LMB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C16 | sing | 1.53Å | 1.53Å | |
| C27 | C26 | sing | 1.53Å | 1.51Å | |
| C26 | C8 | sing | 1.51Å | 1.52Å | |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | doub | 1.33Å | 1.33Å | |
| C13 | C14 | sing | 1.47Å | 1.48Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C15 | C14 | doub | 1.33Å | 1.35Å | |
| O2 | C5 | sing | 1.43Å | 1.44Å | |
| C8 | C9 | doub | 1.33Å | 1.35Å | |
| C8 | C7 | sing | 1.47Å | 1.49Å | |
| C9 | C10 | sing | 1.51Å | 1.51Å | |
| C16 | C17 | sing | 1.51Å | 1.50Å | |
| C14 | C29 | sing | 1.51Å | 1.51Å | |
| C7 | C6 | doub | 1.33Å | 1.33Å | |
| C6 | C5 | sing | 1.51Å | 1.51Å | |
| C10 | C28 | sing | 1.53Å | 1.52Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| O3 | C17 | doub | 1.21Å | 1.22Å | |
| C17 | C18 | sing | 1.51Å | 1.50Å | |
| C25 | C4 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| O1 | C1 | doub | 1.21Å | 1.25Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C1 | O1' | sing | 1.34Å | 1.25Å | |
| C31 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C33 | C22 | sing | 1.51Å | 1.50Å | |
| C19 | C20 | sing | 1.53Å | 1.53Å | |
| C19 | O4 | sing | 1.43Å | 1.43Å | |
| C20 | C32 | sing | 1.53Å | 1.53Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| O6 | C24 | doub | 1.22Å | 1.25Å | |
| C22 | C21 | sing | 1.51Å | 1.51Å | |
| C22 | C23 | doub | 1.33Å | 1.35Å | |
| C24 | C23 | sing | 1.47Å | 1.48Å | |
| C24 | O5 | sing | 1.35Å | 1.25Å | |
| O5 | H1 | sing | 0.97Å | 0.95Å | |
| C23 | H2 | sing | 1.08Å | 1.08Å | |
| C33 | H3 | sing | 1.09Å | 1.10Å | |
| C33 | H4 | sing | 1.09Å | 1.10Å | |
| C33 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C32 | H9 | sing | 1.09Å | 1.10Å | |
| C32 | H10 | sing | 1.09Å | 1.10Å | |
| C32 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| O4 | H13 | sing | 0.97Å | 0.95Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C31 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.08Å | 1.08Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C13 | H26 | sing | 1.08Å | 1.08Å | |
| C12 | H27 | sing | 1.08Å | 1.08Å | |
| C11 | H28 | sing | 1.09Å | 1.10Å | |
| C11 | H29 | sing | 1.09Å | 1.10Å | |
| C10 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C9 | H34 | sing | 1.08Å | 1.08Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C26 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| C7 | H40 | sing | 1.08Å | 1.08Å | |
| C6 | H41 | sing | 1.08Å | 1.08Å | |
| C5 | H42 | sing | 1.09Å | 1.10Å | |
| O2 | H43 | sing | 0.97Å | 0.95Å | |
| C4 | H44 | sing | 1.09Å | 1.10Å | |
| C25 | H45 | sing | 1.09Å | 1.10Å | |
| C25 | H46 | sing | 1.09Å | 1.10Å | |
| C25 | H47 | sing | 1.09Å | 1.10Å | |
| C3 | H48 | sing | 1.09Å | 1.10Å | |
| C3 | H49 | sing | 1.09Å | 1.10Å | |
| C2 | H50 | sing | 1.09Å | 1.10Å | |
| C2 | H51 | sing | 1.09Å | 1.10Å | |
| O1' | H52 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C30 | C16 | C15 | 107.5° | 109.5° |
| C30 | C16 | C17 | 109.0° | 109.5° |
| C30 | C16 | H18 | 109.5° | 109.4° |
| C16 | C30 | H19 | 109.5° | 109.5° |
| C16 | C30 | H20 | 109.5° | 109.4° |
| C16 | C30 | H21 | 109.4° | 109.4° |
| C27 | C26 | C8 | 113.5° | 109.5° |
| C27 | C26 | H35 | 108.4° | 109.4° |
| C27 | C26 | H36 | 108.5° | 109.5° |
| C26 | C27 | H37 | 109.5° | 109.5° |
| C26 | C27 | H38 | 109.5° | 109.4° |
| C26 | C27 | H39 | 109.5° | 109.5° |
| C26 | C8 | C9 | 119.4° | 120.0° |
| C26 | C8 | C7 | 118.4° | 120.0° |
| C8 | C26 | H35 | 108.5° | 109.5° |
| C8 | C26 | H36 | 108.4° | 109.5° |
| C12 | C11 | C10 | 110.2° | 109.5° |
| C11 | C12 | C13 | 118.5° | 120.0° |
| C11 | C12 | H27 | 120.7° | 120.0° |
| C12 | C11 | H28 | 109.3° | 109.4° |
| C12 | C11 | H29 | 109.3° | 109.5° |
| C11 | C10 | C9 | 110.1° | 109.5° |
| C11 | C10 | C28 | 110.5° | 109.5° |
| C10 | C11 | H28 | 109.3° | 109.4° |
| C10 | C11 | H29 | 109.3° | 109.5° |
| C11 | C10 | H30 | 109.6° | 109.4° |
| C12 | C13 | C14 | 122.9° | 120.0° |
| C12 | C13 | H26 | 118.6° | 120.0° |
| C13 | C12 | H27 | 120.8° | 120.0° |
| C13 | C14 | C15 | 116.6° | 120.0° |
| C13 | C14 | C29 | 120.8° | 120.0° |
| C14 | C13 | H26 | 118.5° | 120.0° |
| C16 | C15 | C14 | 123.5° | 120.0° |
| C15 | C16 | C17 | 111.3° | 109.5° |
| C15 | C16 | H18 | 109.6° | 109.5° |
| C16 | C15 | H22 | 118.2° | 120.0° |
| C15 | C14 | C29 | 122.6° | 120.0° |
| C14 | C15 | H22 | 118.3° | 120.0° |
| O2 | C5 | C6 | 104.6° | 109.5° |
| O2 | C5 | C4 | 108.7° | 109.5° |
| O2 | C5 | H42 | 109.5° | 109.4° |
| C5 | O2 | H43 | 109.5° | 114.0° |
| C9 | C8 | C7 | 122.2° | 120.0° |
| C8 | C9 | C10 | 125.4° | 120.0° |
| C8 | C9 | H34 | 117.3° | 120.0° |
| C8 | C7 | C6 | 122.2° | 120.0° |
| C8 | C7 | H40 | 118.9° | 120.0° |
| C9 | C10 | C28 | 107.6° | 109.5° |
| C9 | C10 | H30 | 109.6° | 109.5° |
| C10 | C9 | H34 | 117.3° | 120.0° |
| C16 | C17 | O3 | 119.1° | 119.9° |
| C16 | C17 | C18 | 119.3° | 120.0° |
| C17 | C16 | H18 | 109.9° | 109.4° |
| C14 | C29 | H23 | 109.5° | 109.4° |
| C14 | C29 | H24 | 109.4° | 109.5° |
| C14 | C29 | H25 | 109.5° | 109.5° |
| C7 | C6 | C5 | 119.5° | 120.0° |
| C6 | C7 | H40 | 118.9° | 120.0° |
| C7 | C6 | H41 | 120.2° | 120.0° |
| C6 | C5 | C4 | 117.1° | 109.5° |
| C5 | C6 | H41 | 120.2° | 120.0° |
| C6 | C5 | H42 | 108.5° | 109.4° |
| C28 | C10 | H30 | 109.4° | 109.5° |
| C10 | C28 | H31 | 109.5° | 109.5° |
| C10 | C28 | H32 | 109.5° | 109.5° |
| C10 | C28 | H33 | 109.5° | 109.5° |
| C5 | C4 | C25 | 111.2° | 109.5° |
| C5 | C4 | C3 | 111.4° | 109.5° |
| C4 | C5 | H42 | 108.3° | 109.5° |
| C5 | C4 | H44 | 108.0° | 109.4° |
| O3 | C17 | C18 | 121.6° | 120.0° |
| C17 | C18 | C31 | 107.5° | 109.4° |
| C17 | C18 | C19 | 112.2° | 109.5° |
| C17 | C18 | H14 | 109.0° | 109.5° |
| C25 | C4 | C3 | 109.9° | 109.5° |
| C25 | C4 | H44 | 108.2° | 109.5° |
| C4 | C25 | H45 | 109.5° | 109.5° |
| C4 | C25 | H46 | 109.5° | 109.5° |
| C4 | C25 | H47 | 109.5° | 109.5° |
| C3 | C2 | C1 | 114.1° | 109.5° |
| C2 | C3 | C4 | 111.3° | 109.5° |
| C2 | C3 | H48 | 109.0° | 109.5° |
| C2 | C3 | H49 | 109.0° | 109.5° |
| C3 | C2 | H50 | 108.3° | 109.5° |
| C3 | C2 | H51 | 108.3° | 109.5° |
| C2 | C1 | O1 | 119.2° | 120.0° |
| C2 | C1 | O1' | 116.8° | 120.0° |
| C1 | C2 | H50 | 108.3° | 109.5° |
| C1 | C2 | H51 | 108.3° | 109.5° |
| O1 | C1 | O1' | 123.9° | 120.0° |
| C3 | C4 | H44 | 108.0° | 109.4° |
| C4 | C3 | H48 | 109.0° | 109.4° |
| C4 | C3 | H49 | 109.0° | 109.4° |
| C1 | O1' | H52 | 109.5° | 117.0° |
| C31 | C18 | C19 | 110.9° | 109.5° |
| C31 | C18 | H14 | 108.6° | 109.5° |
| C18 | C31 | H15 | 109.5° | 109.5° |
| C18 | C31 | H16 | 109.5° | 109.5° |
| C18 | C31 | H17 | 109.5° | 109.5° |
| C18 | C19 | C20 | 114.8° | 109.5° |
| C18 | C19 | O4 | 109.1° | 109.4° |
| C18 | C19 | H12 | 107.9° | 109.5° |
| C19 | C18 | H14 | 108.6° | 109.5° |
| C33 | C22 | C21 | 118.9° | 120.1° |
| C33 | C22 | C23 | 121.6° | 120.0° |
| C22 | C33 | H3 | 109.5° | 109.4° |
| C22 | C33 | H4 | 109.5° | 109.4° |
| C22 | C33 | H5 | 109.5° | 109.4° |
| C20 | C19 | O4 | 107.7° | 109.5° |
| C19 | C20 | C32 | 111.0° | 109.5° |
| C19 | C20 | C21 | 112.1° | 109.5° |
| C19 | C20 | H8 | 107.9° | 109.5° |
| C20 | C19 | H12 | 108.0° | 109.4° |
| O4 | C19 | H12 | 109.3° | 109.5° |
| C19 | O4 | H13 | 109.5° | 114.0° |
| C32 | C20 | C21 | 109.6° | 109.4° |
| C32 | C20 | H8 | 108.0° | 109.4° |
| C20 | C32 | H9 | 109.5° | 109.5° |
| C20 | C32 | H10 | 109.5° | 109.5° |
| C20 | C32 | H11 | 109.5° | 109.4° |
| C20 | C21 | C22 | 110.9° | 109.5° |
| C20 | C21 | H6 | 109.1° | 109.4° |
| C20 | C21 | H7 | 109.1° | 109.5° |
| C21 | C20 | H8 | 108.0° | 109.5° |
| O6 | C24 | C23 | 121.3° | 120.0° |
| O6 | C24 | O5 | 120.2° | 120.0° |
| C21 | C22 | C23 | 119.5° | 120.0° |
| C22 | C21 | H6 | 109.1° | 109.4° |
| C22 | C21 | H7 | 109.1° | 109.5° |
| C22 | C23 | C24 | 122.6° | 120.0° |
| C22 | C23 | H2 | 118.7° | 120.0° |
| C23 | C24 | O5 | 118.6° | 120.0° |
| C24 | C23 | H2 | 118.7° | 120.0° |
| C24 | O5 | H1 | 109.5° | 117.0° |
| H3 | C33 | H4 | 109.5° | 109.5° |
| H3 | C33 | H5 | 109.5° | 109.5° |
| H4 | C33 | H5 | 109.5° | 109.5° |
| H6 | C21 | H7 | 109.5° | 109.5° |
| H9 | C32 | H10 | 109.5° | 109.5° |
| H9 | C32 | H11 | 109.4° | 109.4° |
| H10 | C32 | H11 | 109.4° | 109.4° |
| H15 | C31 | H16 | 109.5° | 109.4° |
| H15 | C31 | H17 | 109.4° | 109.5° |
| H16 | C31 | H17 | 109.5° | 109.4° |
| H19 | C30 | H20 | 109.5° | 109.5° |
| H19 | C30 | H21 | 109.5° | 109.5° |
| H20 | C30 | H21 | 109.5° | 109.5° |
| H23 | C29 | H24 | 109.5° | 109.4° |
| H23 | C29 | H25 | 109.4° | 109.5° |
| H24 | C29 | H25 | 109.5° | 109.5° |
| H28 | C11 | H29 | 109.4° | 109.5° |
| H31 | C28 | H32 | 109.5° | 109.5° |
| H31 | C28 | H33 | 109.4° | 109.4° |
| H32 | C28 | H33 | 109.5° | 109.5° |
| H35 | C26 | H36 | 109.5° | 109.5° |
| H37 | C27 | H38 | 109.5° | 109.5° |
| H37 | C27 | H39 | 109.5° | 109.5° |
| H38 | C27 | H39 | 109.4° | 109.5° |
| H45 | C25 | H46 | 109.5° | 109.5° |
| H45 | C25 | H47 | 109.4° | 109.4° |
| H46 | C25 | H47 | 109.5° | 109.5° |
| H48 | C3 | H49 | 109.5° | 109.5° |
| H50 | C2 | H51 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C30 | C16 | C15 | C17 | 119.3° | 120.0° |
| C30 | C16 | C15 | H18 | 118.9° | 119.9° |
| C30 | C16 | C15 | C14 | 137.6° | 125.0° |
| C30 | C16 | C17 | H18 | 120.0° | 119.9° |
| C30 | C16 | C17 | O3 | 42.4° | 95.0° |
| C30 | C16 | C17 | C18 | 136.5° | 85.0° |
| C16 | C30 | H19 | H20 | 120.0° | 120.0° |
| C16 | C30 | H19 | H21 | 120.0° | 119.9° |
| C16 | C30 | H20 | H21 | 120.0° | 119.9° |
| C30 | C16 | C15 | H22 | 42.4° | 55.1° |
| C27 | C26 | C8 | H35 | 120.6° | 120.0° |
| C27 | C26 | C8 | H36 | 120.6° | 120.0° |
| C27 | C26 | C8 | C9 | 3.5° | 95.0° |
| C27 | C26 | C8 | C7 | 175.2° | 85.0° |
| C27 | C26 | H35 | H36 | 118.2° | 120.0° |
| C26 | C27 | H37 | H38 | 120.0° | 120.0° |
| C26 | C27 | H37 | H39 | 120.0° | 120.0° |
| C26 | C27 | H38 | H39 | 120.0° | 120.0° |
| C26 | C8 | C9 | C7 | 178.7° | 180.0° |
| C26 | C8 | C9 | C10 | 179.5° | 174.9° |
| C26 | C8 | C7 | C6 | 5.3° | 5.2° |
| C26 | C8 | C9 | H34 | 0.4° | 5.1° |
| C8 | C26 | H35 | H36 | 118.2° | 120.0° |
| C8 | C26 | C27 | H37 | 180.0° | 180.0° |
| C8 | C26 | C27 | H38 | 60.0° | 60.0° |
| C8 | C26 | C27 | H39 | 60.0° | 60.0° |
| C26 | C8 | C7 | H40 | 174.7° | 174.8° |
| C12 | C11 | C10 | H28 | 120.1° | 119.9° |
| C12 | C11 | C10 | H29 | 120.1° | 120.1° |
| C11 | C12 | C13 | H27 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 178.6° | 180.0° |
| C12 | C11 | C10 | C9 | 169.9° | 175.0° |
| C12 | C11 | C10 | C28 | 71.4° | 65.0° |
| C11 | C12 | C13 | H26 | 1.4° | 0.1° |
| C12 | C11 | H28 | H29 | 119.7° | 120.0° |
| C12 | C11 | C10 | H30 | 49.3° | 55.0° |
| C10 | C11 | C12 | C13 | 135.7° | 125.0° |
| C11 | C10 | C9 | C8 | 125.2° | 125.1° |
| C11 | C10 | C9 | C28 | 120.5° | 120.0° |
| C11 | C10 | C9 | H30 | 120.6° | 120.0° |
| C11 | C10 | C28 | H30 | 120.7° | 120.0° |
| C10 | C11 | C12 | H27 | 44.3° | 55.0° |
| C10 | C11 | H28 | H29 | 119.6° | 120.0° |
| C11 | C10 | C28 | H31 | 180.0° | 60.0° |
| C11 | C10 | C28 | H32 | 60.0° | 180.0° |
| C11 | C10 | C28 | H33 | 60.0° | 60.0° |
| C11 | C10 | C9 | H34 | 54.8° | 54.9° |
| C12 | C13 | C14 | H26 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 174.5° | 180.0° |
| C12 | C13 | C14 | C29 | 4.2° | 0.1° |
| C13 | C12 | C11 | H28 | 15.6° | 115.1° |
| C13 | C12 | C11 | H29 | 104.2° | 4.9° |
| C13 | C14 | C15 | C16 | 178.2° | 175.5° |
| C13 | C14 | C15 | C29 | 178.7° | 179.9° |
| C13 | C14 | C15 | H22 | 1.8° | 4.5° |
| C13 | C14 | C29 | H23 | 180.0° | 86.2° |
| C13 | C14 | C29 | H24 | 60.0° | 33.8° |
| C13 | C14 | C29 | H25 | 60.0° | 153.8° |
| C14 | C13 | C12 | H27 | 1.3° | 0.1° |
| C16 | C15 | C14 | H22 | 180.0° | 179.9° |
| C15 | C16 | C17 | H18 | 121.7° | 120.0° |
| C16 | C15 | C14 | C29 | 0.5° | 4.4° |
| C15 | C16 | C17 | O3 | 76.0° | 25.0° |
| C15 | C16 | C17 | C18 | 105.1° | 155.0° |
| C15 | C16 | C30 | H19 | 180.0° | 180.0° |
| C15 | C16 | C30 | H20 | 60.0° | 59.9° |
| C15 | C16 | C30 | H21 | 60.0° | 60.0° |
| C14 | C15 | C16 | C17 | 103.1° | 115.0° |
| C14 | C15 | C16 | H18 | 18.7° | 5.0° |
| C15 | C14 | C29 | H23 | 1.3° | 93.9° |
| C15 | C14 | C29 | H24 | 121.3° | 146.2° |
| C15 | C14 | C29 | H25 | 118.7° | 26.1° |
| C15 | C14 | C13 | H26 | 5.5° | 0.1° |
| O2 | C5 | C6 | C7 | 120.7° | 120.0° |
| O2 | C5 | C6 | C4 | 120.3° | 120.0° |
| O2 | C5 | C6 | H42 | 116.8° | 119.9° |
| O2 | C5 | C4 | H42 | 118.9° | 120.0° |
| O2 | C5 | C4 | C25 | 67.6° | 55.1° |
| O2 | C5 | C4 | C3 | 55.4° | 65.0° |
| O2 | C5 | C6 | H41 | 59.3° | 60.1° |
| O2 | C5 | C4 | H44 | 173.8° | 175.0° |
| C8 | C9 | C10 | H34 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 176.0° | 174.8° |
| C8 | C9 | C10 | C28 | 114.4° | 114.9° |
| C8 | C9 | C10 | H30 | 4.6° | 5.1° |
| C9 | C8 | C26 | H35 | 117.1° | 145.0° |
| C9 | C8 | C26 | H36 | 124.1° | 25.0° |
| C9 | C8 | C7 | H40 | 4.0° | 5.2° |
| C7 | C8 | C9 | C10 | 1.8° | 5.1° |
| C8 | C7 | C6 | H40 | 180.0° | 180.0° |
| C8 | C7 | C6 | C5 | 178.3° | 180.0° |
| C7 | C8 | C9 | H34 | 178.3° | 174.9° |
| C7 | C8 | C26 | H35 | 64.2° | 35.0° |
| C7 | C8 | C26 | H36 | 54.6° | 155.0° |
| C8 | C7 | C6 | H41 | 1.7° | 0.1° |
| C9 | C10 | C28 | H30 | 119.1° | 120.0° |
| C9 | C10 | C11 | H28 | 69.9° | 65.1° |
| C9 | C10 | C11 | H29 | 49.8° | 55.0° |
| C9 | C10 | C28 | H31 | 59.8° | 60.0° |
| C9 | C10 | C28 | H32 | 179.8° | 60.0° |
| C9 | C10 | C28 | H33 | 60.2° | 180.0° |
| C16 | C17 | O3 | C18 | 178.9° | 180.0° |
| C16 | C17 | C18 | C31 | 85.0° | 90.0° |
| C16 | C17 | C18 | C19 | 152.8° | 150.0° |
| C16 | C17 | C18 | H14 | 32.5° | 30.0° |
| C17 | C16 | C30 | H19 | 59.2° | 59.9° |
| C17 | C16 | C30 | H20 | 179.3° | 180.0° |
| C17 | C16 | C30 | H21 | 60.8° | 60.1° |
| C17 | C16 | C15 | H22 | 76.9° | 64.9° |
| C29 | C14 | C15 | H22 | 179.5° | 175.6° |
| C14 | C29 | H23 | H24 | 120.0° | 119.9° |
| C14 | C29 | H23 | H25 | 120.0° | 120.0° |
| C14 | C29 | H24 | H25 | 120.0° | 120.1° |
| C29 | C14 | C13 | H26 | 175.8° | 180.0° |
| C7 | C6 | C5 | H41 | 180.0° | 179.9° |
| C7 | C6 | C5 | C4 | 118.9° | 120.0° |
| C7 | C6 | C5 | H42 | 4.0° | 0.1° |
| C6 | C5 | C4 | H42 | 123.0° | 120.0° |
| C6 | C5 | C4 | C25 | 50.5° | 65.0° |
| C6 | C5 | C4 | C3 | 173.5° | 175.0° |
| C5 | C6 | C7 | H40 | 1.6° | 0.0° |
| C6 | C5 | O2 | H43 | 180.0° | 60.1° |
| C6 | C5 | C4 | H44 | 68.1° | 55.0° |
| C28 | C10 | C11 | H28 | 48.8° | 54.9° |
| C28 | C10 | C11 | H29 | 168.5° | 175.0° |
| C10 | C28 | H31 | H32 | 120.0° | 120.0° |
| C10 | C28 | H31 | H33 | 120.0° | 120.0° |
| C10 | C28 | H32 | H33 | 120.0° | 120.0° |
| C28 | C10 | C9 | H34 | 65.6° | 65.1° |
| C5 | C4 | C25 | C3 | 123.9° | 120.1° |
| C5 | C4 | C25 | H44 | 118.5° | 120.0° |
| C5 | C4 | C3 | C2 | 39.7° | 175.0° |
| C5 | C4 | C3 | H44 | 118.5° | 120.0° |
| C4 | C5 | C6 | H41 | 61.1° | 59.9° |
| C4 | C5 | O2 | H43 | 54.2° | 60.0° |
| C5 | C4 | C25 | H45 | 180.0° | 60.0° |
| C5 | C4 | C25 | H46 | 60.0° | 60.1° |
| C5 | C4 | C25 | H47 | 60.0° | 180.0° |
| C5 | C4 | C3 | H48 | 80.6° | 65.0° |
| C5 | C4 | C3 | H49 | 159.9° | 55.0° |
| O3 | C17 | C18 | C31 | 93.8° | 90.0° |
| O3 | C17 | C18 | C19 | 28.4° | 30.0° |
| O3 | C17 | C18 | H14 | 148.7° | 150.0° |
| O3 | C17 | C16 | H18 | 162.4° | 145.1° |
| C17 | C18 | C31 | C19 | 122.9° | 120.0° |
| C17 | C18 | C31 | H14 | 117.8° | 120.0° |
| C17 | C18 | C19 | H14 | 120.5° | 120.0° |
| C17 | C18 | C19 | C20 | 62.9° | 65.1° |
| C17 | C18 | C19 | O4 | 176.1° | 174.9° |
| C17 | C18 | C19 | H12 | 57.5° | 54.9° |
| C17 | C18 | C31 | H15 | 180.0° | 65.0° |
| C17 | C18 | C31 | H16 | 60.0° | 175.1° |
| C17 | C18 | C31 | H17 | 60.0° | 55.1° |
| C18 | C17 | C16 | H18 | 16.5° | 34.9° |
| C25 | C4 | C3 | C2 | 163.4° | 65.0° |
| C25 | C4 | C3 | H44 | 117.8° | 120.0° |
| C25 | C4 | C5 | H42 | 173.6° | 175.0° |
| C4 | C25 | H45 | H46 | 120.0° | 120.0° |
| C4 | C25 | H45 | H47 | 120.0° | 120.0° |
| C4 | C25 | H46 | H47 | 120.0° | 120.0° |
| C25 | C4 | C3 | H48 | 43.1° | 55.0° |
| C25 | C4 | C3 | H49 | 76.4° | 175.0° |
| C3 | C2 | C1 | H50 | 120.7° | 120.0° |
| C3 | C2 | C1 | H51 | 120.7° | 120.0° |
| C3 | C2 | C1 | O1 | 39.6° | 0.0° |
| C2 | C3 | C4 | H48 | 120.3° | 120.0° |
| C2 | C3 | C4 | H49 | 120.3° | 120.0° |
| C3 | C2 | C1 | O1' | 141.9° | 179.9° |
| C2 | C3 | C4 | H44 | 78.8° | 55.1° |
| C2 | C3 | H48 | H49 | 119.2° | 120.1° |
| C3 | C2 | H50 | H51 | 117.9° | 120.0° |
| C2 | C1 | O1 | O1' | 178.5° | 180.0° |
| C1 | C2 | C3 | C4 | 176.3° | 180.0° |
| C1 | C2 | C3 | H48 | 63.4° | 60.0° |
| C1 | C2 | C3 | H49 | 56.0° | 60.0° |
| C1 | C2 | H50 | H51 | 117.9° | 120.0° |
| C2 | C1 | O1' | H52 | 178.5° | 180.0° |
| O1 | C1 | C2 | H50 | 81.1° | 120.0° |
| O1 | C1 | C2 | H51 | 160.2° | 120.0° |
| O1 | C1 | O1' | H52 | 0.0° | 0.1° |
| C3 | C4 | C5 | H42 | 63.5° | 55.0° |
| C3 | C4 | C25 | H45 | 56.1° | 180.0° |
| C3 | C4 | C25 | H46 | 176.2° | 60.0° |
| C3 | C4 | C25 | H47 | 63.8° | 60.0° |
| C4 | C3 | H48 | H49 | 119.2° | 119.9° |
| C4 | C3 | C2 | H50 | 63.0° | 60.0° |
| C4 | C3 | C2 | H51 | 55.6° | 59.9° |
| O1' | C1 | C2 | H50 | 97.5° | 59.9° |
| O1' | C1 | C2 | H51 | 21.2° | 60.0° |
| C31 | C18 | C19 | H14 | 119.3° | 120.0° |
| C31 | C18 | C19 | C20 | 176.9° | 174.9° |
| C31 | C18 | C19 | O4 | 55.9° | 54.9° |
| C31 | C18 | C19 | H12 | 62.7° | 65.1° |
| C18 | C31 | H15 | H16 | 120.0° | 120.0° |
| C18 | C31 | H15 | H17 | 120.0° | 120.1° |
| C18 | C31 | H16 | H17 | 120.0° | 120.1° |
| C18 | C19 | C20 | O4 | 121.8° | 120.0° |
| C18 | C19 | C20 | H12 | 120.4° | 120.0° |
| C18 | C19 | O4 | H12 | 117.8° | 120.0° |
| C18 | C19 | C20 | C32 | 67.4° | 64.9° |
| C18 | C19 | C20 | C21 | 169.6° | 175.2° |
| C18 | C19 | C20 | H8 | 50.8° | 55.1° |
| C18 | C19 | O4 | H13 | 180.0° | 60.0° |
| C19 | C18 | C31 | H15 | 57.0° | 55.0° |
| C19 | C18 | C31 | H16 | 177.1° | 64.9° |
| C19 | C18 | C31 | H17 | 62.9° | 175.1° |
| C33 | C22 | C21 | C20 | 62.6° | 85.0° |
| C33 | C22 | C21 | C23 | 178.3° | 180.0° |
| C33 | C22 | C23 | C24 | 2.2° | 7.2° |
| C33 | C22 | C23 | H2 | 177.8° | 172.8° |
| C22 | C33 | H3 | H4 | 120.0° | 120.0° |
| C22 | C33 | H3 | H5 | 120.0° | 119.9° |
| C22 | C33 | H4 | H5 | 120.0° | 120.0° |
| C33 | C22 | C21 | H6 | 57.6° | 35.0° |
| C33 | C22 | C21 | H7 | 177.2° | 155.0° |
| C20 | C19 | O4 | H12 | 117.0° | 120.0° |
| C19 | C20 | C32 | C21 | 124.4° | 120.0° |
| C19 | C20 | C32 | H8 | 118.2° | 120.0° |
| C19 | C20 | C21 | H8 | 118.8° | 120.1° |
| C19 | C20 | C21 | C22 | 58.8° | 175.0° |
| C19 | C20 | C21 | H6 | 179.0° | 55.1° |
| C19 | C20 | C21 | H7 | 61.4° | 64.9° |
| C19 | C20 | C32 | H9 | 180.0° | 175.2° |
| C19 | C20 | C32 | H10 | 60.0° | 64.7° |
| C19 | C20 | C32 | H11 | 60.0° | 55.2° |
| C20 | C19 | O4 | H13 | 54.8° | 60.0° |
| C20 | C19 | C18 | H14 | 57.6° | 54.9° |
| O4 | C19 | C20 | C32 | 54.3° | 55.1° |
| O4 | C19 | C20 | C21 | 68.6° | 64.8° |
| O4 | C19 | C20 | H8 | 172.6° | 175.1° |
| O4 | C19 | C18 | H14 | 63.4° | 65.1° |
| C32 | C20 | C21 | H8 | 117.5° | 120.0° |
| C32 | C20 | C21 | C22 | 177.5° | 65.0° |
| C32 | C20 | C21 | H6 | 57.3° | 175.1° |
| C32 | C20 | C21 | H7 | 62.3° | 55.0° |
| C20 | C32 | H9 | H10 | 120.0° | 120.1° |
| C20 | C32 | H9 | H11 | 120.0° | 120.0° |
| C20 | C32 | H10 | H11 | 120.0° | 119.9° |
| C32 | C20 | C19 | H12 | 172.2° | 175.1° |
| C20 | C21 | C22 | H6 | 120.2° | 119.9° |
| C20 | C21 | C22 | H7 | 120.2° | 120.1° |
| C20 | C21 | C22 | C23 | 115.8° | 95.0° |
| C20 | C21 | H6 | H7 | 119.4° | 120.1° |
| C21 | C20 | C32 | H9 | 55.6° | 55.2° |
| C21 | C20 | C32 | H10 | 175.6° | 175.3° |
| C21 | C20 | C32 | H11 | 64.4° | 64.7° |
| C21 | C20 | C19 | H12 | 49.3° | 55.2° |
| O6 | C24 | C23 | C22 | 6.7° | 4.2° |
| O6 | C24 | C23 | O5 | 179.5° | 179.7° |
| O6 | C24 | O5 | H1 | 0.0° | 0.0° |
| O6 | C24 | C23 | H2 | 173.3° | 175.8° |
| C21 | C22 | C23 | C24 | 179.5° | 172.8° |
| C21 | C22 | C23 | H2 | 0.5° | 7.2° |
| C21 | C22 | C33 | H3 | 180.0° | 95.3° |
| C21 | C22 | C33 | H4 | 60.0° | 144.6° |
| C21 | C22 | C33 | H5 | 60.0° | 24.6° |
| C22 | C21 | H6 | H7 | 119.4° | 120.0° |
| C22 | C21 | C20 | H8 | 60.0° | 54.9° |
| C22 | C23 | C24 | H2 | 180.0° | 180.0° |
| C22 | C23 | C24 | O5 | 172.8° | 175.6° |
| C23 | C22 | C33 | H3 | 1.7° | 84.7° |
| C23 | C22 | C33 | H4 | 118.3° | 35.4° |
| C23 | C22 | C33 | H5 | 121.7° | 155.4° |
| C23 | C22 | C21 | H6 | 124.0° | 145.1° |
| C23 | C22 | C21 | H7 | 4.4° | 25.0° |
| C23 | C24 | O5 | H1 | 179.5° | 179.7° |
| O5 | C24 | C23 | H2 | 7.2° | 4.5° |
| H3 | C33 | H4 | H5 | 120.0° | 120.1° |
| H6 | C21 | C20 | H8 | 60.2° | 65.0° |
| H7 | C21 | C20 | H8 | 179.8° | 175.0° |
| H8 | C20 | C32 | H9 | 61.9° | 64.8° |
| H8 | C20 | C32 | H10 | 58.2° | 55.3° |
| H8 | C20 | C32 | H11 | 178.2° | 175.3° |
| H8 | C20 | C19 | H12 | 69.6° | 64.9° |
| H9 | C32 | H10 | H11 | 119.9° | 120.0° |
| H12 | C19 | O4 | H13 | 62.2° | 180.0° |
| H12 | C19 | C18 | H14 | 178.0° | 174.9° |
| H14 | C18 | C31 | H15 | 62.2° | 175.0° |
| H14 | C18 | C31 | H16 | 57.8° | 55.1° |
| H14 | C18 | C31 | H17 | 177.8° | 64.9° |
| H15 | C31 | H16 | H17 | 120.0° | 119.9° |
| H18 | C16 | C30 | H19 | 61.0° | 60.0° |
| H18 | C16 | C30 | H20 | 59.0° | 60.0° |
| H18 | C16 | C30 | H21 | 179.0° | 180.0° |
| H18 | C16 | C15 | H22 | 161.3° | 175.0° |
| H19 | C30 | H20 | H21 | 120.0° | 120.1° |
| H23 | C29 | H24 | H25 | 120.0° | 120.0° |
| H26 | C13 | C12 | H27 | 178.7° | 180.0° |
| H27 | C12 | C11 | H28 | 164.5° | 65.0° |
| H27 | C12 | C11 | H29 | 75.8° | 175.0° |
| H28 | C11 | C10 | H30 | 169.4° | 174.9° |
| H29 | C11 | C10 | H30 | 70.9° | 65.0° |
| H30 | C10 | C28 | H31 | 59.3° | 180.0° |
| H30 | C10 | C28 | H32 | 60.7° | 60.0° |
| H30 | C10 | C28 | H33 | 179.3° | 60.0° |
| H30 | C10 | C9 | H34 | 175.4° | 174.9° |
| H31 | C28 | H32 | H33 | 120.0° | 120.0° |
| H35 | C26 | C27 | H37 | 59.4° | 60.0° |
| H35 | C26 | C27 | H38 | 60.6° | 180.0° |
| H35 | C26 | C27 | H39 | 179.5° | 60.0° |
| H36 | C26 | C27 | H37 | 59.4° | 60.0° |
| H36 | C26 | C27 | H38 | 179.4° | 60.0° |
| H36 | C26 | C27 | H39 | 60.6° | 180.0° |
| H37 | C27 | H38 | H39 | 120.0° | 120.0° |
| H40 | C7 | C6 | H41 | 178.4° | 179.9° |
| H41 | C6 | C5 | H42 | 176.0° | 180.0° |
| H42 | C5 | O2 | H43 | 63.9° | 180.0° |
| H42 | C5 | C4 | H44 | 55.0° | 65.0° |
| H44 | C4 | C25 | H45 | 61.5° | 60.0° |
| H44 | C4 | C25 | H46 | 58.5° | 180.0° |
| H44 | C4 | C25 | H47 | 178.5° | 60.0° |
| H44 | C4 | C3 | H48 | 160.9° | 175.0° |
| H44 | C4 | C3 | H49 | 41.5° | 65.0° |
| H45 | C25 | H46 | H47 | 120.0° | 120.0° |
| H48 | C3 | C2 | H50 | 57.2° | 180.0° |
| H48 | C3 | C2 | H51 | 175.9° | 60.0° |
| H49 | C3 | C2 | H50 | 176.7° | 60.0° |
| H49 | C3 | C2 | H51 | 64.7° | 180.0° |
