MW9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C33 | C32 | doub | 1.31Å | 1.32Å | |
| C33 | C34 | sing | 1.51Å | 1.50Å | |
| C32 | C31 | sing | 1.51Å | 1.50Å | |
| C34 | C35 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.52Å | |
| C31 | C30 | sing | 1.53Å | 1.53Å | |
| C30 | C29 | sing | 1.53Å | 1.53Å | |
| C36 | C37 | sing | 1.53Å | 1.52Å | |
| C28 | C29 | sing | 1.53Å | 1.52Å | |
| C28 | C27 | sing | 1.53Å | 1.52Å | |
| O4 | P | doub | 1.48Å | 1.48Å | |
| C37 | C38 | sing | 1.53Å | 1.52Å | |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| O9 | C24 | doub | 1.21Å | 1.20Å | |
| C38 | C39 | sing | 1.53Å | 1.52Å | |
| P | O2 | sing | 1.61Å | 1.60Å | |
| P | O3 | sing | 1.61Å | 1.48Å | |
| P | O5 | sing | 1.61Å | 1.59Å | |
| C24 | C25 | sing | 1.51Å | 1.50Å | |
| C24 | O8 | sing | 1.34Å | 1.35Å | |
| O2 | C20 | sing | 1.43Å | 1.45Å | |
| O8 | C19 | sing | 1.45Å | 1.47Å | |
| O5 | C21 | sing | 1.43Å | 1.44Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C39 | C40 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.51Å | |
| C19 | C18 | sing | 1.53Å | 1.50Å | |
| O7 | C22 | sing | 1.43Å | 1.43Å | |
| C40 | C41 | sing | 1.53Å | 1.50Å | |
| C22 | C23 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C16 | C17 | sing | 1.51Å | 1.50Å | |
| O6 | C23 | sing | 1.43Å | 1.42Å | |
| C18 | O1 | sing | 1.45Å | 1.44Å | |
| C15 | C14 | sing | 1.53Å | 1.51Å | |
| C17 | O1 | sing | 1.34Å | 1.33Å | |
| C17 | O | doub | 1.21Å | 1.20Å | |
| C14 | C13 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C9 | C8 | sing | 1.53Å | 1.51Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C2 | H23 | sing | 1.09Å | 1.10Å | |
| C2 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C25 | H32 | sing | 1.09Å | 1.10Å | |
| C25 | H33 | sing | 1.09Å | 1.10Å | |
| C26 | H34 | sing | 1.09Å | 1.10Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C27 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H37 | sing | 1.09Å | 1.10Å | |
| C28 | H38 | sing | 1.09Å | 1.10Å | |
| C28 | H39 | sing | 1.09Å | 1.10Å | |
| C29 | H40 | sing | 1.09Å | 1.10Å | |
| C29 | H41 | sing | 1.09Å | 1.10Å | |
| C3 | H42 | sing | 1.09Å | 1.10Å | |
| C3 | H43 | sing | 1.09Å | 1.10Å | |
| C30 | H44 | sing | 1.09Å | 1.10Å | |
| C30 | H45 | sing | 1.09Å | 1.10Å | |
| C31 | H46 | sing | 1.09Å | 1.10Å | |
| C31 | H47 | sing | 1.09Å | 1.10Å | |
| C32 | H48 | sing | 1.08Å | 1.08Å | |
| C33 | H49 | sing | 1.08Å | 1.08Å | |
| C34 | H50 | sing | 1.09Å | 1.10Å | |
| C34 | H51 | sing | 1.09Å | 1.10Å | |
| C35 | H52 | sing | 1.09Å | 1.10Å | |
| C35 | H53 | sing | 1.09Å | 1.10Å | |
| C36 | H54 | sing | 1.09Å | 1.10Å | |
| C36 | H55 | sing | 1.09Å | 1.10Å | |
| C37 | H56 | sing | 1.09Å | 1.10Å | |
| C37 | H57 | sing | 1.09Å | 1.10Å | |
| C38 | H58 | sing | 1.09Å | 1.10Å | |
| C38 | H59 | sing | 1.09Å | 1.10Å | |
| C39 | H60 | sing | 1.09Å | 1.10Å | |
| C39 | H61 | sing | 1.09Å | 1.10Å | |
| C4 | H62 | sing | 1.09Å | 1.10Å | |
| C4 | H63 | sing | 1.09Å | 1.10Å | |
| C40 | H64 | sing | 1.09Å | 1.10Å | |
| C40 | H65 | sing | 1.09Å | 1.10Å | |
| C41 | H66 | sing | 1.09Å | 1.10Å | |
| C41 | H67 | sing | 1.09Å | 1.10Å | |
| C41 | H68 | sing | 1.09Å | 1.10Å | |
| C5 | H69 | sing | 1.09Å | 1.10Å | |
| C5 | H70 | sing | 1.09Å | 1.10Å | |
| C6 | H71 | sing | 1.09Å | 1.10Å | |
| C6 | H72 | sing | 1.09Å | 1.10Å | |
| C7 | H73 | sing | 1.09Å | 1.10Å | |
| C7 | H74 | sing | 1.09Å | 1.10Å | |
| C8 | H75 | sing | 1.09Å | 1.10Å | |
| C8 | H76 | sing | 1.09Å | 1.10Å | |
| C9 | H77 | sing | 1.09Å | 1.10Å | |
| C9 | H78 | sing | 1.09Å | 1.10Å | |
| O3 | H79 | sing | 0.97Å | 0.95Å | |
| O6 | H80 | sing | 0.97Å | 0.95Å | |
| O7 | H81 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | C33 | C34 | 126.1° | 120.0° |
| C33 | C32 | C31 | 126.7° | 120.0° |
| C33 | C32 | H48 | 116.7° | 120.0° |
| C32 | C33 | H49 | 116.9° | 120.0° |
| C33 | C34 | C35 | 112.4° | 109.5° |
| C34 | C33 | H49 | 116.9° | 120.0° |
| C33 | C34 | H50 | 108.7° | 109.4° |
| C33 | C34 | H51 | 108.7° | 109.5° |
| C32 | C31 | C30 | 112.2° | 109.5° |
| C32 | C31 | H46 | 108.8° | 109.4° |
| C32 | C31 | H47 | 108.8° | 109.5° |
| C31 | C32 | H48 | 116.7° | 120.0° |
| C34 | C35 | C36 | 113.7° | 109.5° |
| C35 | C34 | H50 | 108.7° | 109.4° |
| C35 | C34 | H51 | 108.7° | 109.5° |
| C34 | C35 | H52 | 108.4° | 109.4° |
| C34 | C35 | H53 | 108.4° | 109.5° |
| C35 | C36 | C37 | 113.7° | 109.4° |
| C36 | C35 | H52 | 108.4° | 109.5° |
| C36 | C35 | H53 | 108.4° | 109.5° |
| C35 | C36 | H54 | 108.4° | 109.5° |
| C35 | C36 | H55 | 108.4° | 109.4° |
| C31 | C30 | C29 | 115.2° | 109.5° |
| C31 | C30 | H44 | 108.0° | 109.5° |
| C31 | C30 | H45 | 108.0° | 109.5° |
| C30 | C31 | H46 | 108.8° | 109.5° |
| C30 | C31 | H47 | 108.8° | 109.5° |
| C30 | C29 | C28 | 114.6° | 109.5° |
| C30 | C29 | H40 | 108.2° | 109.4° |
| C30 | C29 | H41 | 108.2° | 109.4° |
| C29 | C30 | H44 | 108.0° | 109.5° |
| C29 | C30 | H45 | 108.0° | 109.5° |
| C36 | C37 | C38 | 114.5° | 109.4° |
| C37 | C36 | H54 | 108.4° | 109.5° |
| C37 | C36 | H55 | 108.4° | 109.5° |
| C36 | C37 | H56 | 108.2° | 109.5° |
| C36 | C37 | H57 | 108.2° | 109.5° |
| C29 | C28 | C27 | 114.0° | 109.4° |
| C29 | C28 | H38 | 108.3° | 109.5° |
| C29 | C28 | H39 | 108.3° | 109.5° |
| C28 | C29 | H40 | 108.2° | 109.5° |
| C28 | C29 | H41 | 108.2° | 109.5° |
| C28 | C27 | C26 | 113.6° | 109.4° |
| C28 | C27 | H36 | 108.4° | 109.5° |
| C28 | C27 | H37 | 108.4° | 109.5° |
| C27 | C28 | H38 | 108.3° | 109.5° |
| C27 | C28 | H39 | 108.3° | 109.5° |
| O4 | P | O2 | 108.1° | 109.4° |
| O4 | P | O3 | 118.8° | 109.4° |
| O4 | P | O5 | 107.9° | 109.5° |
| C37 | C38 | C39 | 113.5° | 109.4° |
| C38 | C37 | H56 | 108.2° | 109.5° |
| C38 | C37 | H57 | 108.2° | 109.5° |
| C37 | C38 | H58 | 108.4° | 109.5° |
| C37 | C38 | H59 | 108.5° | 109.5° |
| C27 | C26 | C25 | 113.9° | 109.5° |
| C27 | C26 | H34 | 108.4° | 109.5° |
| C27 | C26 | H35 | 108.4° | 109.5° |
| C26 | C27 | H36 | 108.4° | 109.4° |
| C26 | C27 | H37 | 108.4° | 109.5° |
| C26 | C25 | C24 | 111.5° | 109.5° |
| C26 | C25 | H32 | 109.0° | 109.5° |
| C26 | C25 | H33 | 108.9° | 109.5° |
| C25 | C26 | H34 | 108.4° | 109.5° |
| C25 | C26 | H35 | 108.3° | 109.5° |
| O9 | C24 | C25 | 124.1° | 120.0° |
| O9 | C24 | O8 | 123.9° | 120.0° |
| C38 | C39 | C40 | 114.2° | 109.4° |
| C39 | C38 | H58 | 108.5° | 109.4° |
| C39 | C38 | H59 | 108.4° | 109.5° |
| C38 | C39 | H60 | 108.3° | 109.5° |
| C38 | C39 | H61 | 108.2° | 109.4° |
| O2 | P | O3 | 108.0° | 109.5° |
| O2 | P | O5 | 105.4° | 109.5° |
| P | O2 | C20 | 122.8° | 123.0° |
| O3 | P | O5 | 107.9° | 109.5° |
| P | O3 | H79 | 109.5° | 114.0° |
| P | O5 | C21 | 120.0° | 123.0° |
| C25 | C24 | O8 | 112.0° | 120.0° |
| C24 | C25 | H32 | 109.0° | 109.5° |
| C24 | C25 | H33 | 109.0° | 109.4° |
| C24 | O8 | C19 | 116.9° | 116.9° |
| O2 | C20 | C19 | 108.8° | 109.4° |
| O2 | C20 | H25 | 109.6° | 109.5° |
| O2 | C20 | H26 | 109.7° | 109.5° |
| O8 | C19 | C20 | 111.7° | 109.5° |
| O8 | C19 | C18 | 108.3° | 109.4° |
| O8 | C19 | H22 | 108.5° | 109.5° |
| O5 | C21 | C22 | 108.3° | 109.5° |
| O5 | C21 | H27 | 109.8° | 109.5° |
| O5 | C21 | H28 | 109.7° | 109.5° |
| C21 | C22 | O7 | 109.2° | 109.4° |
| C21 | C22 | C23 | 112.4° | 109.5° |
| C22 | C21 | H27 | 109.7° | 109.5° |
| C22 | C21 | H28 | 109.7° | 109.5° |
| C21 | C22 | H29 | 108.0° | 109.5° |
| C39 | C40 | C41 | 112.7° | 109.4° |
| C40 | C39 | H60 | 108.3° | 109.5° |
| C40 | C39 | H61 | 108.3° | 109.5° |
| C39 | C40 | H64 | 108.7° | 109.5° |
| C39 | C40 | H65 | 108.6° | 109.5° |
| C20 | C19 | C18 | 112.1° | 109.5° |
| C20 | C19 | H22 | 108.0° | 109.5° |
| C19 | C20 | H25 | 109.6° | 109.5° |
| C19 | C20 | H26 | 109.6° | 109.5° |
| C19 | C18 | O1 | 104.0° | 109.5° |
| C19 | C18 | H20 | 110.8° | 109.4° |
| C19 | C18 | H21 | 110.8° | 109.4° |
| C18 | C19 | H22 | 108.1° | 109.5° |
| O7 | C22 | C23 | 110.1° | 109.5° |
| O7 | C22 | H29 | 109.1° | 109.5° |
| C22 | O7 | H81 | 109.5° | 114.0° |
| C41 | C40 | H64 | 108.6° | 109.5° |
| C41 | C40 | H65 | 108.6° | 109.5° |
| C40 | C41 | H66 | 109.5° | 109.5° |
| C40 | C41 | H67 | 109.5° | 109.5° |
| C40 | C41 | H68 | 109.5° | 109.5° |
| C22 | C23 | O6 | 110.7° | 109.5° |
| C23 | C22 | H29 | 108.0° | 109.5° |
| C22 | C23 | H30 | 109.2° | 109.5° |
| C22 | C23 | H31 | 109.2° | 109.5° |
| C15 | C16 | C17 | 114.1° | 109.5° |
| C16 | C15 | C14 | 112.8° | 109.4° |
| C16 | C15 | H16 | 108.6° | 109.5° |
| C16 | C15 | H17 | 108.7° | 109.5° |
| C15 | C16 | H18 | 108.3° | 109.5° |
| C15 | C16 | H19 | 108.3° | 109.5° |
| C16 | C17 | O1 | 111.2° | 120.0° |
| C16 | C17 | O | 124.9° | 120.0° |
| C17 | C16 | H18 | 108.3° | 109.5° |
| C17 | C16 | H19 | 108.3° | 109.5° |
| O6 | C23 | H30 | 109.2° | 109.4° |
| O6 | C23 | H31 | 109.2° | 109.5° |
| C23 | O6 | H80 | 109.5° | 114.0° |
| C18 | O1 | C17 | 116.9° | 117.0° |
| O1 | C18 | H20 | 110.8° | 109.5° |
| O1 | C18 | H21 | 110.8° | 109.5° |
| C15 | C14 | C13 | 114.2° | 109.4° |
| C15 | C14 | H14 | 108.3° | 109.5° |
| C15 | C14 | H15 | 108.3° | 109.5° |
| C14 | C15 | H16 | 108.6° | 109.5° |
| C14 | C15 | H17 | 108.6° | 109.5° |
| O1 | C17 | O | 123.7° | 119.9° |
| C14 | C13 | C12 | 113.1° | 109.5° |
| C14 | C13 | H12 | 108.6° | 109.5° |
| C14 | C13 | H13 | 108.6° | 109.5° |
| C13 | C14 | H14 | 108.3° | 109.5° |
| C13 | C14 | H15 | 108.3° | 109.5° |
| C3 | C2 | C1 | 114.8° | 109.5° |
| C2 | C3 | C4 | 113.6° | 109.5° |
| C3 | C2 | H23 | 108.1° | 109.5° |
| C3 | C2 | H24 | 108.1° | 109.5° |
| C2 | C3 | H42 | 108.4° | 109.5° |
| C2 | C3 | H43 | 108.4° | 109.4° |
| C2 | C1 | C | 112.5° | 109.5° |
| C2 | C1 | H4 | 108.7° | 109.5° |
| C2 | C1 | H5 | 108.7° | 109.4° |
| C1 | C2 | H23 | 108.1° | 109.4° |
| C1 | C2 | H24 | 108.2° | 109.4° |
| C3 | C4 | C5 | 113.7° | 109.5° |
| C4 | C3 | H42 | 108.4° | 109.5° |
| C4 | C3 | H43 | 108.4° | 109.5° |
| C3 | C4 | H62 | 108.4° | 109.5° |
| C3 | C4 | H63 | 108.4° | 109.5° |
| C4 | C5 | C6 | 113.4° | 109.5° |
| C5 | C4 | H62 | 108.4° | 109.4° |
| C5 | C4 | H63 | 108.4° | 109.4° |
| C4 | C5 | H69 | 108.5° | 109.5° |
| C4 | C5 | H70 | 108.5° | 109.5° |
| C13 | C12 | C11 | 113.2° | 109.5° |
| C13 | C12 | H10 | 108.5° | 109.5° |
| C13 | C12 | H11 | 108.5° | 109.5° |
| C12 | C13 | H12 | 108.6° | 109.5° |
| C12 | C13 | H13 | 108.6° | 109.5° |
| C1 | C | H1 | 109.5° | 109.5° |
| C1 | C | H2 | 109.5° | 109.5° |
| C1 | C | H3 | 109.4° | 109.5° |
| C | C1 | H4 | 108.7° | 109.5° |
| C | C1 | H5 | 108.7° | 109.5° |
| C5 | C6 | C7 | 114.0° | 109.5° |
| C6 | C5 | H69 | 108.5° | 109.5° |
| C6 | C5 | H70 | 108.5° | 109.5° |
| C5 | C6 | H71 | 108.3° | 109.5° |
| C5 | C6 | H72 | 108.4° | 109.5° |
| C12 | C11 | C10 | 113.0° | 109.5° |
| C12 | C11 | H8 | 108.6° | 109.5° |
| C12 | C11 | H9 | 108.6° | 109.4° |
| C11 | C12 | H10 | 108.5° | 109.5° |
| C11 | C12 | H11 | 108.5° | 109.4° |
| C6 | C7 | C8 | 113.9° | 109.5° |
| C7 | C6 | H71 | 108.4° | 109.4° |
| C7 | C6 | H72 | 108.3° | 109.5° |
| C6 | C7 | H73 | 108.4° | 109.5° |
| C6 | C7 | H74 | 108.3° | 109.5° |
| C10 | C9 | C8 | 112.7° | 109.5° |
| C9 | C10 | C11 | 113.4° | 109.5° |
| C9 | C10 | H6 | 108.5° | 109.5° |
| C9 | C10 | H7 | 108.5° | 109.5° |
| C10 | C9 | H77 | 108.7° | 109.5° |
| C10 | C9 | H78 | 108.7° | 109.4° |
| C9 | C8 | C7 | 114.1° | 109.4° |
| C9 | C8 | H75 | 108.3° | 109.5° |
| C9 | C8 | H76 | 108.3° | 109.5° |
| C8 | C9 | H77 | 108.6° | 109.5° |
| C8 | C9 | H78 | 108.7° | 109.5° |
| C11 | C10 | H6 | 108.5° | 109.5° |
| C11 | C10 | H7 | 108.5° | 109.5° |
| C10 | C11 | H8 | 108.6° | 109.5° |
| C10 | C11 | H9 | 108.6° | 109.4° |
| C8 | C7 | H73 | 108.4° | 109.5° |
| C8 | C7 | H74 | 108.4° | 109.5° |
| C7 | C8 | H75 | 108.3° | 109.5° |
| C7 | C8 | H76 | 108.3° | 109.5° |
| H1 | C | H2 | 109.5° | 109.5° |
| H1 | C | H3 | 109.4° | 109.5° |
| H2 | C | H3 | 109.5° | 109.4° |
| H4 | C1 | H5 | 109.5° | 109.4° |
| H6 | C10 | H7 | 109.5° | 109.5° |
| H8 | C11 | H9 | 109.4° | 109.5° |
| H10 | C12 | H11 | 109.5° | 109.5° |
| H12 | C13 | H13 | 109.4° | 109.4° |
| H14 | C14 | H15 | 109.5° | 109.5° |
| H16 | C15 | H17 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.5° |
| H20 | C18 | H21 | 109.5° | 109.5° |
| H23 | C2 | H24 | 109.4° | 109.5° |
| H25 | C20 | H26 | 109.5° | 109.5° |
| H27 | C21 | H28 | 109.5° | 109.5° |
| H30 | C23 | H31 | 109.4° | 109.5° |
| H32 | C25 | H33 | 109.5° | 109.5° |
| H34 | C26 | H35 | 109.5° | 109.5° |
| H36 | C27 | H37 | 109.5° | 109.5° |
| H38 | C28 | H39 | 109.4° | 109.5° |
| H40 | C29 | H41 | 109.4° | 109.5° |
| H42 | C3 | H43 | 109.4° | 109.5° |
| H44 | C30 | H45 | 109.5° | 109.5° |
| H46 | C31 | H47 | 109.5° | 109.5° |
| H50 | C34 | H51 | 109.5° | 109.5° |
| H52 | C35 | H53 | 109.5° | 109.5° |
| H54 | C36 | H55 | 109.5° | 109.5° |
| H56 | C37 | H57 | 109.5° | 109.5° |
| H58 | C38 | H59 | 109.5° | 109.5° |
| H60 | C39 | H61 | 109.5° | 109.5° |
| H62 | C4 | H63 | 109.5° | 109.5° |
| H64 | C40 | H65 | 109.5° | 109.5° |
| H66 | C41 | H67 | 109.4° | 109.5° |
| H66 | C41 | H68 | 109.5° | 109.4° |
| H67 | C41 | H68 | 109.5° | 109.5° |
| H69 | C5 | H70 | 109.4° | 109.5° |
| H71 | C6 | H72 | 109.5° | 109.5° |
| H73 | C7 | H74 | 109.5° | 109.5° |
| H75 | C8 | H76 | 109.5° | 109.4° |
| H77 | C9 | H78 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | C33 | C34 | H49 | 180.0° | 179.9° |
| C33 | C32 | C31 | H48 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 129.0° | 126.3° |
| C33 | C32 | C31 | C30 | 168.7° | 127.6° |
| C33 | C32 | C31 | H46 | 48.3° | 7.6° |
| C33 | C32 | C31 | H47 | 70.9° | 112.4° |
| C32 | C33 | C34 | H50 | 110.6° | 113.7° |
| C32 | C33 | C34 | H51 | 8.6° | 6.3° |
| C34 | C33 | C32 | C31 | 0.1° | 7.6° |
| C33 | C34 | C35 | H50 | 120.4° | 119.9° |
| C33 | C34 | C35 | H51 | 120.4° | 120.1° |
| C33 | C34 | C35 | C36 | 166.5° | 180.0° |
| C34 | C33 | C32 | H48 | 179.9° | 172.4° |
| C33 | C34 | H50 | H51 | 118.6° | 120.0° |
| C33 | C34 | C35 | H52 | 45.8° | 60.0° |
| C33 | C34 | C35 | H53 | 72.9° | 59.9° |
| C32 | C31 | C30 | H46 | 120.4° | 120.0° |
| C32 | C31 | C30 | H47 | 120.4° | 120.1° |
| C32 | C31 | C30 | C29 | 168.9° | 180.0° |
| C32 | C31 | C30 | H44 | 70.3° | 60.0° |
| C32 | C31 | C30 | H45 | 48.1° | 59.9° |
| C32 | C31 | H46 | H47 | 118.8° | 120.0° |
| C31 | C32 | C33 | H49 | 179.9° | 172.5° |
| C34 | C35 | C36 | H52 | 120.6° | 119.9° |
| C34 | C35 | C36 | H53 | 120.6° | 120.0° |
| C34 | C35 | C36 | C37 | 64.6° | 179.9° |
| C35 | C34 | C33 | H49 | 51.0° | 53.6° |
| C35 | C34 | H50 | H51 | 118.7° | 120.0° |
| C34 | C35 | H52 | H53 | 118.0° | 120.0° |
| C34 | C35 | C36 | H54 | 174.8° | 60.1° |
| C34 | C35 | C36 | H55 | 56.0° | 60.0° |
| C35 | C36 | C37 | H54 | 120.6° | 120.0° |
| C35 | C36 | C37 | H55 | 120.6° | 119.9° |
| C35 | C36 | C37 | C38 | 173.3° | 180.0° |
| C36 | C35 | C34 | H50 | 73.1° | 60.0° |
| C36 | C35 | C34 | H51 | 46.1° | 60.0° |
| C36 | C35 | H52 | H53 | 118.1° | 120.1° |
| C35 | C36 | H54 | H55 | 118.0° | 120.0° |
| C35 | C36 | C37 | H56 | 52.6° | 60.0° |
| C35 | C36 | C37 | H57 | 65.9° | 60.0° |
| C31 | C30 | C29 | H44 | 120.9° | 120.0° |
| C31 | C30 | C29 | H45 | 120.8° | 120.0° |
| C31 | C30 | C29 | C28 | 64.0° | 180.0° |
| C31 | C30 | C29 | H40 | 175.2° | 60.0° |
| C31 | C30 | C29 | H41 | 56.7° | 60.0° |
| C31 | C30 | H44 | H45 | 117.4° | 120.0° |
| C30 | C31 | H46 | H47 | 118.8° | 120.0° |
| C30 | C31 | C32 | H48 | 11.3° | 52.5° |
| C30 | C29 | C28 | H40 | 120.8° | 120.0° |
| C30 | C29 | C28 | H41 | 120.8° | 120.0° |
| C30 | C29 | C28 | C27 | 162.3° | 180.0° |
| C30 | C29 | C28 | H38 | 77.0° | 60.0° |
| C30 | C29 | C28 | H39 | 41.6° | 60.0° |
| C30 | C29 | H40 | H41 | 117.7° | 119.9° |
| C29 | C30 | H44 | H45 | 117.3° | 120.0° |
| C29 | C30 | C31 | H46 | 48.5° | 60.0° |
| C29 | C30 | C31 | H47 | 70.7° | 60.0° |
| C36 | C37 | C38 | H56 | 120.7° | 120.0° |
| C36 | C37 | C38 | H57 | 120.7° | 120.0° |
| C36 | C37 | C38 | C39 | 132.4° | 180.0° |
| C37 | C36 | C35 | H52 | 56.0° | 60.0° |
| C37 | C36 | C35 | H53 | 174.8° | 60.0° |
| C37 | C36 | H54 | H55 | 118.1° | 120.0° |
| C36 | C37 | H56 | H57 | 117.7° | 120.1° |
| C36 | C37 | C38 | H58 | 11.9° | 60.0° |
| C36 | C37 | C38 | H59 | 107.0° | 60.0° |
| C29 | C28 | C27 | H38 | 120.7° | 119.9° |
| C29 | C28 | C27 | H39 | 120.7° | 120.0° |
| C29 | C28 | C27 | C26 | 173.5° | 180.0° |
| C29 | C28 | C27 | H36 | 66.0° | 60.1° |
| C29 | C28 | C27 | H37 | 52.8° | 60.0° |
| C29 | C28 | H38 | H39 | 117.9° | 120.0° |
| C28 | C29 | H40 | H41 | 117.7° | 120.1° |
| C28 | C29 | C30 | H44 | 56.8° | 60.0° |
| C28 | C29 | C30 | H45 | 175.1° | 60.0° |
| C28 | C27 | C26 | H36 | 120.6° | 119.9° |
| C28 | C27 | C26 | H37 | 120.6° | 120.0° |
| C28 | C27 | C26 | C25 | 166.4° | 180.0° |
| C28 | C27 | C26 | H34 | 73.0° | 60.0° |
| C28 | C27 | C26 | H35 | 45.7° | 60.0° |
| C28 | C27 | H36 | H37 | 118.1° | 120.1° |
| C27 | C28 | H38 | H39 | 117.9° | 120.1° |
| C27 | C28 | C29 | H40 | 41.5° | 60.1° |
| C27 | C28 | C29 | H41 | 76.9° | 60.0° |
| O4 | P | O2 | O3 | 129.7° | 120.0° |
| O4 | P | O2 | O5 | 115.1° | 120.0° |
| O4 | P | O3 | O5 | 123.0° | 120.0° |
| O4 | P | O2 | C20 | 170.6° | 55.0° |
| O4 | P | O5 | C21 | 78.4° | 55.0° |
| O4 | P | O3 | H79 | 0.0° | 180.0° |
| C37 | C38 | C39 | H58 | 120.6° | 120.0° |
| C37 | C38 | C39 | H59 | 120.6° | 120.0° |
| C37 | C38 | C39 | C40 | 167.6° | 180.0° |
| C38 | C37 | C36 | H54 | 66.1° | 60.0° |
| C38 | C37 | C36 | H55 | 52.7° | 60.1° |
| C38 | C37 | H56 | H57 | 117.7° | 120.0° |
| C37 | C38 | H58 | H59 | 118.2° | 120.1° |
| C37 | C38 | C39 | H60 | 46.9° | 60.0° |
| C37 | C38 | C39 | H61 | 71.7° | 60.0° |
| C27 | C26 | C25 | H34 | 120.7° | 120.0° |
| C27 | C26 | C25 | H35 | 120.7° | 120.0° |
| C27 | C26 | C25 | C24 | 177.6° | 180.0° |
| C27 | C26 | C25 | H32 | 57.3° | 60.0° |
| C27 | C26 | C25 | H33 | 62.1° | 60.0° |
| C27 | C26 | H34 | H35 | 118.0° | 120.0° |
| C26 | C27 | H36 | H37 | 118.2° | 120.0° |
| C26 | C27 | C28 | H38 | 52.8° | 60.1° |
| C26 | C27 | C28 | H39 | 65.9° | 60.0° |
| C26 | C25 | C24 | O9 | 0.3° | 0.1° |
| C26 | C25 | C24 | H32 | 120.3° | 120.0° |
| C26 | C25 | C24 | H33 | 120.3° | 120.0° |
| C26 | C25 | C24 | O8 | 179.0° | 180.0° |
| C26 | C25 | H32 | H33 | 119.0° | 120.0° |
| C25 | C26 | H34 | H35 | 118.0° | 120.0° |
| C25 | C26 | C27 | H36 | 45.8° | 60.1° |
| C25 | C26 | C27 | H37 | 73.0° | 60.0° |
| O9 | C24 | C25 | O8 | 179.3° | 179.9° |
| O9 | C24 | O8 | C19 | 41.3° | 0.1° |
| O9 | C24 | C25 | H32 | 120.0° | 119.9° |
| O9 | C24 | C25 | H33 | 120.5° | 120.1° |
| C38 | C39 | C40 | H60 | 120.7° | 120.0° |
| C38 | C39 | C40 | H61 | 120.7° | 119.9° |
| C38 | C39 | C40 | C41 | 179.2° | 180.0° |
| C39 | C38 | C37 | H56 | 106.8° | 60.0° |
| C39 | C38 | C37 | H57 | 11.7° | 60.0° |
| C39 | C38 | H58 | H59 | 118.2° | 120.0° |
| C38 | C39 | H60 | H61 | 117.8° | 120.0° |
| C38 | C39 | C40 | H64 | 58.7° | 60.0° |
| C38 | C39 | C40 | H65 | 60.3° | 60.0° |
| O2 | P | O3 | O5 | 113.4° | 120.1° |
| O2 | P | O5 | C21 | 166.3° | 175.0° |
| P | O2 | C20 | C19 | 115.1° | 180.0° |
| P | O2 | C20 | H25 | 4.8° | 60.0° |
| P | O2 | C20 | H26 | 125.0° | 60.1° |
| O2 | P | O3 | H79 | 123.5° | 60.0° |
| O3 | P | O2 | C20 | 59.7° | 64.9° |
| O3 | P | O5 | C21 | 51.1° | 65.0° |
| O5 | P | O2 | C20 | 55.5° | 175.0° |
| P | O5 | C21 | C22 | 92.8° | 180.0° |
| P | O5 | C21 | H27 | 27.0° | 60.0° |
| P | O5 | C21 | H28 | 147.4° | 60.0° |
| O5 | P | O3 | H79 | 123.1° | 60.1° |
| C25 | C24 | O8 | C19 | 138.0° | 180.0° |
| C24 | C25 | H32 | H33 | 119.1° | 120.0° |
| C24 | C25 | C26 | H34 | 61.7° | 60.0° |
| C24 | C25 | C26 | H35 | 56.9° | 60.0° |
| C24 | O8 | C19 | C20 | 142.4° | 90.0° |
| C24 | O8 | C19 | C18 | 93.7° | 150.0° |
| C24 | O8 | C19 | H22 | 23.5° | 30.0° |
| O8 | C24 | C25 | H32 | 60.7° | 60.0° |
| O8 | C24 | C25 | H33 | 58.7° | 60.0° |
| O2 | C20 | C19 | O8 | 67.2° | 65.0° |
| O2 | C20 | C19 | H25 | 119.9° | 120.0° |
| O2 | C20 | C19 | H26 | 119.9° | 120.0° |
| O2 | C20 | C19 | C18 | 171.0° | 55.0° |
| O2 | C20 | C19 | H22 | 52.1° | 175.0° |
| O2 | C20 | H25 | H26 | 120.3° | 120.0° |
| O8 | C19 | C20 | C18 | 121.8° | 120.0° |
| O8 | C19 | C20 | H22 | 119.3° | 120.0° |
| O8 | C19 | C18 | H22 | 117.4° | 120.0° |
| O8 | C19 | C18 | O1 | 121.9° | 65.0° |
| O8 | C19 | C18 | H20 | 119.0° | 55.0° |
| O8 | C19 | C18 | H21 | 2.7° | 175.0° |
| O8 | C19 | C20 | H25 | 172.9° | 175.0° |
| O8 | C19 | C20 | H26 | 52.7° | 55.0° |
| O5 | C21 | C22 | H27 | 119.8° | 120.0° |
| O5 | C21 | C22 | H28 | 119.8° | 120.0° |
| O5 | C21 | C22 | O7 | 75.9° | 65.0° |
| O5 | C21 | C22 | C23 | 161.6° | 175.0° |
| O5 | C21 | H27 | H28 | 120.5° | 120.0° |
| O5 | C21 | C22 | H29 | 42.6° | 55.0° |
| C21 | C22 | O7 | C23 | 123.8° | 120.0° |
| C21 | C22 | O7 | H29 | 117.8° | 120.0° |
| C21 | C22 | C23 | H29 | 119.0° | 120.0° |
| C21 | C22 | C23 | O6 | 31.6° | 175.0° |
| C22 | C21 | H27 | H28 | 120.5° | 120.0° |
| C21 | C22 | C23 | H30 | 151.8° | 65.0° |
| C21 | C22 | C23 | H31 | 88.6° | 55.0° |
| C21 | C22 | O7 | H81 | 180.0° | 60.1° |
| C39 | C40 | C41 | H64 | 120.5° | 120.0° |
| C39 | C40 | C41 | H65 | 120.5° | 120.0° |
| C40 | C39 | C38 | H58 | 71.8° | 60.0° |
| C40 | C39 | C38 | H59 | 47.0° | 60.0° |
| C40 | C39 | H60 | H61 | 117.9° | 120.1° |
| C39 | C40 | H64 | H65 | 118.5° | 120.0° |
| C39 | C40 | C41 | H66 | 180.0° | 60.0° |
| C39 | C40 | C41 | H67 | 60.0° | 60.0° |
| C39 | C40 | C41 | H68 | 60.0° | 180.0° |
| C20 | C19 | C18 | H22 | 118.9° | 120.0° |
| C20 | C19 | C18 | O1 | 114.4° | 55.0° |
| C20 | C19 | C18 | H20 | 4.7° | 175.0° |
| C20 | C19 | C18 | H21 | 126.4° | 65.0° |
| C19 | C20 | H25 | H26 | 120.3° | 120.0° |
| C19 | C18 | O1 | H20 | 119.1° | 120.0° |
| C19 | C18 | O1 | H21 | 119.1° | 120.0° |
| C19 | C18 | O1 | C17 | 102.9° | 180.0° |
| C19 | C18 | H20 | H21 | 122.5° | 120.0° |
| C18 | C19 | C20 | H25 | 51.1° | 65.0° |
| C18 | C19 | C20 | H26 | 69.1° | 175.0° |
| O7 | C22 | C23 | H29 | 119.0° | 120.1° |
| O7 | C22 | C23 | O6 | 153.6° | 65.0° |
| O7 | C22 | C21 | H27 | 44.0° | 175.0° |
| O7 | C22 | C21 | H28 | 164.3° | 55.0° |
| O7 | C22 | C23 | H30 | 86.2° | 55.0° |
| O7 | C22 | C23 | H31 | 33.4° | 175.0° |
| C41 | C40 | C39 | H60 | 60.1° | 60.0° |
| C41 | C40 | C39 | H61 | 58.6° | 60.1° |
| C41 | C40 | H64 | H65 | 118.5° | 120.1° |
| C40 | C41 | H66 | H67 | 120.0° | 120.1° |
| C40 | C41 | H66 | H68 | 120.0° | 120.0° |
| C40 | C41 | H67 | H68 | 120.0° | 120.0° |
| C22 | C23 | O6 | H30 | 120.2° | 120.0° |
| C22 | C23 | O6 | H31 | 120.2° | 120.0° |
| C23 | C22 | C21 | H27 | 78.5° | 55.0° |
| C23 | C22 | C21 | H28 | 41.8° | 65.0° |
| C22 | C23 | H30 | H31 | 119.5° | 120.0° |
| C22 | C23 | O6 | H80 | 180.0° | 180.0° |
| C23 | C22 | O7 | H81 | 56.1° | 59.9° |
| C15 | C16 | C17 | H18 | 120.7° | 120.0° |
| C15 | C16 | C17 | H19 | 120.7° | 120.0° |
| C16 | C15 | C14 | H16 | 120.5° | 120.0° |
| C16 | C15 | C14 | H17 | 120.5° | 120.0° |
| C15 | C16 | C17 | O1 | 83.8° | 180.0° |
| C15 | C16 | C17 | O | 101.4° | 0.0° |
| C16 | C15 | C14 | C13 | 100.4° | 180.0° |
| C16 | C15 | C14 | H14 | 138.9° | 60.0° |
| C16 | C15 | C14 | H15 | 20.3° | 60.0° |
| C16 | C15 | H16 | H17 | 118.5° | 120.0° |
| C15 | C16 | H18 | H19 | 117.9° | 120.0° |
| C16 | C17 | O1 | C18 | 131.3° | 180.0° |
| C17 | C16 | C15 | C14 | 21.1° | 180.0° |
| C16 | C17 | O1 | O | 174.9° | 180.0° |
| C17 | C16 | C15 | H16 | 99.4° | 60.0° |
| C17 | C16 | C15 | H17 | 141.6° | 60.0° |
| C17 | C16 | H18 | H19 | 117.9° | 120.0° |
| O6 | C23 | C22 | H29 | 87.4° | 55.0° |
| O6 | C23 | H30 | H31 | 119.4° | 120.0° |
| C18 | O1 | C17 | O | 43.6° | 0.0° |
| O1 | C18 | H20 | H21 | 122.5° | 120.0° |
| O1 | C18 | C19 | H22 | 4.5° | 175.0° |
| C15 | C14 | C13 | H14 | 120.7° | 120.0° |
| C15 | C14 | C13 | H15 | 120.7° | 120.0° |
| C15 | C14 | C13 | C12 | 170.0° | 180.0° |
| C15 | C14 | C13 | H12 | 69.5° | 60.0° |
| C15 | C14 | C13 | H13 | 49.5° | 60.0° |
| C15 | C14 | H14 | H15 | 117.8° | 120.0° |
| C14 | C15 | H16 | H17 | 118.4° | 120.0° |
| C14 | C15 | C16 | H18 | 99.6° | 60.0° |
| C14 | C15 | C16 | H19 | 141.7° | 60.0° |
| O1 | C17 | C16 | H18 | 36.9° | 60.0° |
| O1 | C17 | C16 | H19 | 155.5° | 60.0° |
| C17 | O1 | C18 | H20 | 137.9° | 60.0° |
| C17 | O1 | C18 | H21 | 16.2° | 60.0° |
| O | C17 | C16 | H18 | 137.9° | 120.0° |
| O | C17 | C16 | H19 | 19.3° | 120.0° |
| C14 | C13 | C12 | H12 | 120.5° | 120.1° |
| C14 | C13 | C12 | H13 | 120.6° | 120.0° |
| C14 | C13 | C12 | C11 | 167.8° | 180.0° |
| C14 | C13 | C12 | H10 | 71.6° | 60.0° |
| C14 | C13 | C12 | H11 | 47.3° | 60.0° |
| C14 | C13 | H12 | H13 | 118.4° | 120.0° |
| C13 | C14 | H14 | H15 | 117.8° | 120.0° |
| C13 | C14 | C15 | H16 | 20.1° | 60.0° |
| C13 | C14 | C15 | H17 | 139.1° | 60.0° |
| C3 | C2 | C1 | H23 | 120.8° | 120.1° |
| C3 | C2 | C1 | H24 | 120.8° | 120.0° |
| C2 | C3 | C4 | H42 | 120.6° | 120.0° |
| C2 | C3 | C4 | H43 | 120.6° | 120.0° |
| C2 | C3 | C4 | C5 | 178.3° | 180.0° |
| C3 | C2 | C1 | C | 173.6° | 180.0° |
| C3 | C2 | C1 | H4 | 53.2° | 60.0° |
| C3 | C2 | C1 | H5 | 66.0° | 60.0° |
| C3 | C2 | H23 | H24 | 117.6° | 120.0° |
| C2 | C3 | H42 | H43 | 118.1° | 119.9° |
| C2 | C3 | C4 | H62 | 61.1° | 60.0° |
| C2 | C3 | C4 | H63 | 57.6° | 60.1° |
| C1 | C2 | C3 | C4 | 174.2° | 180.0° |
| C2 | C1 | C | H4 | 120.4° | 120.1° |
| C2 | C1 | C | H5 | 120.4° | 120.0° |
| C2 | C1 | C | H1 | 180.0° | 60.0° |
| C2 | C1 | C | H2 | 60.0° | 60.0° |
| C2 | C1 | C | H3 | 60.0° | 180.0° |
| C2 | C1 | H4 | H5 | 118.6° | 120.0° |
| C1 | C2 | H23 | H24 | 117.6° | 119.9° |
| C1 | C2 | C3 | H42 | 65.2° | 60.0° |
| C1 | C2 | C3 | H43 | 53.6° | 60.0° |
| C3 | C4 | C5 | H62 | 120.6° | 120.0° |
| C3 | C4 | C5 | H63 | 120.6° | 120.0° |
| C3 | C4 | C5 | C6 | 44.9° | 180.0° |
| C4 | C3 | C2 | H23 | 65.0° | 60.0° |
| C4 | C3 | C2 | H24 | 53.4° | 60.0° |
| C4 | C3 | H42 | H43 | 118.1° | 120.1° |
| C3 | C4 | H62 | H63 | 118.1° | 120.1° |
| C3 | C4 | C5 | H69 | 165.5° | 60.0° |
| C3 | C4 | C5 | H70 | 75.7° | 60.0° |
| C4 | C5 | C6 | H69 | 120.6° | 120.0° |
| C4 | C5 | C6 | H70 | 120.6° | 120.0° |
| C4 | C5 | C6 | C7 | 115.4° | 180.0° |
| C5 | C4 | C3 | H42 | 57.7° | 60.0° |
| C5 | C4 | C3 | H43 | 61.1° | 60.0° |
| C5 | C4 | H62 | H63 | 118.1° | 120.0° |
| C4 | C5 | H69 | H70 | 118.2° | 120.0° |
| C4 | C5 | C6 | H71 | 5.2° | 60.1° |
| C4 | C5 | C6 | H72 | 123.9° | 60.0° |
| C13 | C12 | C11 | H10 | 120.5° | 120.0° |
| C13 | C12 | C11 | H11 | 120.5° | 120.0° |
| C13 | C12 | C11 | C10 | 49.1° | 180.0° |
| C13 | C12 | C11 | H8 | 71.4° | 60.0° |
| C13 | C12 | C11 | H9 | 169.7° | 60.0° |
| C13 | C12 | H10 | H11 | 118.3° | 120.0° |
| C12 | C13 | H12 | H13 | 118.3° | 120.0° |
| C12 | C13 | C14 | H14 | 49.3° | 60.0° |
| C12 | C13 | C14 | H15 | 69.3° | 60.0° |
| C1 | C | H1 | H2 | 120.0° | 120.0° |
| C1 | C | H1 | H3 | 120.0° | 120.0° |
| C1 | C | H2 | H3 | 120.0° | 120.0° |
| C | C1 | H4 | H5 | 118.6° | 120.0° |
| C | C1 | C2 | H23 | 65.6° | 59.9° |
| C | C1 | C2 | H24 | 52.8° | 60.0° |
| C5 | C6 | C7 | H71 | 120.6° | 120.0° |
| C5 | C6 | C7 | H72 | 120.7° | 120.0° |
| C5 | C6 | C7 | C8 | 105.9° | 180.0° |
| C6 | C5 | C4 | H62 | 75.7° | 60.0° |
| C6 | C5 | C4 | H63 | 165.5° | 60.0° |
| C6 | C5 | H69 | H70 | 118.2° | 120.1° |
| C5 | C6 | H71 | H72 | 118.0° | 120.1° |
| C5 | C6 | C7 | H73 | 14.8° | 60.0° |
| C5 | C6 | C7 | H74 | 133.5° | 60.0° |
| C12 | C11 | C10 | C9 | 63.0° | 180.0° |
| C12 | C11 | C10 | H8 | 120.5° | 120.1° |
| C12 | C11 | C10 | H9 | 120.5° | 120.0° |
| C12 | C11 | C10 | H6 | 176.4° | 60.0° |
| C12 | C11 | C10 | H7 | 57.5° | 60.0° |
| C12 | C11 | H8 | H9 | 118.4° | 120.0° |
| C11 | C12 | H10 | H11 | 118.3° | 120.0° |
| C11 | C12 | C13 | H12 | 47.3° | 59.9° |
| C11 | C12 | C13 | H13 | 71.6° | 60.0° |
| C6 | C7 | C8 | C9 | 85.7° | 180.0° |
| C6 | C7 | C8 | H73 | 120.7° | 120.0° |
| C6 | C7 | C8 | H74 | 120.6° | 120.0° |
| C7 | C6 | C5 | H69 | 124.0° | 60.0° |
| C7 | C6 | C5 | H70 | 5.2° | 60.0° |
| C7 | C6 | H71 | H72 | 118.0° | 120.0° |
| C6 | C7 | H73 | H74 | 118.0° | 120.0° |
| C6 | C7 | C8 | H75 | 34.9° | 60.0° |
| C6 | C7 | C8 | H76 | 153.6° | 60.0° |
| C10 | C9 | C8 | H77 | 120.5° | 120.0° |
| C10 | C9 | C8 | H78 | 120.5° | 119.9° |
| C9 | C10 | C11 | H6 | 120.6° | 120.0° |
| C9 | C10 | C11 | H7 | 120.6° | 120.0° |
| C10 | C9 | C8 | C7 | 117.4° | 180.0° |
| C9 | C10 | H6 | H7 | 118.2° | 120.0° |
| C9 | C10 | C11 | H8 | 176.4° | 60.0° |
| C9 | C10 | C11 | H9 | 57.5° | 60.0° |
| C10 | C9 | C8 | H75 | 121.9° | 60.0° |
| C10 | C9 | C8 | H76 | 3.3° | 60.0° |
| C10 | C9 | H77 | H78 | 118.5° | 119.9° |
| C8 | C9 | C10 | C11 | 51.8° | 180.0° |
| C9 | C8 | C7 | H75 | 120.7° | 120.0° |
| C9 | C8 | C7 | H76 | 120.7° | 120.0° |
| C8 | C9 | C10 | H6 | 68.8° | 60.0° |
| C8 | C9 | C10 | H7 | 172.3° | 60.0° |
| C9 | C8 | C7 | H73 | 35.0° | 60.0° |
| C9 | C8 | C7 | H74 | 153.6° | 60.0° |
| C9 | C8 | H75 | H76 | 117.9° | 120.0° |
| C8 | C9 | H77 | H78 | 118.5° | 120.1° |
| C11 | C10 | H6 | H7 | 118.2° | 120.0° |
| C10 | C11 | H8 | H9 | 118.4° | 120.0° |
| C10 | C11 | C12 | H10 | 169.7° | 60.0° |
| C10 | C11 | C12 | H11 | 71.4° | 60.0° |
| C11 | C10 | C9 | H77 | 68.7° | 60.0° |
| C11 | C10 | C9 | H78 | 172.3° | 60.0° |
| C8 | C7 | C6 | H71 | 133.5° | 60.0° |
| C8 | C7 | C6 | H72 | 14.8° | 60.0° |
| C8 | C7 | H73 | H74 | 118.0° | 120.1° |
| C7 | C8 | H75 | H76 | 117.9° | 120.0° |
| C7 | C8 | C9 | H77 | 3.0° | 60.0° |
| C7 | C8 | C9 | H78 | 122.1° | 60.1° |
| H1 | C | H2 | H3 | 120.0° | 120.0° |
| H1 | C | C1 | H4 | 59.6° | 60.0° |
| H1 | C | C1 | H5 | 59.6° | 180.0° |
| H2 | C | C1 | H4 | 179.5° | 179.9° |
| H2 | C | C1 | H5 | 60.4° | 60.0° |
| H3 | C | C1 | H4 | 60.4° | 59.9° |
| H3 | C | C1 | H5 | 179.5° | 60.0° |
| H4 | C1 | C2 | H23 | 174.0° | 180.0° |
| H4 | C1 | C2 | H24 | 67.6° | 60.0° |
| H5 | C1 | C2 | H23 | 54.8° | 60.1° |
| H5 | C1 | C2 | H24 | 173.3° | 180.0° |
| H6 | C10 | C11 | H8 | 55.9° | 60.0° |
| H6 | C10 | C11 | H9 | 63.1° | 180.0° |
| H6 | C10 | C9 | H77 | 170.7° | 180.0° |
| H6 | C10 | C9 | H78 | 51.7° | 60.0° |
| H7 | C10 | C11 | H8 | 63.0° | 180.0° |
| H7 | C10 | C11 | H9 | 178.1° | 60.0° |
| H7 | C10 | C9 | H77 | 51.9° | 60.0° |
| H7 | C10 | C9 | H78 | 67.2° | 180.0° |
| H8 | C11 | C12 | H10 | 49.1° | 180.0° |
| H8 | C11 | C12 | H11 | 168.1° | 60.0° |
| H9 | C11 | C12 | H10 | 69.8° | 60.0° |
| H9 | C11 | C12 | H11 | 49.1° | 180.0° |
| H10 | C12 | C13 | H12 | 167.9° | 180.0° |
| H10 | C12 | C13 | H13 | 49.0° | 60.0° |
| H11 | C12 | C13 | H12 | 73.2° | 60.0° |
| H11 | C12 | C13 | H13 | 167.9° | 180.0° |
| H12 | C13 | C14 | H14 | 169.9° | 179.9° |
| H12 | C13 | C14 | H15 | 51.2° | 60.0° |
| H13 | C13 | C14 | H14 | 71.2° | 60.0° |
| H13 | C13 | C14 | H15 | 170.2° | 180.0° |
| H14 | C14 | C15 | H16 | 100.6° | 180.0° |
| H14 | C14 | C15 | H17 | 18.4° | 59.9° |
| H15 | C14 | C15 | H16 | 140.8° | 60.0° |
| H15 | C14 | C15 | H17 | 100.2° | 180.0° |
| H16 | C15 | C16 | H18 | 139.9° | 180.0° |
| H16 | C15 | C16 | H19 | 21.3° | 60.0° |
| H17 | C15 | C16 | H18 | 20.9° | 60.0° |
| H17 | C15 | C16 | H19 | 97.8° | 180.0° |
| H20 | C18 | C19 | H22 | 123.6° | 65.0° |
| H21 | C18 | C19 | H22 | 114.7° | 55.0° |
| H22 | C19 | C20 | H25 | 67.8° | 55.0° |
| H22 | C19 | C20 | H26 | 172.0° | 65.0° |
| H23 | C2 | C3 | H42 | 55.6° | 180.0° |
| H23 | C2 | C3 | H43 | 174.4° | 60.0° |
| H24 | C2 | C3 | H42 | 174.0° | 60.0° |
| H24 | C2 | C3 | H43 | 67.2° | 180.0° |
| H27 | C21 | C22 | H29 | 162.5° | 65.0° |
| H28 | C21 | C22 | H29 | 77.2° | 175.0° |
| H29 | C22 | C23 | H30 | 32.8° | 175.0° |
| H29 | C22 | C23 | H31 | 152.4° | 65.0° |
| H29 | C22 | O7 | H81 | 62.2° | 180.0° |
| H30 | C23 | O6 | H80 | 59.8° | 60.0° |
| H31 | C23 | O6 | H80 | 59.8° | 60.0° |
| H32 | C25 | C26 | H34 | 178.0° | 180.0° |
| H32 | C25 | C26 | H35 | 63.4° | 60.0° |
| H33 | C25 | C26 | H34 | 58.6° | 60.0° |
| H33 | C25 | C26 | H35 | 177.3° | 180.0° |
| H34 | C26 | C27 | H36 | 166.5° | 180.0° |
| H34 | C26 | C27 | H37 | 47.6° | 60.0° |
| H35 | C26 | C27 | H36 | 74.9° | 59.9° |
| H35 | C26 | C27 | H37 | 166.3° | 180.0° |
| H36 | C27 | C28 | H38 | 173.3° | 180.0° |
| H36 | C27 | C28 | H39 | 54.7° | 59.9° |
| H37 | C27 | C28 | H38 | 67.9° | 59.9° |
| H37 | C27 | C28 | H39 | 173.5° | 180.0° |
| H38 | C28 | C29 | H40 | 162.2° | 180.0° |
| H38 | C28 | C29 | H41 | 43.8° | 59.9° |
| H39 | C28 | C29 | H40 | 79.1° | 60.0° |
| H39 | C28 | C29 | H41 | 162.4° | 180.0° |
| H40 | C29 | C30 | H44 | 63.9° | 180.0° |
| H40 | C29 | C30 | H45 | 54.4° | 60.0° |
| H41 | C29 | C30 | H44 | 177.6° | 60.0° |
| H41 | C29 | C30 | H45 | 64.1° | 180.0° |
| H42 | C3 | C4 | H62 | 178.3° | 180.0° |
| H42 | C3 | C4 | H63 | 63.0° | 59.9° |
| H43 | C3 | C4 | H62 | 59.5° | 59.9° |
| H43 | C3 | C4 | H63 | 178.3° | 180.0° |
| H44 | C30 | C31 | H46 | 169.3° | 180.0° |
| H44 | C30 | C31 | H47 | 50.1° | 60.0° |
| H45 | C30 | C31 | H46 | 72.3° | 60.0° |
| H45 | C30 | C31 | H47 | 168.5° | 180.0° |
| H46 | C31 | C32 | H48 | 131.7° | 172.4° |
| H47 | C31 | C32 | H48 | 109.1° | 67.6° |
| H48 | C32 | C33 | H49 | 0.1° | 7.5° |
| H49 | C33 | C34 | H50 | 69.4° | 66.4° |
| H49 | C33 | C34 | H51 | 171.4° | 173.6° |
| H50 | C34 | C35 | H52 | 166.3° | 180.0° |
| H50 | C34 | C35 | H53 | 47.5° | 60.0° |
| H51 | C34 | C35 | H52 | 74.6° | 60.0° |
| H51 | C34 | C35 | H53 | 166.7° | 180.0° |
| H52 | C35 | C36 | H54 | 64.6° | 180.0° |
| H52 | C35 | C36 | H55 | 176.7° | 59.9° |
| H53 | C35 | C36 | H54 | 54.2° | 60.0° |
| H53 | C35 | C36 | H55 | 64.6° | 180.0° |
| H54 | C36 | C37 | H56 | 173.2° | 180.0° |
| H54 | C36 | C37 | H57 | 54.7° | 60.0° |
| H55 | C36 | C37 | H56 | 68.1° | 59.9° |
| H55 | C36 | C37 | H57 | 173.4° | 180.0° |
| H56 | C37 | C38 | H58 | 132.6° | 180.0° |
| H56 | C37 | C38 | H59 | 13.8° | 60.0° |
| H57 | C37 | C38 | H58 | 108.9° | 60.0° |
| H57 | C37 | C38 | H59 | 132.3° | 180.0° |
| H58 | C38 | C39 | H60 | 167.5° | 180.0° |
| H58 | C38 | C39 | H61 | 48.9° | 60.0° |
| H59 | C38 | C39 | H60 | 73.7° | 60.0° |
| H59 | C38 | C39 | H61 | 167.7° | 180.0° |
| H60 | C39 | C40 | H64 | 179.4° | 180.0° |
| H60 | C39 | C40 | H65 | 60.4° | 60.0° |
| H61 | C39 | C40 | H64 | 61.9° | 59.9° |
| H61 | C39 | C40 | H65 | 179.0° | 179.9° |
| H62 | C4 | C5 | H69 | 44.9° | 180.0° |
| H62 | C4 | C5 | H70 | 163.7° | 60.0° |
| H63 | C4 | C5 | H69 | 73.9° | 60.0° |
| H63 | C4 | C5 | H70 | 44.9° | 180.0° |
| H64 | C40 | C41 | H66 | 59.5° | 180.0° |
| H64 | C40 | C41 | H67 | 179.5° | 60.0° |
| H64 | C40 | C41 | H68 | 60.5° | 60.1° |
| H65 | C40 | C41 | H66 | 59.5° | 60.0° |
| H65 | C40 | C41 | H67 | 60.5° | 180.0° |
| H65 | C40 | C41 | H68 | 179.5° | 60.0° |
| H66 | C41 | H67 | H68 | 120.0° | 119.9° |
| H69 | C5 | C6 | H71 | 115.3° | 180.0° |
| H69 | C5 | C6 | H72 | 3.3° | 60.0° |
| H70 | C5 | C6 | H71 | 125.9° | 59.9° |
| H70 | C5 | C6 | H72 | 115.5° | NaN° |
| H71 | C6 | C7 | H73 | 105.9° | 180.0° |
| H71 | C6 | C7 | H74 | 12.8° | 60.0° |
| H72 | C6 | C7 | H73 | 135.5° | 60.0° |
| H72 | C6 | C7 | H74 | 105.9° | NaN° |
| H73 | C7 | C8 | H75 | 155.6° | 180.0° |
| H73 | C7 | C8 | H76 | 85.8° | 60.0° |
| H74 | C7 | C8 | H75 | 85.7° | 60.0° |
| H74 | C7 | C8 | H76 | 32.9° | 180.0° |
| H75 | C8 | C9 | H77 | 117.6° | 60.0° |
| H75 | C8 | C9 | H78 | 1.4° | 179.9° |
| H76 | C8 | C9 | H77 | 123.7° | 180.0° |
| H76 | C8 | C9 | H78 | 117.2° | 59.9° |
