ZHU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C35 | C9 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.47Å | 1.52Å | |
| C17 | C18 | doub | 1.30Å | 1.33Å | |
| C14 | C13 | sing | 1.50Å | 1.51Å | |
| C14 | C15 | doub | 1.31Å | 1.34Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| O36 | C26 | doub | 1.23Å | 1.23Å | |
| C16 | C15 | sing | 1.51Å | 1.49Å | |
| C16 | C25 | sing | 1.51Å | 1.52Å | |
| C15 | C30 | sing | 1.50Å | 1.50Å | |
| C18 | C19 | sing | 1.51Å | 1.50Å | |
| O40 | C39 | sing | 1.34Å | 1.48Å | |
| C26 | C25 | sing | 1.51Å | 1.51Å | |
| C26 | C27 | sing | 1.45Å | 1.51Å | |
| O34 | C8 | sing | 1.43Å | 1.44Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C25 | C24 | sing | 1.52Å | 1.55Å | |
| C24 | C19 | sing | 1.52Å | 1.53Å | |
| C24 | C23 | sing | 1.52Å | 1.54Å | |
| C39 | C27 | doub | 1.39Å | 1.47Å | |
| C39 | C38 | sing | 1.52Å | 1.50Å | |
| C27 | C37 | sing | 1.46Å | 1.49Å | |
| C19 | C20 | sing | 1.52Å | 1.52Å | |
| C38 | N33 | sing | 1.47Å | 1.46Å | |
| C28 | C23 | sing | 1.52Å | 1.52Å | |
| C37 | O41 | doub | 1.21Å | 1.34Å | |
| C37 | N33 | sing | 1.35Å | 1.37Å | |
| C7 | C6 | sing | 1.54Å | 1.52Å | |
| C23 | C22 | sing | 1.52Å | 1.52Å | |
| N33 | C6 | sing | 1.46Å | 1.51Å | |
| C20 | C21 | sing | 1.52Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.51Å | 1.53Å | |
| O32 | C4 | doub | 1.21Å | 1.22Å | |
| C22 | C21 | sing | 1.51Å | 1.52Å | |
| C4 | C3 | sing | 1.46Å | 1.48Å | |
| C21 | C29 | sing | 1.53Å | 1.52Å | |
| C2 | C3 | doub | 1.34Å | 1.34Å | |
| C2 | C1 | sing | 1.51Å | 1.51Å | |
| C3 | C31 | sing | 1.51Å | 1.50Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.10Å | 1.10Å | |
| C13 | H11 | sing | 1.08Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.08Å | |
| C16 | H13 | sing | 1.13Å | 1.10Å | |
| C17 | H14 | sing | 1.08Å | 1.08Å | |
| C18 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.10Å | 1.10Å | |
| C2 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.10Å | 1.10Å | |
| C20 | H21 | sing | 1.10Å | 1.10Å | |
| C21 | H22 | sing | 1.12Å | 1.10Å | |
| C22 | H23 | sing | 1.10Å | 1.10Å | |
| C22 | H24 | sing | 1.10Å | 1.10Å | |
| C23 | H25 | sing | 1.12Å | 1.10Å | |
| C24 | H26 | sing | 1.13Å | 1.10Å | |
| C25 | H27 | sing | 1.10Å | 1.10Å | |
| C28 | H29 | sing | 1.09Å | 1.10Å | |
| C28 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C29 | H33 | sing | 1.09Å | 1.10Å | |
| C29 | H34 | sing | 1.09Å | 1.10Å | |
| C30 | H35 | sing | 1.09Å | 1.10Å | |
| C30 | H36 | sing | 1.09Å | 1.10Å | |
| C30 | H37 | sing | 1.09Å | 1.10Å | |
| C31 | H38 | sing | 1.09Å | 1.10Å | |
| C31 | H39 | sing | 1.09Å | 1.10Å | |
| C31 | H40 | sing | 1.09Å | 1.10Å | |
| C35 | H41 | sing | 1.09Å | 1.10Å | |
| C35 | H42 | sing | 1.09Å | 1.10Å | |
| C35 | H43 | sing | 1.09Å | 1.10Å | |
| C38 | H44 | sing | 1.09Å | 1.10Å | |
| C5 | H45 | sing | 1.09Å | 1.10Å | |
| C5 | H46 | sing | 1.09Å | 1.10Å | |
| C6 | H47 | sing | 1.09Å | 1.10Å | |
| C7 | H48 | sing | 1.09Å | 1.10Å | |
| C7 | H49 | sing | 1.09Å | 1.10Å | |
| C8 | H50 | sing | 1.10Å | 1.10Å | |
| C9 | H51 | sing | 1.10Å | 1.10Å | |
| O34 | H52 | sing | 0.97Å | 0.95Å | |
| O40 | H53 | sing | 0.97Å | 0.95Å | |
| C38 | H15 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C9 | 108.3° | 111.5° |
| C10 | C11 | C12 | 112.3° | 109.1° |
| C11 | C10 | H4 | 109.8° | 109.4° |
| C11 | C10 | H5 | 109.7° | 109.1° |
| C10 | C11 | H6 | 108.8° | 109.6° |
| C10 | C11 | H7 | 108.8° | 110.9° |
| C10 | C9 | C35 | 112.9° | 110.4° |
| C10 | C9 | C8 | 109.8° | 109.8° |
| C9 | C10 | H4 | 109.8° | 109.1° |
| C9 | C10 | H5 | 109.8° | 109.3° |
| C10 | C9 | H51 | 107.2° | 108.1° |
| C11 | C12 | C13 | 111.2° | 109.0° |
| C12 | C11 | H6 | 108.8° | 108.6° |
| C12 | C11 | H7 | 108.8° | 108.6° |
| C11 | C12 | H8 | 109.1° | 109.9° |
| C11 | C12 | H9 | 109.1° | 109.2° |
| C35 | C9 | C8 | 112.4° | 111.1° |
| C9 | C35 | H41 | 109.5° | 109.4° |
| C9 | C35 | H42 | 109.5° | 109.5° |
| C9 | C35 | H43 | 109.5° | 109.4° |
| C35 | C9 | H51 | 107.1° | 108.7° |
| C12 | C13 | C14 | 110.2° | 109.9° |
| C13 | C12 | H8 | 109.0° | 109.5° |
| C13 | C12 | H9 | 109.1° | 109.2° |
| C12 | C13 | H10 | 109.3° | 108.2° |
| C12 | C13 | H11 | 109.3° | 109.6° |
| C16 | C17 | C18 | 121.3° | 126.6° |
| C17 | C16 | C15 | 112.0° | 111.5° |
| C17 | C16 | C25 | 113.2° | 115.2° |
| C17 | C16 | H13 | 108.2° | 105.2° |
| C16 | C17 | H14 | 119.4° | 117.0° |
| C17 | C18 | C19 | 117.9° | 116.5° |
| C18 | C17 | H14 | 119.3° | 116.4° |
| C17 | C18 | H16 | 121.0° | 121.5° |
| C13 | C14 | C15 | 122.4° | 124.3° |
| C14 | C13 | H10 | 109.3° | 108.8° |
| C14 | C13 | H11 | 109.3° | 112.7° |
| C13 | C14 | H12 | 118.8° | 118.6° |
| C14 | C15 | C16 | 118.7° | 116.8° |
| C14 | C15 | C30 | 120.3° | 120.8° |
| C15 | C14 | H12 | 118.8° | 117.2° |
| C9 | C8 | O34 | 109.8° | 109.7° |
| C9 | C8 | C7 | 112.2° | 111.6° |
| C9 | C8 | H50 | 107.0° | 108.6° |
| C8 | C9 | H51 | 107.1° | 108.6° |
| O36 | C26 | C25 | 118.4° | 118.0° |
| O36 | C26 | C27 | 117.8° | 119.1° |
| C15 | C16 | C25 | 106.5° | 114.4° |
| C16 | C15 | C30 | 121.0° | 122.3° |
| C15 | C16 | H13 | 108.6° | 104.0° |
| C16 | C25 | C26 | 105.8° | 107.9° |
| C16 | C25 | C24 | 108.1° | 113.2° |
| C25 | C16 | H13 | 108.2° | 105.2° |
| C16 | C25 | H27 | 109.2° | 110.7° |
| C15 | C30 | H35 | 109.5° | 109.4° |
| C15 | C30 | H36 | 109.5° | 109.5° |
| C15 | C30 | H37 | 109.5° | 109.5° |
| C18 | C19 | C24 | 109.8° | 109.0° |
| C18 | C19 | C20 | 111.0° | 111.9° |
| C19 | C18 | H16 | 121.0° | 121.9° |
| C18 | C19 | H18 | 109.4° | 107.3° |
| O40 | C39 | C27 | 121.4° | 127.3° |
| O40 | C39 | C38 | 120.8° | 126.3° |
| C39 | O40 | H53 | 109.5° | 117.0° |
| C25 | C26 | C27 | 123.8° | 123.0° |
| C26 | C25 | C24 | 115.4° | 111.1° |
| C26 | C25 | H27 | 109.3° | 106.1° |
| C26 | C27 | C39 | 127.8° | 124.9° |
| C26 | C27 | C37 | 133.6° | 127.2° |
| O34 | C8 | C7 | 112.4° | 110.1° |
| O34 | C8 | H50 | 108.1° | 108.3° |
| C8 | O34 | H52 | 109.5° | 114.0° |
| C8 | C7 | C6 | 110.8° | 109.7° |
| C8 | C7 | H48 | 109.1° | 110.0° |
| C8 | C7 | H49 | 109.1° | 111.0° |
| C7 | C8 | H50 | 106.9° | 108.4° |
| C25 | C24 | C19 | 111.0° | 113.6° |
| C25 | C24 | C23 | 119.4° | 112.6° |
| C25 | C24 | H26 | 106.7° | 106.2° |
| C24 | C25 | H27 | 108.8° | 107.7° |
| C19 | C24 | C23 | 105.3° | 113.2° |
| C24 | C19 | C20 | 108.4° | 112.4° |
| C24 | C19 | H18 | 109.0° | 108.2° |
| C19 | C24 | H26 | 106.9° | 105.4° |
| C24 | C23 | C28 | 115.0° | 114.5° |
| C24 | C23 | C22 | 113.0° | 112.0° |
| C24 | C23 | H25 | 105.7° | 106.7° |
| C23 | C24 | H26 | 106.9° | 104.9° |
| C27 | C39 | C38 | 117.9° | 106.4° |
| C39 | C27 | C37 | 98.5° | 108.0° |
| C39 | C38 | N33 | 96.6° | 105.4° |
| C39 | C38 | H44 | 112.6° | 109.9° |
| C39 | C38 | H15 | 112.6° | 110.2° |
| C27 | C37 | O41 | 121.3° | 125.1° |
| C27 | C37 | N33 | 111.3° | 110.2° |
| C19 | C20 | C21 | 110.3° | 113.9° |
| C20 | C19 | H18 | 109.2° | 107.8° |
| C19 | C20 | H20 | 109.3° | 109.5° |
| C19 | C20 | H21 | 109.3° | 108.4° |
| C38 | N33 | C37 | 115.8° | 107.2° |
| C38 | N33 | C6 | 109.4° | 126.5° |
| N33 | C38 | H44 | 112.6° | 109.8° |
| N33 | C38 | H15 | 112.6° | 110.2° |
| C28 | C23 | C22 | 110.6° | 111.0° |
| C28 | C23 | H25 | 105.9° | 105.9° |
| C23 | C28 | H29 | 109.5° | 109.4° |
| C23 | C28 | H30 | 109.4° | 109.5° |
| C23 | C28 | H31 | 109.4° | 109.5° |
| O41 | C37 | N33 | 127.4° | 124.7° |
| C37 | N33 | C6 | 134.7° | 126.3° |
| C7 | C6 | N33 | 105.3° | 108.6° |
| C7 | C6 | C5 | 107.7° | 109.4° |
| C7 | C6 | H47 | 110.3° | 109.1° |
| C6 | C7 | H48 | 109.1° | 109.0° |
| C6 | C7 | H49 | 109.2° | 107.7° |
| C23 | C22 | C21 | 111.0° | 114.4° |
| C23 | C22 | H23 | 109.1° | 108.3° |
| C23 | C22 | H24 | 109.1° | 108.6° |
| C22 | C23 | H25 | 105.8° | 106.1° |
| N33 | C6 | C5 | 112.6° | 109.8° |
| N33 | C6 | H47 | 110.5° | 110.1° |
| C20 | C21 | C22 | 107.5° | 113.9° |
| C20 | C21 | C29 | 112.6° | 111.0° |
| C21 | C20 | H20 | 109.3° | 109.4° |
| C21 | C20 | H21 | 109.3° | 108.7° |
| C20 | C21 | H22 | 109.1° | 106.8° |
| C6 | C5 | C4 | 125.8° | 109.5° |
| C6 | C5 | H45 | 105.3° | 109.4° |
| C6 | C5 | H46 | 105.3° | 109.5° |
| C5 | C6 | H47 | 110.2° | 109.8° |
| C5 | C4 | O32 | 121.4° | 120.0° |
| C5 | C4 | C3 | 122.2° | 120.0° |
| C4 | C5 | H45 | 105.2° | 109.5° |
| C4 | C5 | H46 | 105.3° | 109.5° |
| O32 | C4 | C3 | 116.3° | 120.0° |
| C22 | C21 | C29 | 109.5° | 112.1° |
| C22 | C21 | H22 | 109.0° | 106.7° |
| C21 | C22 | H23 | 109.1° | 109.1° |
| C21 | C22 | H24 | 109.1° | 109.2° |
| C4 | C3 | C2 | 120.5° | 120.0° |
| C4 | C3 | C31 | 125.3° | 120.0° |
| C29 | C21 | H22 | 109.0° | 105.8° |
| C21 | C29 | H32 | 109.5° | 109.5° |
| C21 | C29 | H33 | 109.5° | 109.5° |
| C21 | C29 | H34 | 109.5° | 109.5° |
| C3 | C2 | C1 | 119.3° | 120.0° |
| C2 | C3 | C31 | 114.2° | 120.0° |
| C3 | C2 | H19 | 120.3° | 120.0° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C1 | C2 | H19 | 120.3° | 120.0° |
| C3 | C31 | H38 | 109.5° | 109.4° |
| C3 | C31 | H39 | 109.5° | 109.4° |
| C3 | C31 | H40 | 109.5° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H4 | C10 | H5 | 109.5° | 108.5° |
| H6 | C11 | H7 | 109.5° | 109.9° |
| H8 | C12 | H9 | 109.4° | 109.9° |
| H10 | C13 | H11 | 109.5° | 107.6° |
| H20 | C20 | H21 | 109.5° | 106.5° |
| H23 | C22 | H24 | 109.5° | 107.1° |
| H29 | C28 | H30 | 109.5° | 109.5° |
| H29 | C28 | H31 | 109.5° | 109.5° |
| H30 | C28 | H31 | 109.5° | 109.5° |
| H32 | C29 | H33 | 109.5° | 109.4° |
| H32 | C29 | H34 | 109.5° | 109.5° |
| H33 | C29 | H34 | 109.5° | 109.5° |
| H35 | C30 | H36 | 109.5° | 109.5° |
| H35 | C30 | H37 | 109.5° | 109.4° |
| H36 | C30 | H37 | 109.4° | 109.4° |
| H38 | C31 | H39 | 109.5° | 109.5° |
| H38 | C31 | H40 | 109.5° | 109.5° |
| H39 | C31 | H40 | 109.5° | 109.5° |
| H41 | C35 | H42 | 109.5° | 109.5° |
| H41 | C35 | H43 | 109.4° | 109.5° |
| H42 | C35 | H43 | 109.5° | 109.5° |
| H44 | C38 | H15 | 109.4° | 111.1° |
| H45 | C5 | H46 | 109.4° | 109.5° |
| H48 | C7 | H49 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C9 | H4 | 119.8° | 120.9° |
| C11 | C10 | C9 | H5 | 119.8° | 120.7° |
| C10 | C11 | C12 | H6 | 120.4° | 119.4° |
| C10 | C11 | C12 | H7 | 120.4° | 121.0° |
| C11 | C10 | C9 | C35 | 169.5° | 35.3° |
| C10 | C11 | C12 | C13 | 175.2° | 168.4° |
| C11 | C10 | C9 | C8 | 64.2° | 87.5° |
| C11 | C10 | H4 | H5 | 120.5° | 118.9° |
| C10 | C11 | H6 | H7 | 118.7° | 122.2° |
| C10 | C11 | C12 | H8 | 64.5° | 48.3° |
| C10 | C11 | C12 | H9 | 55.0° | 72.3° |
| C11 | C10 | C9 | H51 | 51.8° | 154.1° |
| C9 | C10 | C11 | C12 | 114.6° | 157.8° |
| C10 | C9 | C35 | C8 | 124.9° | 122.1° |
| C10 | C9 | C35 | H51 | 117.7° | 118.4° |
| C10 | C9 | C8 | H51 | 116.0° | 118.1° |
| C10 | C9 | C8 | O34 | 71.3° | 51.8° |
| C10 | C9 | C8 | C7 | 162.8° | 174.1° |
| C9 | C10 | H4 | H5 | 120.6° | 119.0° |
| C9 | C10 | C11 | H6 | 5.8° | 83.4° |
| C9 | C10 | C11 | H7 | 125.0° | 38.3° |
| C10 | C9 | C35 | H41 | 180.0° | 60.0° |
| C10 | C9 | C35 | H42 | 60.0° | 180.0° |
| C10 | C9 | C35 | H43 | 60.0° | 59.9° |
| C10 | C9 | C8 | H50 | 45.8° | 66.4° |
| C11 | C12 | C13 | H8 | 120.3° | 120.3° |
| C11 | C12 | C13 | H9 | 120.3° | 119.3° |
| C11 | C12 | C13 | C14 | 17.4° | 89.7° |
| C12 | C11 | C10 | H4 | 5.2° | 81.5° |
| C12 | C11 | C10 | H5 | 125.6° | 37.0° |
| C12 | C11 | H6 | H7 | 118.7° | 118.7° |
| C11 | C12 | H8 | H9 | 119.2° | 120.2° |
| C11 | C12 | C13 | H10 | 137.5° | 151.7° |
| C11 | C12 | C13 | H11 | 102.8° | 34.6° |
| C35 | C9 | C8 | H51 | 117.4° | 119.5° |
| C35 | C9 | C8 | O34 | 55.3° | 70.6° |
| C35 | C9 | C8 | C7 | 70.6° | 51.7° |
| C35 | C9 | C10 | H4 | 70.7° | 85.6° |
| C35 | C9 | C10 | H5 | 49.7° | 156.0° |
| C9 | C35 | H41 | H42 | 120.0° | 120.0° |
| C9 | C35 | H41 | H43 | 120.0° | 119.9° |
| C9 | C35 | H42 | H43 | 120.0° | 120.0° |
| C35 | C9 | C8 | H50 | 172.4° | 171.2° |
| C12 | C13 | C14 | H10 | 120.1° | 118.3° |
| C12 | C13 | C14 | H11 | 120.1° | 122.5° |
| C12 | C13 | C14 | C15 | 163.9° | 115.2° |
| C13 | C12 | C11 | H6 | 54.8° | 72.1° |
| C13 | C12 | C11 | H7 | 64.3° | 47.4° |
| C13 | C12 | H8 | H9 | 119.2° | 120.0° |
| C12 | C13 | H10 | H11 | 119.6° | 118.3° |
| C12 | C13 | C14 | H12 | 16.1° | 65.0° |
| C16 | C17 | C18 | H14 | 180.0° | 179.4° |
| C17 | C16 | C15 | C14 | 129.7° | 72.7° |
| C17 | C16 | C15 | C25 | 124.3° | 133.0° |
| C17 | C16 | C15 | H13 | 119.4° | 112.9° |
| C17 | C16 | C25 | H13 | 119.9° | 115.3° |
| C17 | C16 | C15 | C30 | 50.1° | 105.8° |
| C16 | C17 | C18 | C19 | 40.4° | 0.9° |
| C17 | C16 | C25 | C26 | 144.5° | 125.4° |
| C17 | C16 | C25 | C24 | 20.3° | 2.0° |
| C16 | C17 | C18 | H16 | 139.6° | 178.1° |
| C17 | C16 | C25 | H27 | 97.9° | 119.0° |
| C18 | C17 | C16 | C15 | 90.1° | 155.7° |
| C18 | C17 | C16 | C25 | 30.4° | 23.2° |
| C17 | C18 | C19 | H16 | 180.0° | 179.0° |
| C17 | C18 | C19 | C24 | 3.0° | 38.9° |
| C17 | C18 | C19 | C20 | 116.9° | 163.8° |
| C18 | C17 | C16 | H13 | 150.3° | 92.2° |
| C17 | C18 | C19 | H18 | 122.6° | 78.1° |
| C13 | C14 | C15 | H12 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 179.9° | 177.9° |
| C13 | C14 | C15 | C30 | 0.3° | 0.6° |
| C14 | C13 | C12 | H8 | 102.9° | 30.7° |
| C14 | C13 | C12 | H9 | 137.6° | 151.1° |
| C14 | C13 | H10 | H11 | 119.7° | 122.4° |
| C14 | C15 | C16 | C30 | 179.9° | 178.5° |
| C14 | C15 | C16 | C25 | 106.0° | 154.4° |
| C15 | C14 | C13 | H10 | 76.0° | 126.5° |
| C15 | C14 | C13 | H11 | 43.8° | 7.3° |
| C14 | C15 | C16 | H13 | 10.3° | 40.2° |
| C14 | C15 | C30 | H35 | 180.0° | 58.4° |
| C14 | C15 | C30 | H36 | 60.0° | 178.5° |
| C14 | C15 | C30 | H37 | 60.0° | 61.5° |
| C9 | C8 | O34 | C7 | 125.7° | 123.2° |
| C9 | C8 | O34 | H50 | 116.4° | 118.4° |
| C9 | C8 | C7 | H50 | 117.1° | 119.6° |
| C9 | C8 | C7 | C6 | 116.2° | 175.7° |
| C8 | C9 | C10 | H4 | 55.7° | 151.6° |
| C8 | C9 | C10 | H5 | 176.0° | 33.1° |
| C8 | C9 | C35 | H41 | 55.1° | 177.9° |
| C8 | C9 | C35 | H42 | 64.9° | 57.9° |
| C8 | C9 | C35 | H43 | 175.1° | 62.2° |
| C9 | C8 | C7 | H48 | 123.6° | 64.4° |
| C9 | C8 | C7 | H49 | 4.1° | 56.9° |
| C9 | C8 | O34 | H52 | 170.0° | 65.1° |
| O36 | C26 | C25 | C16 | 73.9° | 71.7° |
| O36 | C26 | C25 | C27 | 179.1° | 179.8° |
| O36 | C26 | C25 | C24 | 45.6° | 52.9° |
| O36 | C26 | C27 | C39 | 17.3° | 147.3° |
| O36 | C26 | C27 | C37 | 159.4° | 30.9° |
| O36 | C26 | C25 | H27 | 168.6° | 169.6° |
| C15 | C16 | C25 | H13 | 116.5° | 113.5° |
| C15 | C16 | C25 | C26 | 91.9° | 103.5° |
| C15 | C16 | C25 | C24 | 143.9° | 133.2° |
| C16 | C15 | C14 | H12 | 0.1° | 1.9° |
| C15 | C16 | C17 | H14 | 89.9° | 23.7° |
| C15 | C16 | C25 | H27 | 25.6° | 12.1° |
| C16 | C15 | C30 | H35 | 0.1° | 123.2° |
| C16 | C15 | C30 | H36 | 119.9° | 3.1° |
| C16 | C15 | C30 | H37 | 120.2° | 116.9° |
| C25 | C16 | C15 | C30 | 74.2° | 27.2° |
| C16 | C25 | C26 | C24 | 119.5° | 124.6° |
| C16 | C25 | C26 | H27 | 117.5° | 118.6° |
| C16 | C25 | C26 | C27 | 105.2° | 108.1° |
| C16 | C25 | C24 | H27 | 118.5° | 122.7° |
| C16 | C25 | C24 | C19 | 60.8° | 36.9° |
| C16 | C25 | C24 | C23 | 176.5° | 93.4° |
| C25 | C16 | C17 | H14 | 149.6° | 156.2° |
| C16 | C25 | C24 | H26 | 55.4° | 152.4° |
| C30 | C15 | C14 | H12 | 179.7° | 179.6° |
| C30 | C15 | C16 | H13 | 169.6° | 141.3° |
| C15 | C30 | H35 | H36 | 120.0° | 120.1° |
| C15 | C30 | H35 | H37 | 120.0° | 120.0° |
| C15 | C30 | H36 | H37 | 120.0° | 120.0° |
| C18 | C19 | C24 | C25 | 53.2° | 57.9° |
| C18 | C19 | C24 | C20 | 121.4° | 124.7° |
| C18 | C19 | C24 | H18 | 119.9° | 116.4° |
| C18 | C19 | C24 | C23 | 176.3° | 72.2° |
| C18 | C19 | C20 | H18 | 120.7° | 117.8° |
| C18 | C19 | C20 | C21 | 172.0° | 73.7° |
| C19 | C18 | C17 | H14 | 139.6° | 178.4° |
| C18 | C19 | C20 | H20 | 51.9° | 163.4° |
| C18 | C19 | C20 | H21 | 67.8° | 47.5° |
| C18 | C19 | C24 | H26 | 62.8° | 173.8° |
| O40 | C39 | C27 | C26 | 1.9° | 2.4° |
| O40 | C39 | C27 | C38 | 179.2° | 179.2° |
| O40 | C39 | C27 | C37 | 179.5° | 176.1° |
| O40 | C39 | C38 | N33 | 179.4° | 173.7° |
| O40 | C39 | C38 | H44 | 62.8° | 68.0° |
| O40 | C39 | C38 | H15 | 61.5° | 54.8° |
| C26 | C25 | C24 | H27 | 123.3° | 115.7° |
| C26 | C25 | C24 | C19 | 179.0° | 84.6° |
| C26 | C25 | C24 | C23 | 58.3° | 145.0° |
| C25 | C26 | C27 | C39 | 163.5° | 32.9° |
| C25 | C26 | C27 | C37 | 19.8° | 148.9° |
| C26 | C25 | C16 | H13 | 24.6° | 10.0° |
| C26 | C25 | C24 | H26 | 62.9° | 30.8° |
| C27 | C26 | C25 | C24 | 135.3° | 127.3° |
| C26 | C27 | C39 | C37 | 177.6° | 178.5° |
| C26 | C27 | C39 | C38 | 178.8° | 178.3° |
| C26 | C27 | C37 | O41 | 2.9° | 11.0° |
| C26 | C27 | C37 | N33 | 179.3° | 168.0° |
| C27 | C26 | C25 | H27 | 12.3° | 10.6° |
| O34 | C8 | C7 | H50 | 118.5° | 118.3° |
| O34 | C8 | C7 | C6 | 119.4° | 53.6° |
| O34 | C8 | C7 | H48 | 0.8° | 173.5° |
| O34 | C8 | C7 | H49 | 120.4° | 65.2° |
| O34 | C8 | C9 | H51 | 172.6° | 169.8° |
| C8 | C7 | C6 | H48 | 120.2° | 120.5° |
| C8 | C7 | C6 | H49 | 120.2° | 120.9° |
| C8 | C7 | C6 | N33 | 68.6° | 72.3° |
| C8 | C7 | C6 | C5 | 51.8° | 167.9° |
| C8 | C7 | C6 | H47 | 172.1° | 47.7° |
| C8 | C7 | H48 | H49 | 119.3° | 122.2° |
| C7 | C8 | C9 | H51 | 46.8° | 67.8° |
| C7 | C8 | O34 | H52 | 44.3° | 58.2° |
| C25 | C24 | C19 | C23 | 130.5° | 130.0° |
| C25 | C24 | C19 | H26 | 116.0° | 115.9° |
| C25 | C24 | C23 | H26 | 121.1° | 115.0° |
| C25 | C24 | C19 | C20 | 68.2° | 177.5° |
| C25 | C24 | C23 | C28 | 61.4° | 54.9° |
| C25 | C24 | C23 | C22 | 66.9° | 177.6° |
| C24 | C25 | C16 | H13 | 99.6° | 113.3° |
| C25 | C24 | C19 | H18 | 173.1° | 58.5° |
| C25 | C24 | C23 | H25 | 177.8° | 61.9° |
| C19 | C24 | C23 | H26 | 113.5° | 114.4° |
| C24 | C19 | C20 | H18 | 118.6° | 119.1° |
| C19 | C24 | C23 | C28 | 173.2° | 75.7° |
| C19 | C24 | C23 | C22 | 58.6° | 51.8° |
| C24 | C19 | C20 | C21 | 67.3° | 49.3° |
| C24 | C19 | C18 | H16 | 176.9° | 142.1° |
| C24 | C19 | C20 | H20 | 172.6° | 73.6° |
| C24 | C19 | C20 | H21 | 52.9° | 170.5° |
| C19 | C24 | C23 | H25 | 56.7° | 167.5° |
| C19 | C24 | C25 | H27 | 57.7° | 159.6° |
| C23 | C24 | C19 | C20 | 62.3° | 52.5° |
| C24 | C23 | C28 | C22 | 129.4° | 128.0° |
| C24 | C23 | C28 | H25 | 116.4° | 117.3° |
| C24 | C23 | C22 | H25 | 115.2° | 116.1° |
| C24 | C23 | C22 | C21 | 56.9° | 48.5° |
| C23 | C24 | C19 | H18 | 56.4° | 171.4° |
| C24 | C23 | C22 | H23 | 63.3° | 73.4° |
| C24 | C23 | C22 | H24 | 177.2° | 170.7° |
| C23 | C24 | C25 | H27 | 65.0° | 29.3° |
| C24 | C23 | C28 | H29 | 180.0° | 62.6° |
| C24 | C23 | C28 | H30 | 60.0° | 57.4° |
| C24 | C23 | C28 | H31 | 60.0° | 177.4° |
| C27 | C39 | C38 | N33 | 0.1° | 7.1° |
| C39 | C27 | C37 | O41 | 179.7° | 167.5° |
| C39 | C27 | C37 | N33 | 2.0° | 13.5° |
| C27 | C39 | C38 | H44 | 118.0° | 111.2° |
| C27 | C39 | O40 | H53 | 8.1° | 145.6° |
| C27 | C39 | C38 | H15 | 117.7° | 126.0° |
| C38 | C39 | C27 | C37 | 1.3° | 3.1° |
| C39 | C38 | N33 | H44 | 117.8° | 118.3° |
| C39 | C38 | N33 | H15 | 117.8° | 118.9° |
| C39 | C38 | N33 | C37 | 1.3° | 15.4° |
| C39 | C38 | N33 | C6 | 178.0° | 162.1° |
| C39 | C38 | H44 | H15 | 126.0° | 122.2° |
| C38 | C39 | O40 | H53 | 172.7° | 33.5° |
| C27 | C37 | N33 | C38 | 2.2° | 17.9° |
| C27 | C37 | O41 | N33 | 177.3° | 178.8° |
| C27 | C37 | N33 | C6 | 177.9° | 159.6° |
| C19 | C20 | C21 | H20 | 120.1° | 122.9° |
| C19 | C20 | C21 | H21 | 120.1° | 121.1° |
| C19 | C20 | C21 | C22 | 61.6° | 46.2° |
| C19 | C20 | C21 | C29 | 177.7° | 81.4° |
| C20 | C19 | C18 | H16 | 63.2° | 17.2° |
| C19 | C20 | H20 | H21 | 119.6° | 117.1° |
| C19 | C20 | C21 | H22 | 56.5° | 163.7° |
| C20 | C19 | C24 | H26 | 175.8° | 61.6° |
| C38 | N33 | C37 | O41 | 179.8° | 163.1° |
| C38 | N33 | C37 | C6 | 175.6° | 177.5° |
| C38 | N33 | C6 | C7 | 54.7° | 61.8° |
| C38 | N33 | C6 | C5 | 171.8° | 57.7° |
| N33 | C38 | H44 | H15 | 126.1° | 122.3° |
| C38 | N33 | C6 | H47 | 64.4° | 178.8° |
| C28 | C23 | C22 | H25 | 114.3° | 114.6° |
| C28 | C23 | C22 | C21 | 172.6° | 80.8° |
| C28 | C23 | C22 | H23 | 67.2° | 157.3° |
| C28 | C23 | C22 | H24 | 52.3° | 41.4° |
| C28 | C23 | C24 | H26 | 59.7° | 169.9° |
| C23 | C28 | H29 | H30 | 120.0° | 120.0° |
| C23 | C28 | H29 | H31 | 120.0° | 120.0° |
| C23 | C28 | H30 | H31 | 120.0° | 120.0° |
| O41 | C37 | N33 | C6 | 4.6° | 19.3° |
| C37 | N33 | C6 | C7 | 121.1° | 115.2° |
| C37 | N33 | C6 | C5 | 4.1° | 125.2° |
| C37 | N33 | C38 | H44 | 116.6° | 103.0° |
| C37 | N33 | C6 | H47 | 119.7° | 4.2° |
| C37 | N33 | C38 | H15 | 119.1° | 134.2° |
| C7 | C6 | N33 | C5 | 117.1° | 119.6° |
| C7 | C6 | N33 | H47 | 119.2° | 119.4° |
| C7 | C6 | C5 | H47 | 120.4° | 119.7° |
| C7 | C6 | C5 | C4 | 50.7° | 174.7° |
| C7 | C6 | C5 | H45 | 172.9° | 54.7° |
| C7 | C6 | C5 | H46 | 71.5° | 65.3° |
| C6 | C7 | H48 | H49 | 119.4° | 117.5° |
| C6 | C7 | C8 | H50 | 0.9° | 64.7° |
| C23 | C22 | C21 | C20 | 55.4° | 46.0° |
| C23 | C22 | C21 | H23 | 120.2° | 121.4° |
| C23 | C22 | C21 | H24 | 120.2° | 121.9° |
| C23 | C22 | C21 | C29 | 178.1° | 81.1° |
| C23 | C22 | C21 | H22 | 62.7° | 163.5° |
| C23 | C22 | H23 | H24 | 119.3° | 116.9° |
| C22 | C23 | C24 | H26 | 172.1° | 62.6° |
| C22 | C23 | C28 | H29 | 50.6° | 65.5° |
| C22 | C23 | C28 | H30 | 69.4° | 174.5° |
| C22 | C23 | C28 | H31 | 170.6° | 54.5° |
| N33 | C6 | C5 | H47 | 123.9° | 121.3° |
| N33 | C6 | C5 | C4 | 166.4° | 66.3° |
| C6 | N33 | C38 | H44 | 60.2° | 79.5° |
| N33 | C6 | C5 | H45 | 71.4° | 173.8° |
| N33 | C6 | C5 | H46 | 44.2° | 53.8° |
| N33 | C6 | C7 | H48 | 171.2° | 167.2° |
| N33 | C6 | C7 | H49 | 51.6° | 48.6° |
| C6 | N33 | C38 | H15 | 64.2° | 43.3° |
| C20 | C21 | C22 | C29 | 122.7° | 127.1° |
| C20 | C21 | C22 | H22 | 118.2° | 117.5° |
| C20 | C21 | C29 | H22 | 121.3° | 115.5° |
| C21 | C20 | C19 | H18 | 51.4° | 168.4° |
| C21 | C20 | H20 | H21 | 119.6° | 117.4° |
| C20 | C21 | C22 | H23 | 64.8° | 75.5° |
| C20 | C21 | C22 | H24 | 175.6° | 167.8° |
| C20 | C21 | C29 | H32 | 180.0° | 60.1° |
| C20 | C21 | C29 | H33 | 60.0° | 180.0° |
| C20 | C21 | C29 | H34 | 60.0° | 60.0° |
| C6 | C5 | C4 | H45 | 122.2° | 120.0° |
| C6 | C5 | C4 | H46 | 122.2° | 120.0° |
| C6 | C5 | C4 | O32 | 36.4° | 0.0° |
| C6 | C5 | C4 | C3 | 148.1° | 180.0° |
| C6 | C5 | H45 | H46 | 112.7° | 120.0° |
| C5 | C6 | C7 | H48 | 68.4° | 47.4° |
| C5 | C6 | C7 | H49 | 172.0° | 71.2° |
| C5 | C4 | O32 | C3 | 175.8° | 180.0° |
| C5 | C4 | C3 | C2 | 118.6° | 180.0° |
| C5 | C4 | C3 | C31 | 61.8° | 0.0° |
| C4 | C5 | H45 | H46 | 112.7° | 120.0° |
| C4 | C5 | C6 | H47 | 69.7° | 55.0° |
| O32 | C4 | C3 | C2 | 57.1° | 0.0° |
| O32 | C4 | C3 | C31 | 122.5° | 180.0° |
| O32 | C4 | C5 | H45 | 158.6° | 120.0° |
| O32 | C4 | C5 | H46 | 85.8° | 120.0° |
| C22 | C21 | C29 | H22 | 119.2° | 115.9° |
| C22 | C21 | C20 | H20 | 178.3° | 76.7° |
| C22 | C21 | C20 | H21 | 58.6° | 167.3° |
| C21 | C22 | H23 | H24 | 119.3° | 118.0° |
| C21 | C22 | C23 | H25 | 58.3° | 164.6° |
| C22 | C21 | C29 | H32 | 60.4° | 68.5° |
| C22 | C21 | C29 | H33 | 179.6° | 51.4° |
| C22 | C21 | C29 | H34 | 59.6° | 171.5° |
| C4 | C3 | C2 | C31 | 179.6° | 180.0° |
| C4 | C3 | C2 | C1 | 179.9° | 180.0° |
| C4 | C3 | C2 | H19 | 0.1° | 0.0° |
| C4 | C3 | C31 | H38 | 180.0° | 90.0° |
| C4 | C3 | C31 | H39 | 60.0° | 30.0° |
| C4 | C3 | C31 | H40 | 60.0° | 150.0° |
| C3 | C4 | C5 | H45 | 25.9° | 60.0° |
| C3 | C4 | C5 | H46 | 89.7° | 60.0° |
| C29 | C21 | C20 | H20 | 57.6° | 155.7° |
| C29 | C21 | C20 | H21 | 62.1° | 39.7° |
| C29 | C21 | C22 | H23 | 57.9° | 157.5° |
| C29 | C21 | C22 | H24 | 61.7° | 40.8° |
| C21 | C29 | H32 | H33 | 120.0° | 119.9° |
| C21 | C29 | H32 | H34 | 120.0° | 120.0° |
| C21 | C29 | H33 | H34 | 120.0° | 120.1° |
| C3 | C2 | C1 | H19 | 180.0° | 180.0° |
| C3 | C2 | C1 | H1 | 180.0° | 59.9° |
| C3 | C2 | C1 | H2 | 60.0° | 60.0° |
| C3 | C2 | C1 | H3 | 60.0° | 180.0° |
| C2 | C3 | C31 | H38 | 0.4° | 90.0° |
| C2 | C3 | C31 | H39 | 119.6° | 150.0° |
| C2 | C3 | C31 | H40 | 120.4° | 29.9° |
| C1 | C2 | C3 | C31 | 0.3° | 0.1° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 119.9° |
| C31 | C3 | C2 | H19 | 179.7° | 180.0° |
| C3 | C31 | H38 | H39 | 120.0° | 120.0° |
| C3 | C31 | H38 | H40 | 120.0° | 119.9° |
| C3 | C31 | H39 | H40 | 120.0° | 120.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H1 | C1 | C2 | H19 | 0.0° | 120.0° |
| H2 | C1 | C2 | H19 | 120.0° | 120.0° |
| H3 | C1 | C2 | H19 | 120.0° | 0.1° |
| H4 | C10 | C11 | H6 | 125.6° | 37.3° |
| H4 | C10 | C11 | H7 | 115.2° | 158.9° |
| H4 | C10 | C9 | H51 | 171.7° | 33.2° |
| H5 | C10 | C11 | H6 | 114.0° | 155.8° |
| H5 | C10 | C11 | H7 | 5.2° | 82.6° |
| H5 | C10 | C9 | H51 | 68.0° | 85.2° |
| H6 | C11 | C12 | H8 | 175.1° | 167.8° |
| H6 | C11 | C12 | H9 | 65.5° | 47.1° |
| H7 | C11 | C12 | H8 | 55.9° | 72.7° |
| H7 | C11 | C12 | H9 | 175.4° | 166.7° |
| H8 | C12 | C13 | H10 | 17.2° | 87.9° |
| H8 | C12 | C13 | H11 | 137.0° | 155.0° |
| H9 | C12 | C13 | H10 | 102.3° | 32.4° |
| H9 | C12 | C13 | H11 | 17.5° | 84.6° |
| H10 | C13 | C14 | H12 | 104.0° | 53.4° |
| H11 | C13 | C14 | H12 | 136.2° | 172.6° |
| H13 | C16 | C17 | H14 | 29.7° | 88.5° |
| H13 | C16 | C25 | H27 | 142.2° | 125.6° |
| H14 | C17 | C18 | H16 | 40.4° | 2.5° |
| H16 | C18 | C19 | H18 | 57.4° | 101.0° |
| H18 | C19 | C20 | H20 | 68.8° | 45.5° |
| H18 | C19 | C20 | H21 | 171.5° | 70.3° |
| H18 | C19 | C24 | H26 | 57.1° | 57.3° |
| H20 | C20 | C21 | H22 | 63.6° | 40.8° |
| H21 | C20 | C21 | H22 | 176.7° | 75.2° |
| H22 | C21 | C22 | H23 | 177.0° | 42.1° |
| H22 | C21 | C22 | H24 | 57.5° | 74.6° |
| H22 | C21 | C29 | H32 | 58.7° | 175.5° |
| H22 | C21 | C29 | H33 | 61.3° | 64.5° |
| H22 | C21 | C29 | H34 | 178.7° | 55.5° |
| H23 | C22 | C23 | H25 | 178.5° | 42.7° |
| H24 | C22 | C23 | H25 | 61.9° | 73.2° |
| H25 | C23 | C24 | H26 | 56.8° | 53.1° |
| H25 | C23 | C28 | H29 | 63.6° | 179.8° |
| H25 | C23 | C28 | H30 | 176.4° | 59.8° |
| H25 | C23 | C28 | H31 | 56.4° | 60.2° |
| H26 | C24 | C25 | H27 | 173.8° | 84.9° |
| H29 | C28 | H30 | H31 | 120.0° | 120.0° |
| H32 | C29 | H33 | H34 | 120.0° | 120.0° |
| H35 | C30 | H36 | H37 | 120.0° | 120.0° |
| H38 | C31 | H39 | H40 | 120.0° | 120.1° |
| H41 | C35 | H42 | H43 | 120.0° | 120.0° |
| H41 | C35 | C9 | H51 | 62.3° | 58.4° |
| H42 | C35 | C9 | H51 | 177.7° | 61.6° |
| H43 | C35 | C9 | H51 | 57.7° | 178.4° |
| H45 | C5 | C6 | H47 | 52.5° | 65.0° |
| H46 | C5 | C6 | H47 | 168.1° | 175.0° |
| H47 | C6 | C7 | H48 | 51.9° | 72.7° |
| H47 | C6 | C7 | H49 | 67.6° | 168.6° |
| H48 | C7 | C8 | H50 | 119.3° | 55.2° |
| H49 | C7 | C8 | H50 | 121.1° | 176.5° |
| H50 | C8 | C9 | H51 | 70.2° | 51.7° |
| H50 | C8 | O34 | H52 | 73.6° | 176.6° |
