KX2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.46Å | 1.45Å | |
| N1 | C1 | sing | 1.35Å | 1.34Å | |
| C1 | O1 | doub | 1.21Å | 1.21Å | |
| C20 | N1 | sing | 1.40Å | 1.41Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| C22 | C2 | sing | 1.50Å | 1.49Å | |
| C3 | C2 | doub | 1.35Å | 1.35Å | |
| C24 | N2 | sing | 1.35Å | 1.32Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N2 | HN2A | sing | 0.97Å | 1.00Å | |
| C6 | O2 | sing | 1.43Å | 1.45Å | |
| O2 | C23 | sing | 1.43Å | 1.45Å | |
| C4 | C3 | sing | 1.45Å | 1.46Å | |
| C3 | H3 | sing | 1.09Å | 1.08Å | |
| C7 | O3 | sing | 1.45Å | 1.42Å | |
| C24 | O3 | sing | 1.35Å | 1.43Å | |
| C5 | C4 | doub | 1.33Å | 1.34Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| O4 | C24 | doub | 1.21Å | 1.22Å | |
| C5 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | H5 | sing | 1.09Å | 1.08Å | |
| O5 | C11 | sing | 1.43Å | 1.42Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C7 | C6 | sing | 1.53Å | 1.51Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C27 | O6 | sing | 1.43Å | 1.44Å | |
| O6 | C12 | sing | 1.43Å | 1.43Å | |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | C8 | doub | 1.31Å | 1.34Å | |
| C8 | C25 | sing | 1.51Å | 1.50Å | |
| C18 | O8 | doub | 1.22Å | 1.26Å | |
| C10 | C9 | sing | 1.50Å | 1.52Å | |
| C9 | H9 | sing | 1.09Å | 1.08Å | |
| O9 | C21 | doub | 1.22Å | 1.25Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C26 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.52Å | 1.53Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.08Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C14 | C28 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.50Å | 1.53Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | C17 | doub | 1.35Å | 1.49Å | |
| C16 | C21 | sing | 1.43Å | 1.49Å | |
| N29 | C17 | sing | 1.37Å | 1.34Å | |
| C17 | C18 | sing | 1.49Å | 1.48Å | |
| C18 | C19 | sing | 1.47Å | 1.39Å | |
| C20 | C19 | doub | 1.35Å | 1.38Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C21 | C20 | sing | 1.48Å | 1.50Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C23 | H23B | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C26 | H26B | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| N29 | C30 | sing | 1.47Å | 1.46Å | |
| N29 | HN29 | sing | 0.97Å | 1.00Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| N32 | C31 | sing | 1.47Å | 1.46Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C33 | N32 | sing | 1.48Å | 1.46Å | |
| N32 | C36 | sing | 1.47Å | 1.47Å | |
| C34 | C33 | sing | 1.55Å | 1.53Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C34 | C35 | sing | 1.55Å | 1.53Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C35 | C36 | sing | 1.54Å | 1.53Å | |
| 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 |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N1 | 120.9° | 121.1° |
| C2 | C1 | O1 | 116.8° | 118.5° |
| C1 | C2 | C22 | 119.0° | 120.5° |
| C1 | C2 | C3 | 117.1° | 118.6° |
| N1 | C1 | O1 | 122.3° | 120.5° |
| C1 | N1 | C20 | 128.5° | 116.4° |
| C1 | N1 | HN1 | 115.7° | 123.3° |
| C20 | N1 | HN1 | 115.8° | 120.3° |
| N1 | C20 | C19 | 116.7° | 118.9° |
| N1 | C20 | C21 | 123.8° | 120.9° |
| C22 | C2 | C3 | 123.8° | 120.9° |
| C2 | C22 | H22 | 109.5° | 109.5° |
| C2 | C22 | H22A | 109.5° | 109.5° |
| C2 | C22 | H22B | 109.5° | 109.5° |
| C2 | C3 | C4 | 123.8° | 122.6° |
| C2 | C3 | H3 | 118.1° | 118.0° |
| C24 | N2 | HN2 | 120.0° | 120.0° |
| C24 | N2 | HN2A | 120.0° | 120.0° |
| N2 | C24 | O3 | 116.8° | 120.0° |
| N2 | C24 | O4 | 123.6° | 120.0° |
| HN2 | N2 | HN2A | 120.0° | 120.0° |
| C6 | O2 | C23 | 116.8° | 114.0° |
| O2 | C6 | C5 | 108.8° | 110.4° |
| O2 | C6 | C7 | 108.7° | 109.2° |
| O2 | C6 | H6 | 111.5° | 109.5° |
| O2 | C23 | H23 | 109.5° | 109.4° |
| O2 | C23 | H23A | 109.5° | 109.5° |
| O2 | C23 | H23B | 109.4° | 109.5° |
| C4 | C3 | H3 | 118.1° | 119.4° |
| C3 | C4 | C5 | 122.3° | 121.4° |
| C3 | C4 | H4 | 118.8° | 120.7° |
| C7 | O3 | C24 | 114.7° | 117.0° |
| O3 | C7 | C6 | 104.8° | 109.4° |
| O3 | C7 | C8 | 107.4° | 109.3° |
| O3 | C7 | H7 | 114.6° | 109.3° |
| O3 | C24 | O4 | 119.6° | 120.0° |
| C5 | C4 | H4 | 118.8° | 117.8° |
| C4 | C5 | C6 | 121.4° | 122.8° |
| C4 | C5 | H5 | 119.3° | 118.5° |
| C6 | C5 | H5 | 119.3° | 118.7° |
| C5 | C6 | C7 | 112.5° | 109.0° |
| C5 | C6 | H6 | 107.7° | 109.6° |
| C11 | O5 | HO5 | 109.5° | 114.0° |
| O5 | C11 | C10 | 108.6° | 108.3° |
| O5 | C11 | C12 | 111.5° | 110.2° |
| O5 | C11 | H11 | 110.4° | 108.7° |
| C7 | C6 | H6 | 107.7° | 109.1° |
| C6 | C7 | C8 | 111.9° | 110.6° |
| C6 | C7 | H7 | 110.4° | 109.1° |
| C27 | O6 | C12 | 112.5° | 114.0° |
| O6 | C27 | H27 | 109.5° | 109.4° |
| O6 | C27 | H27A | 109.4° | 109.5° |
| O6 | C27 | H27B | 109.4° | 109.5° |
| O6 | C12 | C11 | 106.0° | 109.6° |
| O6 | C12 | C13 | 114.1° | 107.8° |
| O6 | C12 | H12 | 109.7° | 109.2° |
| C8 | C7 | H7 | 107.8° | 109.1° |
| C7 | C8 | C9 | 120.6° | 119.7° |
| C7 | C8 | C25 | 116.9° | 118.8° |
| C9 | C8 | C25 | 122.5° | 121.5° |
| C8 | C9 | C10 | 122.5° | 123.5° |
| C8 | C9 | H9 | 118.7° | 118.4° |
| C8 | C25 | H25 | 109.5° | 109.4° |
| C8 | C25 | H25A | 109.5° | 109.5° |
| C8 | C25 | H25B | 109.5° | 109.5° |
| O8 | C18 | C17 | 120.0° | 120.1° |
| O8 | C18 | C19 | 118.9° | 120.3° |
| C10 | C9 | H9 | 118.8° | 118.1° |
| C9 | C10 | C11 | 111.1° | 109.1° |
| C9 | C10 | C26 | 109.5° | 110.5° |
| C9 | C10 | H10 | 107.8° | 109.7° |
| O9 | C21 | C16 | 119.6° | 118.2° |
| O9 | C21 | C20 | 120.8° | 120.9° |
| C11 | C10 | C26 | 108.0° | 110.4° |
| C11 | C10 | H10 | 109.4° | 108.0° |
| C10 | C11 | C12 | 114.1° | 111.3° |
| C10 | C11 | H11 | 107.6° | 108.8° |
| C26 | C10 | H10 | 111.0° | 109.1° |
| C10 | C26 | H26 | 109.5° | 109.4° |
| C10 | C26 | H26A | 109.5° | 109.5° |
| C10 | C26 | H26B | 109.4° | 109.5° |
| C12 | C11 | H11 | 104.4° | 109.5° |
| C11 | C12 | C13 | 112.2° | 111.0° |
| C11 | C12 | H12 | 111.8° | 110.4° |
| C13 | C12 | H12 | 103.2° | 108.9° |
| C12 | C13 | C14 | 116.3° | 109.3° |
| C12 | C13 | H13 | 107.3° | 108.8° |
| C12 | C13 | H13A | 107.3° | 111.2° |
| C14 | C13 | H13 | 107.2° | 108.8° |
| C14 | C13 | H13A | 107.2° | 109.8° |
| C13 | C14 | C15 | 113.1° | 109.8° |
| C13 | C14 | C28 | 111.6° | 109.0° |
| C13 | C14 | H14 | 105.7° | 109.4° |
| H13 | C13 | H13A | 111.6° | 108.8° |
| C15 | C14 | C28 | 110.2° | 109.7° |
| C15 | C14 | H14 | 107.1° | 109.6° |
| C14 | C15 | C16 | 111.0° | 109.8° |
| C14 | C15 | H15 | 109.0° | 109.0° |
| C14 | C15 | H15A | 109.0° | 109.4° |
| C28 | C14 | H14 | 108.8° | 109.4° |
| C14 | C28 | H28 | 109.5° | 109.4° |
| C14 | C28 | H28A | 109.5° | 109.5° |
| C14 | C28 | H28B | 109.5° | 109.5° |
| C16 | C15 | H15 | 108.9° | 109.0° |
| C16 | C15 | H15A | 109.0° | 110.9° |
| C15 | C16 | C17 | 120.7° | 121.4° |
| C15 | C16 | C21 | 121.5° | 118.5° |
| H15 | C15 | H15A | 110.0° | 108.7° |
| C17 | C16 | C21 | 117.7° | 120.1° |
| C16 | C17 | N29 | 119.1° | 121.0° |
| C16 | C17 | C18 | 118.6° | 120.0° |
| C16 | C21 | C20 | 119.6° | 120.8° |
| N29 | C17 | C18 | 121.4° | 119.0° |
| C17 | N29 | C30 | 118.0° | 120.0° |
| C17 | N29 | HN29 | 106.7° | 120.0° |
| C17 | C18 | C19 | 121.1° | 119.6° |
| C18 | C19 | C20 | 123.6° | 119.2° |
| C18 | C19 | H19 | 118.2° | 120.6° |
| C20 | C19 | H19 | 118.2° | 120.2° |
| C19 | C20 | C21 | 119.4° | 120.3° |
| H22 | C22 | H22A | 109.4° | 109.5° |
| H22 | C22 | H22B | 109.5° | 109.4° |
| H22A | C22 | H22B | 109.5° | 109.5° |
| H23 | C23 | H23A | 109.4° | 109.5° |
| H23 | C23 | H23B | 109.4° | 109.5° |
| H23A | C23 | H23B | 109.5° | 109.5° |
| H25 | C25 | H25A | 109.4° | 109.6° |
| H25 | C25 | H25B | 109.5° | 109.4° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H26 | C26 | H26A | 109.5° | 109.4° |
| H26 | C26 | H26B | 109.5° | 109.5° |
| H26A | C26 | H26B | 109.5° | 109.4° |
| H27 | C27 | H27A | 109.5° | 109.5° |
| H27 | C27 | H27B | 109.5° | 109.5° |
| H27A | C27 | H27B | 109.5° | 109.5° |
| H28 | C28 | H28A | 109.4° | 109.5° |
| H28 | C28 | H28B | 109.5° | 109.5° |
| H28A | C28 | H28B | 109.5° | 109.5° |
| C30 | N29 | HN29 | 106.7° | 120.0° |
| N29 | C30 | C31 | 109.0° | 109.4° |
| N29 | C30 | H30 | 109.6° | 109.5° |
| N29 | C30 | H30A | 109.6° | 109.5° |
| C31 | C30 | H30 | 109.6° | 109.5° |
| C31 | C30 | H30A | 109.6° | 109.5° |
| C30 | C31 | N32 | 113.6° | 109.4° |
| C30 | C31 | H31 | 108.1° | 109.5° |
| C30 | C31 | H31A | 108.1° | 109.5° |
| H30 | C30 | H30A | 109.3° | 109.5° |
| N32 | C31 | H31 | 108.1° | 109.4° |
| N32 | C31 | H31A | 108.1° | 109.5° |
| C31 | N32 | C33 | 122.9° | 111.0° |
| C31 | N32 | C36 | 120.4° | 111.0° |
| H31 | C31 | H31A | 110.8° | 109.5° |
| C33 | N32 | C36 | 116.6° | 108.6° |
| N32 | C33 | C34 | 101.7° | 104.8° |
| N32 | C33 | H33 | 112.2° | 110.4° |
| N32 | C33 | H33A | 112.1° | 110.4° |
| N32 | C36 | C35 | 101.5° | 107.2° |
| N32 | C36 | H36 | 112.2° | 109.9° |
| N32 | C36 | H36A | 112.2° | 109.9° |
| C34 | C33 | H33 | 112.1° | 110.3° |
| C34 | C33 | H33A | 112.2° | 110.5° |
| C33 | C34 | C35 | 108.1° | 101.7° |
| C33 | C34 | H34 | 109.9° | 111.0° |
| C33 | C34 | H34A | 109.9° | 111.0° |
| H33 | C33 | H33A | 106.7° | 110.3° |
| C35 | C34 | H34 | 109.9° | 111.0° |
| C35 | C34 | H34A | 109.9° | 111.0° |
| C34 | C35 | C36 | 108.7° | 103.0° |
| C34 | C35 | H35 | 109.8° | 110.7° |
| C34 | C35 | H35A | 109.8° | 110.7° |
| H34 | C34 | H34A | 109.0° | 110.9° |
| C36 | C35 | H35 | 109.7° | 110.7° |
| C36 | C35 | H35A | 109.7° | 110.7° |
| C35 | C36 | H36 | 112.2° | 109.9° |
| C35 | C36 | H36A | 112.2° | 109.9° |
| H35 | C35 | H35A | 109.2° | 110.8° |
| H36 | C36 | H36A | 106.6° | 110.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N1 | O1 | 176.8° | 179.4° |
| C2 | C1 | N1 | C20 | 2.6° | 111.8° |
| C2 | C1 | N1 | HN1 | 177.4° | 66.8° |
| C1 | C2 | C22 | C3 | 178.0° | 179.8° |
| C1 | C2 | C3 | C4 | 179.1° | 179.4° |
| C1 | C2 | C3 | H3 | 0.9° | 0.4° |
| C1 | C2 | C22 | H22 | 180.0° | 90.0° |
| C1 | C2 | C22 | H22A | 60.0° | 150.0° |
| C1 | C2 | C22 | H22B | 60.0° | 30.0° |
| C1 | N1 | C20 | HN1 | 180.0° | 178.7° |
| N1 | C1 | C2 | C22 | 115.5° | 5.1° |
| N1 | C1 | C2 | C3 | 66.4° | 174.7° |
| C1 | N1 | C20 | C19 | 127.8° | 175.8° |
| C1 | N1 | C20 | C21 | 54.0° | 4.7° |
| O1 | C1 | N1 | C20 | 179.5° | 67.6° |
| O1 | C1 | N1 | HN1 | 0.5° | 113.8° |
| O1 | C1 | C2 | C22 | 67.5° | 175.5° |
| O1 | C1 | C2 | C3 | 110.6° | 4.7° |
| N1 | C20 | C21 | O9 | 1.7° | 0.5° |
| N1 | C20 | C21 | C16 | 179.3° | 179.6° |
| N1 | C20 | C19 | C18 | 179.4° | 179.7° |
| N1 | C20 | C19 | C21 | 178.3° | 179.5° |
| N1 | C20 | C19 | H19 | 0.6° | 0.4° |
| HN1 | N1 | C20 | C19 | 52.2° | 5.5° |
| HN1 | N1 | C20 | C21 | 126.0° | 174.0° |
| C22 | C2 | C3 | C4 | 1.1° | 0.8° |
| C22 | C2 | C3 | H3 | 178.9° | 179.8° |
| C2 | C22 | H22 | H22A | 120.0° | 120.0° |
| C2 | C22 | H22 | H22B | 120.0° | 120.0° |
| C2 | C22 | H22A | H22B | 120.0° | 120.0° |
| C2 | C3 | C4 | H3 | 180.0° | 179.0° |
| C2 | C3 | C4 | C5 | 179.3° | 137.0° |
| C2 | C3 | C4 | H4 | 0.7° | 40.1° |
| C3 | C2 | C22 | H22 | 2.0° | 89.8° |
| C3 | C2 | C22 | H22A | 122.0° | 30.2° |
| C3 | C2 | C22 | H22B | 118.0° | 150.3° |
| C24 | N2 | HN2 | HN2A | 180.0° | 179.9° |
| N2 | C24 | O3 | C7 | 153.2° | 180.0° |
| N2 | C24 | O3 | O4 | 179.9° | 179.9° |
| HN2 | N2 | C24 | O3 | 179.9° | 180.0° |
| HN2 | N2 | C24 | O4 | 0.0° | 0.1° |
| HN2A | N2 | C24 | O3 | 0.0° | 0.1° |
| HN2A | N2 | C24 | O4 | 180.0° | 180.0° |
| O2 | C6 | C7 | O3 | 37.9° | 65.0° |
| O2 | C6 | C5 | C4 | 86.1° | 28.7° |
| O2 | C6 | C5 | C7 | 120.5° | 119.9° |
| O2 | C6 | C5 | H6 | 121.0° | 120.7° |
| O2 | C6 | C5 | H5 | 93.8° | 151.3° |
| O2 | C6 | C7 | H6 | 121.0° | 119.7° |
| O2 | C6 | C7 | C8 | 154.0° | 55.4° |
| O2 | C6 | C7 | H7 | 86.0° | 175.4° |
| C6 | O2 | C23 | H23 | 180.0° | 54.6° |
| C6 | O2 | C23 | H23A | 60.0° | 174.6° |
| C6 | O2 | C23 | H23B | 60.0° | 65.4° |
| C23 | O2 | C6 | C5 | 55.7° | 130.6° |
| C23 | O2 | C6 | C7 | 67.1° | 109.5° |
| C23 | O2 | C6 | H6 | 174.3° | 9.9° |
| O2 | C23 | H23 | H23A | 120.0° | 119.9° |
| O2 | C23 | H23 | H23B | 120.0° | 120.0° |
| O2 | C23 | H23A | H23B | 120.0° | 120.0° |
| C3 | C4 | C5 | H4 | 180.0° | 177.2° |
| C3 | C4 | C5 | C6 | 0.2° | 1.1° |
| C3 | C4 | C5 | H5 | 179.9° | 178.9° |
| H3 | C3 | C4 | C5 | 0.7° | 44.0° |
| H3 | C3 | C4 | H4 | 179.3° | 138.9° |
| C7 | O3 | C24 | O4 | 26.9° | 0.1° |
| O3 | C7 | C6 | C5 | 158.4° | 55.7° |
| O3 | C7 | C6 | C8 | 116.1° | 120.5° |
| O3 | C7 | C6 | H7 | 123.9° | 119.6° |
| O3 | C7 | C6 | H6 | 83.1° | 175.3° |
| O3 | C7 | C8 | H7 | 124.0° | 119.5° |
| O3 | C7 | C8 | C9 | 131.7° | 52.0° |
| O3 | C7 | C8 | C25 | 47.0° | 127.2° |
| C24 | O3 | C7 | C6 | 151.4° | 150.0° |
| C24 | O3 | C7 | C8 | 89.5° | 88.8° |
| C24 | O3 | C7 | H7 | 30.3° | 30.6° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 153.3° | 148.7° |
| C4 | C5 | C6 | H6 | 34.9° | 92.0° |
| H4 | C4 | C5 | C6 | 179.8° | 176.1° |
| H4 | C4 | C5 | H5 | 0.2° | 3.9° |
| C5 | C6 | C7 | H6 | 118.5° | 119.6° |
| C5 | C6 | C7 | C8 | 85.5° | 176.1° |
| C5 | C6 | C7 | H7 | 34.5° | 63.9° |
| H5 | C5 | C6 | C7 | 26.7° | 31.3° |
| H5 | C5 | C6 | H6 | 145.2° | 88.0° |
| O5 | C11 | C12 | O6 | 82.1° | 151.0° |
| O5 | C11 | C10 | C9 | 177.2° | 45.4° |
| O5 | C11 | C10 | C12 | 125.1° | 121.3° |
| O5 | C11 | C10 | H11 | 119.5° | 118.0° |
| O5 | C11 | C10 | C26 | 57.1° | 166.9° |
| O5 | C11 | C10 | H10 | 63.8° | 73.8° |
| O5 | C11 | C12 | H11 | 119.3° | 119.4° |
| O5 | C11 | C12 | C13 | 43.0° | 32.0° |
| O5 | C11 | C12 | H12 | 158.4° | 88.8° |
| HO5 | O5 | C11 | C10 | 180.0° | 60.0° |
| HO5 | O5 | C11 | C12 | 53.4° | 178.1° |
| HO5 | O5 | C11 | H11 | 62.2° | 58.1° |
| C6 | C7 | C8 | H7 | 121.5° | 120.0° |
| C6 | C7 | C8 | C9 | 113.9° | 68.4° |
| C6 | C7 | C8 | C25 | 67.4° | 112.3° |
| H6 | C6 | C7 | C8 | 33.0° | 64.2° |
| H6 | C6 | C7 | H7 | 153.0° | 55.7° |
| C27 | O6 | C12 | C11 | 76.2° | 142.5° |
| C27 | O6 | C12 | C13 | 47.8° | 96.6° |
| C27 | O6 | C12 | H12 | 163.0° | 21.5° |
| O6 | C27 | H27 | H27A | 120.0° | 120.0° |
| O6 | C27 | H27 | H27B | 120.0° | 120.0° |
| O6 | C27 | H27A | H27B | 120.0° | 120.0° |
| O6 | C12 | C11 | C10 | 154.3° | 88.8° |
| O6 | C12 | C11 | C13 | 125.2° | 119.0° |
| O6 | C12 | C11 | H12 | 119.5° | 120.2° |
| O6 | C12 | C11 | H11 | 37.1° | 31.6° |
| O6 | C12 | C13 | H12 | 119.0° | 118.3° |
| O6 | C12 | C13 | C14 | 54.6° | 113.6° |
| O6 | C12 | C13 | H13 | 65.4° | 5.1° |
| O6 | C12 | C13 | H13A | 174.6° | 124.9° |
| C12 | O6 | C27 | H27 | 180.0° | 69.0° |
| C12 | O6 | C27 | H27A | 60.0° | 51.0° |
| C12 | O6 | C27 | H27B | 60.0° | 171.0° |
| C7 | C8 | C9 | C25 | 178.6° | 179.2° |
| C7 | C8 | C9 | C10 | 179.6° | 179.2° |
| C7 | C8 | C9 | H9 | 0.4° | 0.0° |
| C7 | C8 | C25 | H25 | 180.0° | 89.9° |
| C7 | C8 | C25 | H25A | 60.0° | 150.0° |
| C7 | C8 | C25 | H25B | 60.0° | 30.0° |
| H7 | C7 | C8 | C9 | 7.7° | 171.6° |
| H7 | C7 | C8 | C25 | 171.0° | 7.7° |
| C8 | C9 | C10 | H9 | 180.0° | 179.2° |
| C8 | C9 | C10 | C11 | 138.6° | 159.2° |
| C8 | C9 | C10 | C26 | 102.2° | 79.3° |
| C8 | C9 | C10 | H10 | 18.7° | 41.1° |
| C9 | C8 | C25 | H25 | 1.3° | 89.3° |
| C9 | C8 | C25 | H25A | 118.6° | 30.8° |
| C9 | C8 | C25 | H25B | 121.4° | 150.8° |
| C25 | C8 | C9 | C10 | 1.0° | 0.0° |
| C25 | C8 | C9 | H9 | 179.0° | 179.2° |
| C8 | C25 | H25 | H25A | 120.0° | 120.1° |
| C8 | C25 | H25 | H25B | 120.0° | 119.9° |
| C8 | C25 | H25A | H25B | 120.0° | 120.0° |
| O8 | C18 | C17 | C16 | 178.4° | 179.3° |
| O8 | C18 | C17 | N29 | 9.3° | 0.8° |
| O8 | C18 | C17 | C19 | 179.0° | 179.9° |
| O8 | C18 | C19 | C20 | 179.8° | 179.9° |
| O8 | C18 | C19 | H19 | 0.2° | 0.2° |
| C9 | C10 | C11 | C26 | 120.1° | 121.6° |
| C9 | C10 | C11 | H10 | 119.0° | 119.2° |
| C9 | C10 | C26 | H10 | 119.0° | 120.7° |
| C9 | C10 | C11 | C12 | 57.7° | 75.9° |
| C9 | C10 | C11 | H11 | 57.7° | 163.3° |
| C9 | C10 | C26 | H26 | 180.0° | 60.0° |
| C9 | C10 | C26 | H26A | 60.0° | 180.0° |
| C9 | C10 | C26 | H26B | 60.0° | 60.0° |
| H9 | C9 | C10 | C11 | 41.4° | 20.0° |
| H9 | C9 | C10 | C26 | 77.8° | 101.5° |
| H9 | C9 | C10 | H10 | 161.3° | 138.1° |
| O9 | C21 | C16 | C15 | 0.6° | 0.8° |
| O9 | C21 | C16 | C17 | 178.4° | 179.7° |
| O9 | C21 | C16 | C20 | 179.0° | 179.9° |
| O9 | C21 | C20 | C19 | 179.8° | 179.0° |
| C11 | C10 | C26 | H10 | 119.9° | 118.6° |
| C10 | C11 | C12 | H11 | 117.2° | 120.4° |
| C10 | C11 | C12 | C13 | 80.5° | 152.2° |
| C10 | C11 | C12 | H12 | 34.9° | 31.4° |
| C11 | C10 | C26 | H26 | 58.9° | 179.2° |
| C11 | C10 | C26 | H26A | 61.1° | 59.3° |
| C11 | C10 | C26 | H26B | 178.8° | 60.7° |
| C26 | C10 | C11 | C12 | 177.8° | 45.6° |
| C26 | C10 | C11 | H11 | 62.5° | 75.1° |
| C10 | C26 | H26 | H26A | 120.0° | 120.0° |
| C10 | C26 | H26 | H26B | 120.0° | 120.1° |
| C10 | C26 | H26A | H26B | 120.0° | 120.0° |
| H10 | C10 | C11 | C12 | 61.3° | 164.9° |
| H10 | C10 | C11 | H11 | 176.6° | 44.1° |
| H10 | C10 | C26 | H26 | 61.0° | 60.7° |
| H10 | C10 | C26 | H26A | 179.0° | 59.3° |
| H10 | C10 | C26 | H26B | 58.9° | 179.2° |
| C11 | C12 | C13 | H12 | 120.5° | 121.7° |
| C11 | C12 | C13 | C14 | 175.1° | 126.4° |
| C11 | C12 | C13 | H13 | 55.1° | 114.9° |
| C11 | C12 | C13 | H13A | 64.9° | 4.9° |
| H11 | C11 | C12 | C13 | 162.3° | 87.4° |
| H11 | C11 | C12 | H12 | 82.4° | 151.8° |
| C12 | C13 | C14 | H13 | 120.0° | 118.7° |
| C12 | C13 | C14 | H13A | 120.0° | 122.3° |
| C12 | C13 | H13 | H13A | 117.2° | 121.3° |
| C12 | C13 | C14 | C15 | 161.2° | 88.5° |
| C12 | C13 | C14 | C28 | 36.3° | 151.3° |
| C12 | C13 | C14 | H14 | 81.9° | 31.7° |
| H12 | C12 | C13 | C14 | 64.4° | 4.7° |
| H12 | C12 | C13 | H13 | 175.6° | 123.4° |
| H12 | C12 | C13 | H13A | 55.6° | 116.8° |
| C14 | C13 | H13 | H13A | 117.2° | 119.7° |
| C13 | C14 | C15 | C28 | 125.7° | 119.7° |
| C13 | C14 | C15 | H14 | 116.1° | 120.1° |
| C13 | C14 | C28 | H14 | 116.2° | 119.6° |
| C13 | C14 | C15 | C16 | 69.3° | 175.6° |
| C13 | C14 | C15 | H15 | 170.7° | 65.0° |
| C13 | C14 | C15 | H15A | 50.8° | 53.7° |
| C13 | C14 | C28 | H28 | 180.0° | 60.0° |
| C13 | C14 | C28 | H28A | 60.0° | 180.0° |
| C13 | C14 | C28 | H28B | 60.0° | 60.0° |
| H13 | C13 | C14 | C15 | 78.8° | 30.2° |
| H13 | C13 | C14 | C28 | 156.3° | 90.0° |
| H13 | C13 | C14 | H14 | 38.2° | 150.4° |
| H13A | C13 | C14 | C15 | 41.2° | 149.2° |
| H13A | C13 | C14 | C28 | 83.7° | 29.0° |
| H13A | C13 | C14 | H14 | 158.1° | 90.6° |
| C15 | C14 | C28 | H14 | 117.2° | 120.2° |
| C14 | C15 | C16 | H15 | 120.0° | 119.3° |
| C14 | C15 | C16 | H15A | 120.0° | 121.0° |
| C14 | C15 | H15 | H15A | 119.4° | 119.2° |
| C14 | C15 | C16 | C17 | 90.2° | 115.9° |
| C14 | C15 | C16 | C21 | 87.5° | 64.6° |
| C15 | C14 | C28 | H28 | 53.5° | 179.8° |
| C15 | C14 | C28 | H28A | 66.5° | 59.8° |
| C15 | C14 | C28 | H28B | 173.5° | 60.2° |
| C28 | C14 | C15 | C16 | 56.4° | 55.9° |
| C28 | C14 | C15 | H15 | 63.6° | 175.2° |
| C28 | C14 | C15 | H15A | 176.4° | 66.1° |
| C14 | C28 | H28 | H28A | 120.0° | 120.0° |
| C14 | C28 | H28 | H28B | 120.0° | 120.0° |
| C14 | C28 | H28A | H28B | 120.0° | 120.0° |
| H14 | C14 | C15 | C16 | 174.7° | 64.3° |
| H14 | C14 | C15 | H15 | 54.7° | 55.1° |
| H14 | C14 | C15 | H15A | 65.3° | 173.8° |
| H14 | C14 | C28 | H28 | 63.8° | 59.5° |
| H14 | C14 | C28 | H28A | 176.3° | 60.4° |
| H14 | C14 | C28 | H28B | 56.3° | 179.5° |
| C16 | C15 | H15 | H15A | 119.4° | 121.0° |
| C15 | C16 | C17 | C21 | 177.8° | 179.4° |
| C15 | C16 | C17 | N29 | 10.5° | 0.2° |
| C15 | C16 | C17 | C18 | 179.8° | 179.9° |
| C15 | C16 | C21 | C20 | 178.4° | 179.3° |
| H15 | C15 | C16 | C17 | 149.8° | 124.7° |
| H15 | C15 | C16 | C21 | 32.6° | 54.7° |
| H15A | C15 | C16 | C17 | 29.8° | 5.1° |
| H15A | C15 | C16 | C21 | 152.5° | 174.3° |
| C16 | C17 | N29 | C18 | 169.0° | 179.9° |
| C16 | C17 | C18 | C19 | 2.6° | 0.8° |
| C17 | C16 | C21 | C20 | 0.6° | 0.2° |
| C16 | C17 | N29 | C30 | 130.6° | 179.9° |
| C16 | C17 | N29 | HN29 | 10.6° | 0.0° |
| C21 | C16 | C17 | N29 | 171.7° | 179.3° |
| C21 | C16 | C17 | C18 | 2.4° | 0.6° |
| C16 | C21 | C20 | C19 | 1.2° | 0.9° |
| N29 | C17 | C18 | C19 | 171.7° | 179.1° |
| C17 | N29 | C30 | HN29 | 120.0° | 180.0° |
| C17 | N29 | C30 | C31 | 51.0° | 180.0° |
| C17 | N29 | C30 | H30 | 171.0° | 60.0° |
| C17 | N29 | C30 | H30A | 69.1° | 60.0° |
| C17 | C18 | C19 | C20 | 0.8° | 0.0° |
| C17 | C18 | C19 | H19 | 179.2° | 179.9° |
| C18 | C17 | N29 | C30 | 38.4° | 0.1° |
| C18 | C17 | N29 | HN29 | 158.4° | 179.9° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 1.1° | 0.8° |
| H19 | C19 | C20 | C21 | 178.9° | 179.1° |
| H22 | C22 | H22A | H22B | 120.0° | 120.0° |
| H23 | C23 | H23A | H23B | 120.0° | 120.1° |
| H25 | C25 | H25A | H25B | 120.0° | 120.0° |
| H26 | C26 | H26A | H26B | 120.0° | 120.0° |
| H27 | C27 | H27A | H27B | 120.0° | 120.0° |
| H28 | C28 | H28A | H28B | 120.0° | 120.0° |
| N29 | C30 | C31 | H30 | 120.0° | 120.0° |
| N29 | C30 | C31 | H30A | 120.0° | 120.0° |
| N29 | C30 | H30 | H30A | 120.2° | 120.0° |
| N29 | C30 | C31 | N32 | 152.4° | 180.0° |
| N29 | C30 | C31 | H31 | 87.6° | 60.1° |
| N29 | C30 | C31 | H31A | 32.4° | 60.0° |
| HN29 | N29 | C30 | C31 | 69.1° | 0.0° |
| HN29 | N29 | C30 | H30 | 50.9° | 120.0° |
| HN29 | N29 | C30 | H30A | 170.9° | 120.0° |
| C31 | C30 | H30 | H30A | 120.2° | 120.0° |
| C30 | C31 | N32 | H31 | 120.0° | 120.0° |
| C30 | C31 | N32 | H31A | 120.0° | 120.0° |
| C30 | C31 | H31 | H31A | 118.3° | 120.0° |
| C30 | C31 | N32 | C33 | 54.9° | 69.2° |
| C30 | C31 | N32 | C36 | 129.5° | 170.0° |
| H30 | C30 | C31 | N32 | 32.3° | 60.0° |
| H30 | C30 | C31 | H31 | 152.3° | 179.9° |
| H30 | C30 | C31 | H31A | 87.6° | 60.0° |
| H30A | C30 | C31 | N32 | 87.6° | 60.0° |
| H30A | C30 | C31 | H31 | 32.4° | 59.9° |
| H30A | C30 | C31 | H31A | 152.4° | 180.0° |
| N32 | C31 | H31 | H31A | 118.3° | 120.0° |
| C31 | N32 | C33 | C36 | 175.8° | 122.2° |
| C31 | N32 | C33 | C34 | 156.0° | 146.3° |
| C31 | N32 | C33 | H33 | 36.0° | 27.5° |
| C31 | N32 | C33 | H33A | 84.0° | 94.7° |
| C31 | N32 | C36 | C35 | 157.9° | 123.3° |
| C31 | N32 | C36 | H36 | 82.1° | 117.4° |
| C31 | N32 | C36 | H36A | 37.9° | 3.8° |
| H31 | C31 | N32 | C33 | 174.9° | 170.8° |
| H31 | C31 | N32 | C36 | 9.5° | 50.0° |
| H31A | C31 | N32 | C33 | 65.0° | 50.8° |
| H31A | C31 | N32 | C36 | 110.6° | 70.0° |
| N32 | C33 | C34 | H33 | 120.0° | 118.9° |
| N32 | C33 | C34 | H33A | 120.0° | 118.9° |
| N32 | C33 | H33 | H33A | 123.1° | 122.3° |
| N32 | C33 | C34 | C35 | 12.6° | 37.0° |
| N32 | C33 | C34 | H34 | 107.4° | 155.2° |
| N32 | C33 | C34 | H34A | 132.6° | 81.0° |
| C33 | N32 | C36 | C35 | 18.0° | 1.0° |
| C33 | N32 | C36 | H36 | 102.0° | 120.4° |
| C33 | N32 | C36 | H36A | 138.0° | 118.4° |
| C36 | N32 | C33 | C34 | 19.8° | 24.1° |
| C36 | N32 | C33 | H33 | 139.8° | 94.8° |
| C36 | N32 | C33 | H33A | 100.2° | 143.0° |
| N32 | C36 | C35 | C34 | 8.1° | 22.3° |
| N32 | C36 | C35 | H36 | 120.0° | 119.4° |
| N32 | C36 | C35 | H36A | 120.0° | 119.4° |
| N32 | C36 | C35 | H35 | 111.9° | 96.1° |
| N32 | C36 | C35 | H35A | 128.1° | 140.6° |
| N32 | C36 | H36 | H36A | 123.2° | 121.2° |
| C34 | C33 | H33 | H33A | 123.2° | 122.3° |
| C33 | C34 | C35 | H34 | 120.0° | 118.1° |
| C33 | C34 | C35 | H34A | 120.0° | 118.1° |
| C33 | C34 | H34 | H34A | 120.6° | 123.8° |
| C33 | C34 | C35 | C36 | 2.9° | 35.6° |
| C33 | C34 | C35 | H35 | 122.9° | 82.7° |
| C33 | C34 | C35 | H35A | 117.1° | 154.0° |
| H33 | C33 | C34 | C35 | 132.6° | 81.9° |
| H33 | C33 | C34 | H34 | 12.6° | 36.3° |
| H33 | C33 | C34 | H34A | 107.4° | 160.1° |
| H33A | C33 | C34 | C35 | 107.4° | 155.9° |
| H33A | C33 | C34 | H34 | 132.6° | 85.9° |
| H33A | C33 | C34 | H34A | 12.6° | 37.9° |
| C35 | C34 | H34 | H34A | 120.6° | 123.8° |
| C34 | C35 | C36 | H35 | 120.0° | 118.3° |
| C34 | C35 | C36 | H35A | 120.0° | 118.4° |
| C34 | C35 | H35 | H35A | 120.4° | 123.2° |
| C34 | C35 | C36 | H36 | 111.9° | 97.2° |
| C34 | C35 | C36 | H36A | 128.1° | 141.7° |
| H34 | C34 | C35 | C36 | 117.1° | 153.7° |
| H34 | C34 | C35 | H35 | 2.9° | 35.4° |
| H34 | C34 | C35 | H35A | 122.9° | 87.9° |
| H34A | C34 | C35 | C36 | 122.9° | 82.5° |
| H34A | C34 | C35 | H35 | 117.1° | 159.2° |
| H34A | C34 | C35 | H35A | 2.9° | 35.9° |
| C36 | C35 | H35 | H35A | 120.3° | 123.3° |
| C35 | C36 | H36 | H36A | 123.2° | 121.1° |
| H35 | C35 | C36 | H36 | 128.0° | 144.5° |
| H35 | C35 | C36 | H36A | 8.1° | 23.4° |
| H35A | C35 | C36 | H36 | 8.1° | 21.2° |
| H35A | C35 | C36 | H36A | 111.9° | 99.9° |
