C23 | C25 | H25B | 64.5° | 60.0° |
| C25 | C23 | N26 | O27 | 87.4° | 176.1° |
| C25 | C23 | N26 | O28 | 153.2° | 60.0° |
| C25 | C23 | C22 | H22B | 64.2° | 60.0° |
| C25 | C23 | C22 | H22A | 54.1° | 180.0° |
| C25 | C23 | C24 | H24C | 56.5° | 60.0° |
| C25 | C23 | C24 | H24B | 63.5° | 60.0° |
| C25 | C23 | C24 | H24A | 176.4° | 180.0° |
| C23 | C25 | H25C | H25A | 120.0° | 120.0° |
| C23 | C25 | H25C | H25B | 120.0° | 120.0° |
| C23 | C25 | H25A | H25B | 120.0° | 120.0° |
| C23 | N26 | O27 | O28 | 119.9° | 123.9° |
| N26 | C23 | C22 | H22B | 55.2° | 60.0° |
| N26 | C23 | C22 | H22A | 173.5° | 60.0° |
| N26 | C23 | C24 | H24C | 61.0° | 180.0° |
| N26 | C23 | C24 | H24B | 179.0° | 60.0° |
| N26 | C23 | C24 | H24A | 59.0° | 60.0° |
| N26 | C23 | C25 | H25C | 60.2° | 60.0° |
| N26 | C23 | C25 | H25A | 59.8° | 60.0° |
| N26 | C23 | C25 | H25B | 179.8° | 180.0° |
| C23 | N26 | O27 | H3 | 180.0° | 180.0° |
| C23 | N26 | O28 | H28 | 180.0° | 180.0° |
| O27 | N26 | O28 | H28 | 55.8° | 56.1° |
| O28 | N26 | O27 | H3 | 60.0° | 56.1° |
| C5 | C29 | C30 | H29A | 120.4° | 119.8° |
| C5 | C29 | C30 | H29B | 120.4° | 119.7° |
| C5 | C29 | C30 | O31 | 65.6° | 177.8° |
| C5 | C29 | C30 | C32 | 55.0° | 57.6° |
| C29 | C5 | C6 | H6 | 2.8° | 0.0° |
| C5 | C29 | H29A | H29B | 118.6° | 120.5° |
| C5 | C29 | C30 | H30 | 174.3° | 62.4° |
| C29 | C30 | O31 | C32 | 120.7° | 120.4° |
| C29 | C30 | O31 | H30 | 119.4° | 119.8° |
| C29 | C30 | C32 | H30 | 119.2° | 120.0° |
| C29 | C30 | C32 | C2 | 57.7° | 66.0° |
| C30 | C29 | H29A | H29B | 118.6° | 120.5° |
| C29 | C30 | C32 | H32B | 62.5° | 53.9° |
| C29 | C30 | C32 | H32A | 177.8° | 173.7° |
| C29 | C30 | O31 | H31 | 180.0° | 59.9° |
| O31 | C30 | C32 | H30 | 120.5° | 119.8° |
| O31 | C30 | C32 | C2 | 62.6° | 173.9° |
| O31 | C30 | C29 | H29A | 173.9° | 62.4° |
| O31 | C30 | C29 | H29B | 54.8° | 58.1° |
| O31 | C30 | C32 | H32B | 177.2° | 66.2° |
| O31 | C30 | C32 | H32A | 57.6° | 53.5° |
| C30 | C32 | C2 | H32B | 120.2° | 120.0° |
| C30 | C32 | C2 | H32A | 120.2° | 120.3° |
| C30 | C32 | C2 | H2 | 65.3° | 177.2° |
| C32 | C30 | C29 | H29A | 65.5° | 177.4° |
| C32 | C30 | C29 | H29B | 175.4° | 62.0° |
| C30 | C32 | H32B | H32A | 119.5° | 119.8° |
| C32 | C30 | O31 | H31 | 59.3° | 179.7° |
| C2 | C32 | C30 | H30 | 176.9° | 54.0° |
| C2 | C32 | H32B | H32A | 119.5° | 119.8° |
| C32 | C2 | O1 | H1 | 57.7° | 178.8° |
| C8 | C14 | C12 | C17 | 177.4° | 167.7° |
| C14 | C8 | C7 | H7 | 7.4° | 0.3° |
| C8 | C14 | C15 | H15A | 47.6° | 37.9° |
| C8 | C14 | C15 | H15B | 74.6° | 85.5° |
| C14 | C8 | C9 | H9B | 62.8° | 69.8° |
| C14 | C8 | C9 | H9A | 177.1° | 170.8° |
| C17 | C12 | C13 | H13C | 46.7° | 68.1° |
| C17 | C12 | C13 | H13A | 73.3° | 171.9° |
| C17 | C12 | C13 | H13B | 166.7° | 51.9° |
| C17 | C12 | C11 | H11B | 45.7° | 64.9° |
| C17 | C12 | C11 | H11A | 73.3° | 56.0° |
| C17 | C12 | C14 | H14 | 66.5° | 72.5° |
| C12 | C17 | C16 | H16A | 110.1° | 115.4° |
| C12 | C17 | C16 | H16B | 129.4° | 123.1° |
| C12 | C17 | C18 | H18 | 68.1° | 59.9° |
| H6 | C6 | C7 | H7 | 154.3° | 180.0° |
| H10B | C10 | C11 | H11B | 54.3° | 179.0° |
| H10B | C10 | C11 | H11A | 64.6° | 58.0° |
| H10B | C10 | C9 | H9B | 53.7° | 167.8° |
| H10B | C10 | C9 | H9A | 66.3° | 48.4° |
| H10A | C10 | C11 | H11B | 173.5° | 60.1° |
| H10A | C10 | C11 | H11A | 54.6° | 60.9° |
| H10A | C10 | C9 | H9B | 172.8° | 49.0° |
| H10A | C10 | C9 | H9A | 52.8° | 70.4° |
| H13C | C13 | H13A | H13B | 119.9° | 120.0° |
| H15A | C15 | C14 | H14 | 169.0° | 166.1° |
| H15A | C15 | C16 | H16A | 19.1° | 25.0° |
| H15A | C15 | C16 | H16B | 139.7° | 146.6° |
| H15B | C15 | C14 | H14 | 46.8° | 42.8° |
| H15B | C15 | C16 | H16A | 103.1° | 98.3° |
| H15B | C15 | C16 | H16B | 17.5° | 23.3° |
| H17 | C17 | C16 | H16A | 136.8° | 125.8° |
| H17 | C17 | C16 | H16B | 16.3° | 4.2° |
| H17 | C17 | C18 | H18 | 170.4° | 177.9° |
| H20B | C20 | C21 | H21A | 161.8° | 60.0° |
| H20B | C20 | C21 | H21B | 43.0° | 180.0° |
| H20B | C20 | C18 | H18 | 172.6° | 65.0° |
| H20A | C20 | C21 | H21A | 79.1° | 180.0° |
| H20A | C20 | C21 | H21B | 162.1° | 60.0° |
| H20A | C20 | C18 | H18 | 68.3° | 175.0° |
| H21A | C21 | C22 | H22B | 166.7° | 180.0° |
| H21A | C21 | C22 | H22A | 75.0° | 60.0° |
| H21B | C21 | C22 | H22B | 48.0° | 60.0° |
| H21B | C21 | C22 | H22A | 166.3° | 180.0° |
| H24C | C24 | H24B | H24A | 120.0° | 120.0° |
| H18 | C18 | C19 | H19A | 63.6° | 60.0° |
| H18 | C18 | C19 | H19C | 56.4° | 60.0° |
| H18 | C18 | C19 | H19B | 176.5° | 180.0° |
| H19A | C19 | H19C | H19B | 120.0° | 120.0° |
| H2 | C2 | C32 | H32B | 174.5° | 57.1° |
| H2 | C2 | C32 | H32A | 54.8° | 62.5° |
| H2 | C2 | O1 | H1 | 60.3° | 60.6° |
| H25C | C25 | H25A | H25B | 120.0° | 120.0° |
| H29A | C29 | C30 | H30 | 53.8° | 57.4° |
| H29B | C29 | C30 | H30 | 65.3° | 178.0° |
| H30 | C30 | C32 | H32B | 56.7° | 174.0° |
| H30 | C30 | C32 | H32A | 63.0° | 66.3° |
| H30 | C30 | O31 | H31 | 60.6° | 59.9° |
