L0O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | N | sing | 1.47Å | 1.46Å | |
| C27 | N | sing | 1.47Å | 1.46Å | |
| N | C22 | sing | 1.47Å | 1.48Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C21 | O6 | sing | 1.43Å | 1.41Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C24 | C25 | sing | 1.53Å | 1.51Å | |
| C24 | O5 | sing | 1.43Å | 1.44Å | |
| O5 | C20 | sing | 1.43Å | 1.42Å | |
| C20 | O4 | sing | 1.43Å | 1.40Å | |
| C | C1 | sing | 1.53Å | 1.50Å | |
| O | C1 | sing | 1.43Å | 1.44Å | |
| O | C2 | sing | 1.43Å | 1.44Å | |
| C5 | C6 | sing | 1.53Å | 1.50Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C7 | C3 | sing | 1.53Å | 1.53Å | |
| O4 | C14 | sing | 1.43Å | 1.44Å | |
| C3 | C2 | sing | 1.53Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | C2 | sing | 1.53Å | 1.48Å | |
| C1 | C8 | sing | 1.51Å | 1.49Å | |
| C4 | O1 | sing | 1.45Å | 1.46Å | |
| O1 | C18 | sing | 1.34Å | 1.34Å | |
| C9 | C8 | doub | 1.34Å | 1.36Å | |
| C9 | C10 | sing | 1.46Å | 1.44Å | |
| C30 | C11 | sing | 1.53Å | 1.53Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| C17 | C18 | sing | 1.51Å | 1.52Å | |
| C11 | C10 | sing | 1.51Å | 1.52Å | |
| C16 | O3 | sing | 1.43Å | 1.43Å | |
| C18 | O2 | doub | 1.21Å | 1.21Å | |
| C10 | O8 | doub | 1.21Å | 1.22Å | |
| C13 | C28 | sing | 1.53Å | 1.50Å | |
| C29 | C28 | sing | 1.53Å | 1.51Å | |
| C29 | O7 | sing | 1.43Å | 1.42Å | |
| C12 | H1 | sing | 1.09Å | 1.10Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C23 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C29 | H16 | sing | 1.09Å | 1.10Å | |
| C29 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C | H33 | sing | 1.09Å | 1.10Å | |
| C | H34 | sing | 1.09Å | 1.10Å | |
| C | H35 | sing | 1.09Å | 1.10Å | |
| C11 | H36 | sing | 1.09Å | 1.10Å | |
| C2 | H37 | sing | 1.09Å | 1.10Å | |
| C20 | H38 | sing | 1.09Å | 1.10Å | |
| C21 | H39 | sing | 1.09Å | 1.10Å | |
| C3 | H40 | sing | 1.09Å | 1.10Å | |
| C4 | H41 | sing | 1.09Å | 1.10Å | |
| C5 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | H43 | sing | 1.09Å | 1.10Å | |
| C6 | H44 | sing | 1.09Å | 1.10Å | |
| C6 | H45 | sing | 1.09Å | 1.10Å | |
| C6 | H46 | sing | 1.09Å | 1.10Å | |
| C7 | H47 | sing | 1.09Å | 1.10Å | |
| C7 | H48 | sing | 1.09Å | 1.10Å | |
| C7 | H49 | sing | 1.09Å | 1.10Å | |
| C8 | H50 | sing | 1.08Å | 1.08Å | |
| C9 | H51 | sing | 1.08Å | 1.08Å | |
| O3 | H52 | sing | 0.97Å | 0.95Å | |
| O6 | H53 | sing | 0.97Å | 0.95Å | |
| O7 | H54 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | N | C27 | 109.9° | 111.1° |
| C26 | N | C22 | 113.3° | 111.0° |
| N | C26 | H23 | 109.5° | 109.4° |
| N | C26 | H24 | 109.5° | 109.5° |
| N | C26 | H25 | 109.4° | 109.5° |
| C27 | N | C22 | 113.8° | 111.0° |
| N | C27 | H20 | 109.5° | 109.5° |
| N | C27 | H21 | 109.4° | 109.5° |
| N | C27 | H22 | 109.5° | 109.4° |
| N | C22 | C23 | 116.2° | 109.5° |
| N | C22 | C21 | 109.7° | 109.6° |
| N | C22 | H12 | 107.3° | 109.6° |
| C23 | C22 | C21 | 109.5° | 109.1° |
| C22 | C23 | C24 | 112.7° | 109.2° |
| C23 | C22 | H12 | 106.9° | 109.5° |
| C22 | C23 | H13 | 108.6° | 109.5° |
| C22 | C23 | H14 | 108.6° | 109.5° |
| C22 | C21 | O6 | 110.2° | 109.5° |
| C22 | C21 | C20 | 107.9° | 109.1° |
| C21 | C22 | H12 | 106.9° | 109.5° |
| C22 | C21 | H39 | 109.0° | 109.5° |
| C23 | C24 | C25 | 112.8° | 109.5° |
| C23 | C24 | O5 | 110.4° | 109.4° |
| C24 | C23 | H13 | 108.7° | 109.5° |
| C24 | C23 | H14 | 108.7° | 109.5° |
| C23 | C24 | H15 | 109.0° | 109.5° |
| O6 | C21 | C20 | 110.2° | 109.5° |
| O6 | C21 | H39 | 110.5° | 109.6° |
| C21 | O6 | H53 | 109.5° | 114.0° |
| C21 | C20 | O5 | 110.0° | 109.4° |
| C21 | C20 | O4 | 110.0° | 109.5° |
| C21 | C20 | H38 | 108.9° | 109.5° |
| C20 | C21 | H39 | 108.9° | 109.6° |
| C25 | C24 | O5 | 105.5° | 109.5° |
| C25 | C24 | H15 | 109.1° | 109.5° |
| C24 | C25 | H26 | 109.5° | 109.5° |
| C24 | C25 | H27 | 109.5° | 109.4° |
| C24 | C25 | H28 | 109.5° | 109.5° |
| C24 | O5 | C20 | 114.0° | 114.1° |
| O5 | C24 | H15 | 110.0° | 109.5° |
| O5 | C20 | O4 | 106.8° | 109.5° |
| O5 | C20 | H38 | 110.5° | 109.5° |
| C20 | O4 | C14 | 112.5° | 114.0° |
| O4 | C20 | H38 | 110.7° | 109.5° |
| C | C1 | O | 116.2° | 117.8° |
| C | C1 | C2 | 123.6° | 117.8° |
| C | C1 | C8 | 110.6° | 115.7° |
| C1 | C | H33 | 109.5° | 109.5° |
| C1 | C | H34 | 109.5° | 109.5° |
| C1 | C | H35 | 109.5° | 109.4° |
| C1 | O | C2 | 61.4° | 64.7° |
| O | C1 | C2 | 59.3° | 57.7° |
| O | C1 | C8 | 115.2° | 118.0° |
| O | C2 | C3 | 107.8° | 117.9° |
| O | C2 | C1 | 59.3° | 57.6° |
| O | C2 | H37 | 117.1° | 117.7° |
| C6 | C5 | C4 | 118.3° | 109.4° |
| C6 | C5 | H42 | 107.2° | 109.5° |
| C6 | C5 | H43 | 107.2° | 109.5° |
| C5 | C6 | H44 | 109.5° | 109.4° |
| C5 | C6 | H45 | 109.4° | 109.5° |
| C5 | C6 | H46 | 109.5° | 109.5° |
| C5 | C4 | C3 | 108.2° | 109.5° |
| C5 | C4 | O1 | 111.2° | 109.5° |
| C5 | C4 | H41 | 110.1° | 109.4° |
| C4 | C5 | H42 | 107.3° | 109.5° |
| C4 | C5 | H43 | 107.2° | 109.5° |
| C7 | C3 | C2 | 109.8° | 109.5° |
| C7 | C3 | C4 | 112.2° | 109.5° |
| C7 | C3 | H40 | 106.0° | 109.5° |
| C3 | C7 | H47 | 109.5° | 109.4° |
| C3 | C7 | H48 | 109.5° | 109.5° |
| C3 | C7 | H49 | 109.5° | 109.5° |
| O4 | C14 | C15 | 107.6° | 109.5° |
| O4 | C14 | C13 | 107.3° | 109.5° |
| O4 | C14 | H4 | 109.1° | 109.4° |
| C2 | C3 | C4 | 115.8° | 109.5° |
| C3 | C2 | C1 | 125.3° | 117.7° |
| C3 | C2 | H37 | 115.9° | 115.7° |
| C2 | C3 | H40 | 106.2° | 109.4° |
| C3 | C4 | O1 | 106.0° | 109.5° |
| C4 | C3 | H40 | 106.0° | 109.4° |
| C3 | C4 | H41 | 110.1° | 109.4° |
| C2 | C1 | C8 | 121.6° | 117.6° |
| C1 | C2 | H37 | 116.4° | 117.9° |
| C1 | C8 | C9 | 122.8° | 119.7° |
| C1 | C8 | H50 | 118.6° | 120.2° |
| C4 | O1 | C18 | 119.6° | 117.0° |
| O1 | C4 | H41 | 111.1° | 109.5° |
| O1 | C18 | C17 | 112.3° | 120.1° |
| O1 | C18 | O2 | 122.9° | 120.0° |
| C8 | C9 | C10 | 125.1° | 120.1° |
| C9 | C8 | H50 | 118.7° | 120.1° |
| C8 | C9 | H51 | 117.4° | 120.0° |
| C9 | C10 | C11 | 119.2° | 119.9° |
| C9 | C10 | O8 | 120.0° | 120.0° |
| C10 | C9 | H51 | 117.5° | 119.9° |
| C30 | C11 | C12 | 112.7° | 109.5° |
| C30 | C11 | C10 | 110.6° | 109.4° |
| C11 | C30 | H29 | 109.5° | 109.5° |
| C11 | C30 | H30 | 109.5° | 109.5° |
| C11 | C30 | H31 | 109.4° | 109.4° |
| C30 | C11 | H36 | 106.5° | 109.5° |
| C11 | C12 | C13 | 114.3° | 109.6° |
| C12 | C11 | C10 | 113.2° | 109.4° |
| C11 | C12 | H1 | 108.2° | 109.5° |
| C11 | C12 | H2 | 108.3° | 109.5° |
| C12 | C11 | H36 | 106.6° | 109.5° |
| C12 | C13 | C14 | 111.6° | 109.4° |
| C12 | C13 | C28 | 107.4° | 109.4° |
| C13 | C12 | H1 | 108.3° | 109.5° |
| C13 | C12 | H2 | 108.2° | 109.4° |
| C12 | C13 | H3 | 107.9° | 109.4° |
| C15 | C14 | C13 | 117.2° | 109.5° |
| C14 | C15 | C16 | 114.2° | 109.5° |
| C14 | C15 | C19 | 113.2° | 109.5° |
| C15 | C14 | H4 | 107.7° | 109.4° |
| C14 | C15 | H5 | 105.7° | 109.5° |
| C14 | C13 | C28 | 113.5° | 109.5° |
| C14 | C13 | H3 | 107.9° | 109.5° |
| C13 | C14 | H4 | 107.8° | 109.5° |
| C16 | C15 | C19 | 111.2° | 109.5° |
| C15 | C16 | C17 | 115.4° | 109.5° |
| C15 | C16 | O3 | 108.0° | 109.5° |
| C16 | C15 | H5 | 105.8° | 109.4° |
| C15 | C16 | H6 | 107.9° | 109.5° |
| C19 | C15 | H5 | 105.9° | 109.5° |
| C15 | C19 | H9 | 109.5° | 109.5° |
| C15 | C19 | H10 | 109.4° | 109.5° |
| C15 | C19 | H11 | 109.5° | 109.4° |
| C16 | C17 | C18 | 111.8° | 109.5° |
| C17 | C16 | O3 | 108.3° | 109.5° |
| C17 | C16 | H6 | 108.0° | 109.5° |
| C16 | C17 | H7 | 108.9° | 109.5° |
| C16 | C17 | H8 | 108.9° | 109.5° |
| C17 | C18 | O2 | 124.8° | 119.9° |
| C18 | C17 | H7 | 108.9° | 109.4° |
| C18 | C17 | H8 | 108.9° | 109.5° |
| C11 | C10 | O8 | 120.8° | 120.1° |
| C10 | C11 | H36 | 106.7° | 109.5° |
| O3 | C16 | H6 | 109.2° | 109.4° |
| C16 | O3 | H52 | 109.5° | 114.0° |
| C13 | C28 | C29 | 113.1° | 109.5° |
| C28 | C13 | H3 | 108.4° | 109.5° |
| C13 | C28 | H18 | 108.6° | 109.5° |
| C13 | C28 | H19 | 108.6° | 109.5° |
| C28 | C29 | O7 | 111.3° | 109.5° |
| C28 | C29 | H16 | 109.0° | 109.5° |
| C28 | C29 | H17 | 109.0° | 109.5° |
| C29 | C28 | H18 | 108.5° | 109.5° |
| C29 | C28 | H19 | 108.5° | 109.5° |
| O7 | C29 | H16 | 109.0° | 109.5° |
| O7 | C29 | H17 | 109.0° | 109.5° |
| C29 | O7 | H54 | 109.5° | 113.9° |
| H1 | C12 | H2 | 109.5° | 109.4° |
| H7 | C17 | H8 | 109.5° | 109.5° |
| H9 | C19 | H10 | 109.4° | 109.5° |
| H9 | C19 | H11 | 109.4° | 109.5° |
| H10 | C19 | H11 | 109.5° | 109.5° |
| H13 | C23 | H14 | 109.5° | 109.6° |
| H16 | C29 | H17 | 109.4° | 109.4° |
| H18 | C28 | H19 | 109.5° | 109.4° |
| H20 | C27 | H21 | 109.5° | 109.5° |
| H20 | C27 | H22 | 109.5° | 109.4° |
| H21 | C27 | H22 | 109.5° | 109.5° |
| H23 | C26 | H24 | 109.4° | 109.5° |
| H23 | C26 | H25 | 109.5° | 109.5° |
| H24 | C26 | H25 | 109.5° | 109.5° |
| H26 | C25 | H27 | 109.4° | 109.5° |
| H26 | C25 | H28 | 109.5° | 109.6° |
| H27 | C25 | H28 | 109.5° | 109.4° |
| H29 | C30 | H30 | 109.5° | 109.5° |
| H29 | C30 | H31 | 109.5° | 109.5° |
| H30 | C30 | H31 | 109.5° | 109.5° |
| H33 | C | H34 | 109.5° | 109.5° |
| H33 | C | H35 | 109.4° | 109.5° |
| H34 | C | H35 | 109.5° | 109.5° |
| H42 | C5 | H43 | 109.5° | 109.5° |
| H44 | C6 | H45 | 109.5° | 109.5° |
| H44 | C6 | H46 | 109.5° | 109.5° |
| H45 | C6 | H46 | 109.5° | 109.5° |
| H47 | C7 | H48 | 109.4° | 109.4° |
| H47 | C7 | H49 | 109.5° | 109.5° |
| H48 | C7 | H49 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | N | C27 | C22 | 128.3° | 124.0° |
| C26 | N | C22 | C23 | 53.1° | 69.8° |
| C26 | N | C22 | C21 | 177.9° | 170.6° |
| C26 | N | C22 | H12 | 66.3° | 50.4° |
| C26 | N | C27 | H20 | 180.0° | 59.9° |
| C26 | N | C27 | H21 | 60.0° | 180.0° |
| C26 | N | C27 | H22 | 60.0° | 60.0° |
| N | C26 | H23 | H24 | 120.0° | 120.0° |
| N | C26 | H23 | H25 | 120.0° | 120.0° |
| N | C26 | H24 | H25 | 120.0° | 120.1° |
| C27 | N | C22 | C23 | 73.4° | 54.2° |
| C27 | N | C22 | C21 | 51.3° | 65.4° |
| C27 | N | C22 | H12 | 167.1° | 174.4° |
| N | C27 | H20 | H21 | 120.0° | 120.0° |
| N | C27 | H20 | H22 | 120.0° | 119.9° |
| N | C27 | H21 | H22 | 120.0° | 120.0° |
| C27 | N | C26 | H23 | 180.0° | 67.0° |
| C27 | N | C26 | H24 | 60.0° | 173.0° |
| C27 | N | C26 | H25 | 60.0° | 52.9° |
| N | C22 | C23 | C21 | 124.9° | 119.9° |
| N | C22 | C23 | H12 | 119.7° | 120.2° |
| N | C22 | C21 | H12 | 116.0° | 120.3° |
| N | C22 | C23 | C24 | 177.5° | 176.9° |
| N | C22 | C21 | O6 | 54.9° | 63.3° |
| N | C22 | C21 | C20 | 175.3° | 176.8° |
| N | C22 | C23 | H13 | 62.0° | 63.3° |
| N | C22 | C23 | H14 | 57.0° | 57.0° |
| C22 | N | C27 | H20 | 51.7° | 176.0° |
| C22 | N | C27 | H21 | 68.3° | 56.0° |
| C22 | N | C27 | H22 | 171.7° | 64.1° |
| C22 | N | C26 | H23 | 51.4° | 57.0° |
| C22 | N | C26 | H24 | 171.4° | 63.0° |
| C22 | N | C26 | H25 | 68.6° | 177.0° |
| N | C22 | C21 | H39 | 66.6° | 56.9° |
| C23 | C22 | C21 | H12 | 115.4° | 119.9° |
| C22 | C23 | C24 | H13 | 120.5° | 119.9° |
| C22 | C23 | C24 | H14 | 120.5° | 119.9° |
| C23 | C22 | C21 | O6 | 176.6° | 176.9° |
| C23 | C22 | C21 | C20 | 56.2° | 57.0° |
| C22 | C23 | C24 | C25 | 168.4° | 177.6° |
| C22 | C23 | C24 | O5 | 50.7° | 57.6° |
| C22 | C23 | H13 | H14 | 118.5° | 120.2° |
| C22 | C23 | C24 | H15 | 70.3° | 62.4° |
| C23 | C22 | C21 | H39 | 62.0° | 63.0° |
| C21 | C22 | C23 | C24 | 52.6° | 57.0° |
| C22 | C21 | O6 | C20 | 119.0° | 119.7° |
| C22 | C21 | O6 | H39 | 120.5° | 120.1° |
| C22 | C21 | C20 | H39 | 118.2° | 119.9° |
| C22 | C21 | C20 | O5 | 61.1° | 57.6° |
| C22 | C21 | C20 | O4 | 178.4° | 177.6° |
| C21 | C22 | C23 | H13 | 173.1° | 176.9° |
| C21 | C22 | C23 | H14 | 67.9° | 62.9° |
| C22 | C21 | C20 | H38 | 60.1° | 62.4° |
| C22 | C21 | O6 | H53 | 180.0° | 180.0° |
| C23 | C24 | C25 | O5 | 120.6° | 119.9° |
| C23 | C24 | C25 | H15 | 121.2° | 120.0° |
| C23 | C24 | O5 | H15 | 120.3° | 120.0° |
| C23 | C24 | O5 | C20 | 56.1° | 61.2° |
| C24 | C23 | C22 | H12 | 62.8° | 62.9° |
| C24 | C23 | H13 | H14 | 118.6° | 120.2° |
| C23 | C24 | C25 | H26 | 180.0° | 60.0° |
| C23 | C24 | C25 | H27 | 60.0° | 180.0° |
| C23 | C24 | C25 | H28 | 60.0° | 60.1° |
| O6 | C21 | C20 | H39 | 121.4° | 120.2° |
| O6 | C21 | C20 | O5 | 178.5° | 177.5° |
| O6 | C21 | C20 | O4 | 61.1° | 62.5° |
| O6 | C21 | C22 | H12 | 61.2° | 57.0° |
| O6 | C21 | C20 | H38 | 60.4° | 57.5° |
| C21 | C20 | O5 | C24 | 62.4° | 61.2° |
| C21 | C20 | O5 | O4 | 119.3° | 119.9° |
| C21 | C20 | O5 | H38 | 120.3° | 120.0° |
| C21 | C20 | O4 | H38 | 120.4° | 120.0° |
| C21 | C20 | O4 | C14 | 166.3° | 170.7° |
| C20 | C21 | C22 | H12 | 59.2° | 62.9° |
| C20 | C21 | O6 | H53 | 61.0° | 60.3° |
| C25 | C24 | O5 | H15 | 117.6° | 120.0° |
| C25 | C24 | O5 | C20 | 178.2° | 178.8° |
| C25 | C24 | C23 | H13 | 71.1° | 62.6° |
| C25 | C24 | C23 | H14 | 48.0° | 57.7° |
| C24 | C25 | H26 | H27 | 120.0° | 120.0° |
| C24 | C25 | H26 | H28 | 120.0° | 120.0° |
| C24 | C25 | H27 | H28 | 120.0° | 119.9° |
| C24 | O5 | C20 | O4 | 178.3° | 178.9° |
| O5 | C24 | C23 | H13 | 171.1° | 177.5° |
| O5 | C24 | C23 | H14 | 69.8° | 62.3° |
| O5 | C24 | C25 | H26 | 59.4° | 59.9° |
| O5 | C24 | C25 | H27 | 179.4° | 60.1° |
| O5 | C24 | C25 | H28 | 60.6° | 180.0° |
| C24 | O5 | C20 | H38 | 57.9° | 58.8° |
| O5 | C20 | O4 | H38 | 120.3° | 120.1° |
| O5 | C20 | O4 | C14 | 74.4° | 69.4° |
| C20 | O5 | C24 | H15 | 64.2° | 58.8° |
| O5 | C20 | C21 | H39 | 57.1° | 62.2° |
| C20 | O4 | C14 | C15 | 102.4° | 97.2° |
| C20 | O4 | C14 | C13 | 130.7° | 142.8° |
| C20 | O4 | C14 | H4 | 14.2° | 22.7° |
| O4 | C20 | C21 | H39 | 60.3° | 57.7° |
| C | C1 | O | C2 | 115.1° | 106.9° |
| C | C1 | O | C8 | 131.7° | 146.6° |
| C | C1 | C2 | C3 | 12.1° | 0.1° |
| C | C1 | C2 | C8 | 154.6° | 145.9° |
| C | C1 | C8 | C9 | 0.2° | 68.2° |
| C1 | C | H33 | H34 | 120.0° | 120.0° |
| C1 | C | H33 | H35 | 120.0° | 120.0° |
| C1 | C | H34 | H35 | 120.0° | 120.0° |
| C | C1 | C2 | H37 | 149.9° | 146.4° |
| C | C1 | C8 | H50 | 179.8° | 111.7° |
| O | C1 | C2 | C3 | 90.8° | 107.0° |
| O | C1 | C2 | C8 | 102.5° | 107.2° |
| O | C1 | C8 | C9 | 134.1° | 144.5° |
| O | C1 | C | H33 | 180.0° | 111.4° |
| O | C1 | C | H34 | 60.0° | 128.6° |
| O | C1 | C | H35 | 60.0° | 8.6° |
| C1 | O | C2 | H37 | 106.1° | 107.0° |
| O | C1 | C8 | H50 | 45.9° | 35.6° |
| O | C2 | C3 | C7 | 74.5° | 40.3° |
| O | C2 | C3 | H37 | 133.4° | 147.0° |
| O | C2 | C3 | C4 | 157.1° | 160.3° |
| O | C2 | C3 | H40 | 39.7° | 79.8° |
| C6 | C5 | C4 | H42 | 121.3° | 120.0° |
| C6 | C5 | C4 | H43 | 121.3° | 120.0° |
| C6 | C5 | C4 | C3 | 170.3° | 64.0° |
| C6 | C5 | C4 | O1 | 54.3° | 56.1° |
| C6 | C5 | C4 | H41 | 69.4° | 176.0° |
| C6 | C5 | H42 | H43 | 116.0° | 120.0° |
| C5 | C6 | H44 | H45 | 120.0° | 120.0° |
| C5 | C6 | H44 | H46 | 120.0° | 120.0° |
| C5 | C6 | H45 | H46 | 120.0° | 120.0° |
| C5 | C4 | C3 | C7 | 65.1° | 30.3° |
| C5 | C4 | C3 | C2 | 167.8° | 150.3° |
| C5 | C4 | C3 | O1 | 119.4° | 120.1° |
| C5 | C4 | C3 | H41 | 120.3° | 119.9° |
| C5 | C4 | O1 | H41 | 123.0° | 119.9° |
| C5 | C4 | O1 | C18 | 91.4° | 72.8° |
| C5 | C4 | C3 | H40 | 50.2° | 89.8° |
| C4 | C5 | H42 | H43 | 116.0° | 120.0° |
| C4 | C5 | C6 | H44 | 180.0° | 175.5° |
| C4 | C5 | C6 | H45 | 60.0° | 64.6° |
| C4 | C5 | C6 | H46 | 60.0° | 55.5° |
| C7 | C3 | C2 | C4 | 128.4° | 120.0° |
| C7 | C3 | C2 | H40 | 114.2° | 120.1° |
| C7 | C3 | C4 | H40 | 115.3° | 120.1° |
| C7 | C3 | C2 | C1 | 139.0° | 106.2° |
| C7 | C3 | C4 | O1 | 175.5° | 150.4° |
| C7 | C3 | C2 | H37 | 58.9° | 106.7° |
| C7 | C3 | C4 | H41 | 55.3° | 89.6° |
| C3 | C7 | H47 | H48 | 120.0° | 120.0° |
| C3 | C7 | H47 | H49 | 120.0° | 120.0° |
| C3 | C7 | H48 | H49 | 120.0° | 120.0° |
| O4 | C14 | C13 | C12 | 34.6° | 104.6° |
| O4 | C14 | C15 | C13 | 120.9° | 120.0° |
| O4 | C14 | C15 | H4 | 117.4° | 119.9° |
| O4 | C14 | C13 | H4 | 117.4° | 120.0° |
| O4 | C14 | C15 | C16 | 63.3° | 128.7° |
| O4 | C14 | C15 | C19 | 168.1° | 8.7° |
| O4 | C14 | C13 | C28 | 156.1° | 135.4° |
| O4 | C14 | C13 | H3 | 83.8° | 15.3° |
| O4 | C14 | C15 | H5 | 52.7° | 111.3° |
| C14 | O4 | C20 | H38 | 45.9° | 50.7° |
| C2 | C3 | C4 | H40 | 117.5° | 119.9° |
| C3 | C2 | C1 | H37 | 162.0° | 146.3° |
| C3 | C2 | C1 | C8 | 166.7° | 145.8° |
| C2 | C3 | C4 | O1 | 48.4° | 89.6° |
| C2 | C3 | C4 | H41 | 71.9° | 30.4° |
| C2 | C3 | C7 | H47 | 180.0° | 63.9° |
| C2 | C3 | C7 | H48 | 60.0° | 176.2° |
| C2 | C3 | C7 | H49 | 60.0° | 56.1° |
| C4 | C3 | C2 | C1 | 92.7° | 133.7° |
| C3 | C4 | O1 | H41 | 119.6° | 120.0° |
| C3 | C4 | O1 | C18 | 151.2° | 167.2° |
| C4 | C3 | C2 | H37 | 69.4° | 13.3° |
| C3 | C4 | C5 | H42 | 49.0° | 176.0° |
| C3 | C4 | C5 | H43 | 68.5° | 55.9° |
| C4 | C3 | C7 | H47 | 49.7° | 176.1° |
| C4 | C3 | C7 | H48 | 70.3° | 56.1° |
| C4 | C3 | C7 | H49 | 169.7° | 63.9° |
| C2 | C1 | C8 | C9 | 157.8° | 78.4° |
| C2 | C1 | C | H33 | 110.9° | 177.5° |
| C2 | C1 | C | H34 | 9.1° | 62.5° |
| C2 | C1 | C | H35 | 129.1° | 57.5° |
| C1 | C2 | C3 | H40 | 24.8° | 13.8° |
| C2 | C1 | C8 | H50 | 22.2° | 101.6° |
| C1 | C8 | C9 | H50 | 180.0° | 180.0° |
| C1 | C8 | C9 | C10 | 168.2° | 180.0° |
| C8 | C1 | C | H33 | 46.2° | 35.9° |
| C8 | C1 | C | H34 | 166.2° | 84.1° |
| C8 | C1 | C | H35 | 73.8° | 156.0° |
| C8 | C1 | C2 | H37 | 4.7° | 0.5° |
| C1 | C8 | C9 | H51 | 11.8° | 0.1° |
| C4 | O1 | C18 | C17 | 163.8° | 180.0° |
| C4 | O1 | C18 | O2 | 15.5° | 0.1° |
| O1 | C4 | C3 | H40 | 69.2° | 30.3° |
| O1 | C4 | C5 | H42 | 67.0° | 63.9° |
| O1 | C4 | C5 | H43 | 175.5° | 176.0° |
| O1 | C18 | C17 | C16 | 69.5° | 119.6° |
| O1 | C18 | C17 | O2 | 179.3° | 180.0° |
| O1 | C18 | C17 | H7 | 50.8° | 0.4° |
| O1 | C18 | C17 | H8 | 170.2° | 120.4° |
| C18 | O1 | C4 | H41 | 31.6° | 47.1° |
| C8 | C9 | C10 | H51 | 180.0° | 179.9° |
| C8 | C9 | C10 | C11 | 175.4° | 179.9° |
| C8 | C9 | C10 | O8 | 7.0° | 0.0° |
| C9 | C10 | C11 | C30 | 96.6° | 65.6° |
| C9 | C10 | C11 | C12 | 30.9° | 54.4° |
| C9 | C10 | C11 | O8 | 177.6° | 179.9° |
| C9 | C10 | C11 | H36 | 147.9° | 174.4° |
| C10 | C9 | C8 | H50 | 11.8° | 0.0° |
| C30 | C11 | C12 | C10 | 126.4° | 119.9° |
| C30 | C11 | C12 | H36 | 116.5° | 120.0° |
| C30 | C11 | C12 | C13 | 171.6° | 2.1° |
| C30 | C11 | C10 | H36 | 115.5° | 120.0° |
| C30 | C11 | C10 | O8 | 81.1° | 114.5° |
| C30 | C11 | C12 | H1 | 67.7° | 117.9° |
| C30 | C11 | C12 | H2 | 50.9° | 122.1° |
| C11 | C30 | H29 | H30 | 120.0° | 120.0° |
| C11 | C30 | H29 | H31 | 120.0° | 119.9° |
| C11 | C30 | H30 | H31 | 120.0° | 119.9° |
| C11 | C12 | C13 | H1 | 120.7° | 120.1° |
| C11 | C12 | C13 | H2 | 120.7° | 120.1° |
| C11 | C12 | C13 | C14 | 158.7° | 168.8° |
| C12 | C11 | C10 | H36 | 117.0° | 120.0° |
| C12 | C11 | C10 | O8 | 151.4° | 125.5° |
| C11 | C12 | C13 | C28 | 76.3° | 71.2° |
| C11 | C12 | H1 | H2 | 117.8° | 120.0° |
| C11 | C12 | C13 | H3 | 40.3° | 48.8° |
| C12 | C11 | C30 | H29 | 180.0° | 86.5° |
| C12 | C11 | C30 | H30 | 60.0° | 153.5° |
| C12 | C11 | C30 | H31 | 60.0° | 33.5° |
| C12 | C13 | C14 | C15 | 155.7° | 135.4° |
| C12 | C13 | C14 | C28 | 121.5° | 120.0° |
| C12 | C13 | C14 | H3 | 118.4° | 120.0° |
| C13 | C12 | C11 | C10 | 62.0° | 122.1° |
| C12 | C13 | C28 | H3 | 116.3° | 120.0° |
| C12 | C13 | C28 | C29 | 68.3° | 54.0° |
| C13 | C12 | H1 | H2 | 117.8° | 119.9° |
| C12 | C13 | C14 | H4 | 82.7° | 15.4° |
| C12 | C13 | C28 | H18 | 52.3° | 66.0° |
| C12 | C13 | C28 | H19 | 171.2° | 174.0° |
| C13 | C12 | C11 | H36 | 55.0° | 117.9° |
| C15 | C14 | C13 | H4 | 121.6° | 120.0° |
| C14 | C15 | C16 | C19 | 129.6° | 120.0° |
| C14 | C15 | C16 | H5 | 115.9° | 120.0° |
| C14 | C15 | C19 | H5 | 115.3° | 120.0° |
| C14 | C15 | C16 | C17 | 153.1° | 139.3° |
| C14 | C15 | C16 | O3 | 85.6° | 100.7° |
| C15 | C14 | C13 | C28 | 82.8° | 15.4° |
| C15 | C14 | C13 | H3 | 37.3° | 104.7° |
| C14 | C15 | C16 | H6 | 32.3° | 19.2° |
| C14 | C15 | C19 | H9 | 180.0° | 67.6° |
| C14 | C15 | C19 | H10 | 60.0° | 172.4° |
| C14 | C15 | C19 | H11 | 60.0° | 52.4° |
| C13 | C14 | C15 | C16 | 57.6° | 111.2° |
| C13 | C14 | C15 | C19 | 71.0° | 128.8° |
| C14 | C13 | C28 | H3 | 119.8° | 120.1° |
| C14 | C13 | C28 | C29 | 55.6° | 66.0° |
| C14 | C13 | C12 | H1 | 38.0° | 71.1° |
| C14 | C13 | C12 | H2 | 80.6° | 48.8° |
| C13 | C14 | C15 | H5 | 173.6° | 8.8° |
| C14 | C13 | C28 | H18 | 176.1° | 174.0° |
| C14 | C13 | C28 | H19 | 64.9° | 54.0° |
| C16 | C15 | C19 | H5 | 114.5° | 120.0° |
| C15 | C16 | C17 | O3 | 121.2° | 120.0° |
| C15 | C16 | C17 | H6 | 120.7° | 120.0° |
| C15 | C16 | C17 | C18 | 178.8° | 136.4° |
| C15 | C16 | O3 | H6 | 117.0° | 120.0° |
| C16 | C15 | C14 | H4 | 179.2° | 8.8° |
| C15 | C16 | C17 | H7 | 58.5° | 16.4° |
| C15 | C16 | C17 | H8 | 60.9° | 103.6° |
| C16 | C15 | C19 | H9 | 49.8° | 52.5° |
| C16 | C15 | C19 | H10 | 169.8° | 67.6° |
| C16 | C15 | C19 | H11 | 70.1° | 172.4° |
| C15 | C16 | O3 | H52 | 180.0° | 180.0° |
| C19 | C15 | C16 | C17 | 77.3° | 100.7° |
| C19 | C15 | C16 | O3 | 44.0° | 19.3° |
| C19 | C15 | C14 | H4 | 50.6° | 111.2° |
| C19 | C15 | C16 | H6 | 161.9° | 139.2° |
| C15 | C19 | H9 | H10 | 120.0° | 120.0° |
| C15 | C19 | H9 | H11 | 120.0° | 119.9° |
| C15 | C19 | H10 | H11 | 120.0° | 120.0° |
| C16 | C17 | C18 | H7 | 120.4° | 120.0° |
| C16 | C17 | C18 | H8 | 120.3° | 120.0° |
| C17 | C16 | O3 | H6 | 117.3° | 120.0° |
| C16 | C17 | C18 | O2 | 111.1° | 60.5° |
| C17 | C16 | C15 | H5 | 37.2° | 19.2° |
| C16 | C17 | H7 | H8 | 118.9° | 120.0° |
| C17 | C16 | O3 | H52 | 54.4° | 60.0° |
| C18 | C17 | C16 | O3 | 60.0° | 103.6° |
| C18 | C17 | C16 | H6 | 58.1° | 16.4° |
| C18 | C17 | H7 | H8 | 118.9° | 120.0° |
| C10 | C11 | C12 | H1 | 58.7° | 2.0° |
| C10 | C11 | C12 | H2 | 177.3° | 117.9° |
| C10 | C11 | C30 | H29 | 52.2° | 33.5° |
| C10 | C11 | C30 | H30 | 172.2° | 86.6° |
| C10 | C11 | C30 | H31 | 67.8° | 153.4° |
| C11 | C10 | C9 | H51 | 4.6° | 0.2° |
| O3 | C16 | C15 | H5 | 158.5° | 139.2° |
| O3 | C16 | C17 | H7 | 179.6° | 136.4° |
| O3 | C16 | C17 | H8 | 60.3° | 16.4° |
| O2 | C18 | C17 | H7 | 128.5° | 179.6° |
| O2 | C18 | C17 | H8 | 9.2° | 59.6° |
| O8 | C10 | C11 | H36 | 34.4° | 5.5° |
| O8 | C10 | C9 | H51 | 173.1° | 179.9° |
| C13 | C28 | C29 | H18 | 120.5° | 120.0° |
| C13 | C28 | C29 | H19 | 120.5° | 120.0° |
| C13 | C28 | C29 | O7 | 164.8° | 172.4° |
| C28 | C13 | C12 | H1 | 163.0° | 48.9° |
| C28 | C13 | C12 | H2 | 44.4° | 168.8° |
| C28 | C13 | C14 | H4 | 38.8° | 104.6° |
| C13 | C28 | C29 | H16 | 44.5° | 67.6° |
| C13 | C28 | C29 | H17 | 74.9° | 52.3° |
| C13 | C28 | H18 | H19 | 118.4° | 120.0° |
| C28 | C29 | O7 | H16 | 120.3° | 120.0° |
| C28 | C29 | O7 | H17 | 120.3° | 120.0° |
| C29 | C28 | C13 | H3 | 175.4° | 173.9° |
| C28 | C29 | H16 | H17 | 119.1° | 119.9° |
| C29 | C28 | H18 | H19 | 118.3° | 120.0° |
| C28 | C29 | O7 | H54 | 180.0° | 167.6° |
| O7 | C29 | H16 | H17 | 119.2° | 120.1° |
| O7 | C29 | C28 | H18 | 74.7° | 52.4° |
| O7 | C29 | C28 | H19 | 44.3° | 67.6° |
| H1 | C12 | C13 | H3 | 80.4° | 168.9° |
| H1 | C12 | C11 | H36 | 175.7° | 122.0° |
| H2 | C12 | C13 | H3 | 161.0° | 71.2° |
| H2 | C12 | C11 | H36 | 65.7° | 2.1° |
| H3 | C13 | C14 | H4 | 158.9° | 135.4° |
| H3 | C13 | C28 | H18 | 64.1° | 53.9° |
| H3 | C13 | C28 | H19 | 54.9° | 66.1° |
| H4 | C14 | C15 | H5 | 64.8° | 128.8° |
| H5 | C15 | C16 | H6 | 83.6° | 100.8° |
| H5 | C15 | C19 | H9 | 64.7° | 172.4° |
| H5 | C15 | C19 | H10 | 55.3° | 52.4° |
| H5 | C15 | C19 | H11 | 175.4° | 67.6° |
| H6 | C16 | C17 | H7 | 62.3° | 103.6° |
| H6 | C16 | C17 | H8 | 178.4° | 136.4° |
| H6 | C16 | O3 | H52 | 63.0° | 60.0° |
| H9 | C19 | H10 | H11 | 120.0° | 120.0° |
| H12 | C22 | C23 | H13 | 57.7° | 57.0° |
| H12 | C22 | C23 | H14 | 176.7° | 177.2° |
| H12 | C22 | C21 | H39 | 177.4° | 177.2° |
| H13 | C23 | C24 | H15 | 50.2° | 57.5° |
| H14 | C23 | C24 | H15 | 169.2° | 177.7° |
| H15 | C24 | C25 | H26 | 58.8° | 180.0° |
| H15 | C24 | C25 | H27 | 61.2° | 59.9° |
| H15 | C24 | C25 | H28 | 178.8° | 60.0° |
| H16 | C29 | C28 | H18 | 165.1° | 172.4° |
| H16 | C29 | C28 | H19 | 76.0° | 52.4° |
| H16 | C29 | O7 | H54 | 59.7° | 72.4° |
| H17 | C29 | C28 | H18 | 45.6° | 67.7° |
| H17 | C29 | C28 | H19 | 164.6° | 172.3° |
| H17 | C29 | O7 | H54 | 59.7° | 47.6° |
| H20 | C27 | H21 | H22 | 120.0° | 120.0° |
| H23 | C26 | H24 | H25 | 120.0° | 120.0° |
| H26 | C25 | H27 | H28 | 120.0° | 120.1° |
| H29 | C30 | H30 | H31 | 120.0° | 120.1° |
| H29 | C30 | C11 | H36 | 63.4° | 153.5° |
| H30 | C30 | C11 | H36 | 56.6° | 33.4° |
| H31 | C30 | C11 | H36 | 176.6° | 86.5° |
| H33 | C | H34 | H35 | 120.0° | 120.0° |
| H37 | C2 | C3 | H40 | 173.1° | 133.2° |
| H38 | C20 | C21 | H39 | 178.3° | 177.7° |
| H39 | C21 | O6 | H53 | 59.5° | 59.9° |
| H40 | C3 | C4 | H41 | 170.6° | 150.3° |
| H40 | C3 | C7 | H47 | 65.7° | 56.1° |
| H40 | C3 | C7 | H48 | 174.4° | 63.9° |
| H40 | C3 | C7 | H49 | 54.4° | 176.1° |
| H41 | C4 | C5 | H42 | 169.4° | 56.0° |
| H41 | C4 | C5 | H43 | 51.9° | 64.0° |
| H42 | C5 | C6 | H44 | 58.7° | 55.5° |
| H42 | C5 | C6 | H45 | 61.3° | 175.4° |
| H42 | C5 | C6 | H46 | 178.7° | 64.5° |
| H43 | C5 | C6 | H44 | 58.7° | 64.5° |
| H43 | C5 | C6 | H45 | 178.7° | 55.4° |
| H43 | C5 | C6 | H46 | 61.3° | 175.5° |
| H44 | C6 | H45 | H46 | 120.0° | 120.1° |
| H47 | C7 | H48 | H49 | 120.0° | 120.0° |
| H50 | C8 | C9 | H51 | 168.2° | 179.9° |
