KXX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C54 | O53 | sing | 1.43Å | 1.38Å | |
| O53 | C09 | sing | 1.43Å | 1.39Å | |
| O49 | C14 | sing | 1.44Å | 1.37Å | |
| O51 | C52 | sing | 1.43Å | 1.39Å | |
| O51 | C11 | sing | 1.43Å | 1.40Å | |
| C09 | C10 | sing | 1.54Å | 1.57Å | |
| C09 | C08 | sing | 1.52Å | 1.55Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | O15 | sing | 1.43Å | 1.45Å | |
| C55 | C07 | sing | 1.52Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C06 | C07 | sing | 1.53Å | 1.54Å | |
| C06 | C05 | sing | 1.52Å | 1.55Å | |
| O15 | C14 | sing | 1.43Å | 1.48Å | |
| C12 | C13 | sing | 1.52Å | 1.49Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.50Å | 1.56Å | |
| O17 | C16 | doub | 1.20Å | 1.18Å | |
| C07 | C08 | sing | 1.52Å | 1.56Å | |
| C50 | C13 | sing | 1.53Å | 1.53Å | |
| C04 | C05 | doub | 1.31Å | 1.33Å | |
| C04 | C03 | sing | 1.50Å | 1.55Å | |
| C05 | C56 | sing | 1.51Å | 1.55Å | |
| C16 | C18 | sing | 1.49Å | 1.55Å | |
| C02 | C03 | sing | 1.53Å | 1.55Å | |
| C02 | C01 | sing | 1.53Å | 1.54Å | |
| C03 | C33 | sing | 1.51Å | 1.55Å | |
| C18 | O19 | doub | 1.22Å | 1.18Å | |
| C18 | N20 | sing | 1.34Å | 1.46Å | |
| O34 | C33 | doub | 1.21Å | 1.19Å | |
| C21 | N20 | sing | 1.48Å | 1.53Å | |
| C21 | C22 | sing | 1.54Å | 1.53Å | |
| C33 | C32 | sing | 1.51Å | 1.56Å | |
| N20 | C25 | sing | 1.46Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.47Å | |
| C48 | C37 | sing | 1.51Å | 1.53Å | |
| C32 | C31 | sing | 1.53Å | 1.57Å | |
| C36 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | sing | 1.52Å | 1.55Å | |
| C30 | C29 | sing | 1.53Å | 1.57Å | |
| O28 | C29 | sing | 1.45Å | 1.44Å | |
| O28 | C26 | sing | 1.34Å | 1.43Å | |
| C25 | C26 | sing | 1.50Å | 1.53Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.46Å | |
| C31 | O35 | sing | 1.43Å | 1.41Å | |
| C29 | C37 | sing | 1.51Å | 1.57Å | |
| C37 | C38 | doub | 1.31Å | 1.36Å | |
| C26 | O27 | doub | 1.21Å | 1.19Å | |
| C38 | C39 | sing | 1.51Å | 1.58Å | |
| C39 | C40 | sing | 1.53Å | 1.54Å | |
| C39 | C44 | sing | 1.53Å | 1.54Å | |
| C40 | C41 | sing | 1.53Å | 1.53Å | |
| C41 | C42 | sing | 1.53Å | 1.53Å | |
| C44 | C43 | sing | 1.53Å | 1.53Å | |
| C43 | C42 | sing | 1.53Å | 1.52Å | |
| C43 | O45 | sing | 1.43Å | 1.39Å | |
| C42 | O47 | sing | 1.43Å | 1.40Å | |
| C46 | O45 | sing | 1.43Å | 1.39Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.10Å | 1.10Å | |
| C12 | H3 | sing | 1.10Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.10Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C02 | H9 | sing | 1.09Å | 1.10Å | |
| C02 | H10 | sing | 1.09Å | 1.10Å | |
| C03 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.08Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C07 | H15 | sing | 1.11Å | 1.10Å | |
| C08 | H16 | sing | 1.10Å | 1.10Å | |
| C08 | H17 | sing | 1.10Å | 1.10Å | |
| C09 | H18 | sing | 1.08Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.10Å | 1.10Å | |
| C29 | H28 | sing | 1.08Å | 1.10Å | |
| C30 | H29 | sing | 1.10Å | 1.10Å | |
| C31 | H30 | sing | 1.10Å | 1.10Å | |
| C32 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| C36 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C38 | H36 | sing | 1.08Å | 1.08Å | |
| C39 | H37 | sing | 1.09Å | 1.10Å | |
| C40 | H38 | sing | 1.09Å | 1.10Å | |
| C40 | H39 | sing | 1.09Å | 1.10Å | |
| C41 | H40 | sing | 1.09Å | 1.10Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C43 | H43 | sing | 1.09Å | 1.10Å | |
| C44 | H44 | sing | 1.09Å | 1.10Å | |
| C44 | H45 | sing | 1.09Å | 1.10Å | |
| C46 | H46 | sing | 1.09Å | 1.10Å | |
| C46 | H47 | sing | 1.09Å | 1.10Å | |
| C46 | H48 | sing | 1.09Å | 1.10Å | |
| C48 | H49 | sing | 1.09Å | 1.10Å | |
| C48 | H50 | sing | 1.09Å | 1.10Å | |
| C48 | H51 | sing | 1.09Å | 1.10Å | |
| C50 | H52 | sing | 1.09Å | 1.10Å | |
| C50 | H53 | sing | 1.09Å | 1.10Å | |
| C50 | H54 | sing | 1.09Å | 1.10Å | |
| C52 | H55 | sing | 1.09Å | 1.10Å | |
| C52 | H56 | sing | 1.09Å | 1.10Å | |
| C52 | H57 | sing | 1.09Å | 1.10Å | |
| C54 | H58 | sing | 1.09Å | 1.10Å | |
| C54 | H59 | sing | 1.09Å | 1.10Å | |
| C54 | H60 | sing | 1.09Å | 1.10Å | |
| C55 | H61 | sing | 1.09Å | 1.10Å | |
| C55 | H62 | sing | 1.09Å | 1.10Å | |
| C55 | H63 | sing | 1.09Å | 1.10Å | |
| C56 | H64 | sing | 1.09Å | 1.10Å | |
| C56 | H65 | sing | 1.09Å | 1.10Å | |
| C56 | H66 | sing | 1.09Å | 1.10Å | |
| O35 | H67 | sing | 0.97Å | 0.95Å | |
| O47 | H68 | sing | 0.97Å | 0.95Å | |
| O49 | H69 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C54 | O53 | C09 | 111.2° | 114.0° |
| O53 | C54 | H58 | 109.5° | 109.5° |
| O53 | C54 | H59 | 109.5° | 109.5° |
| O53 | C54 | H60 | 109.5° | 109.5° |
| O53 | C09 | C10 | 109.5° | 108.5° |
| O53 | C09 | C08 | 110.8° | 109.0° |
| O53 | C09 | H18 | 108.8° | 108.8° |
| O49 | C14 | O15 | 109.0° | 108.9° |
| O49 | C14 | C13 | 111.5° | 108.7° |
| O49 | C14 | C16 | 108.6° | 108.8° |
| C14 | O49 | H69 | 109.5° | 114.0° |
| C52 | O51 | C11 | 114.5° | 114.0° |
| O51 | C52 | H55 | 109.5° | 109.4° |
| O51 | C52 | H56 | 109.5° | 109.4° |
| O51 | C52 | H57 | 109.4° | 109.5° |
| O51 | C11 | C10 | 108.0° | 109.9° |
| O51 | C11 | C12 | 110.1° | 110.1° |
| O51 | C11 | H5 | 110.4° | 108.4° |
| C10 | C09 | C08 | 114.1° | 108.4° |
| C09 | C10 | C11 | 115.8° | 110.3° |
| C09 | C10 | O15 | 102.4° | 109.3° |
| C09 | C10 | H1 | 109.1° | 108.3° |
| C10 | C09 | H18 | 106.6° | 108.7° |
| C09 | C08 | C07 | 113.2° | 114.2° |
| C09 | C08 | H16 | 108.6° | 108.3° |
| C09 | C08 | H17 | 108.5° | 109.2° |
| C08 | C09 | H18 | 106.8° | 113.3° |
| C11 | C10 | O15 | 108.7° | 109.6° |
| C10 | C11 | C12 | 110.5° | 110.9° |
| C11 | C10 | H1 | 109.8° | 109.5° |
| C10 | C11 | H5 | 108.8° | 108.8° |
| C10 | O15 | C14 | 112.0° | 113.5° |
| O15 | C10 | H1 | 110.8° | 109.8° |
| C55 | C07 | C06 | 111.0° | 110.2° |
| C55 | C07 | C08 | 113.3° | 112.5° |
| C55 | C07 | H15 | 107.5° | 107.4° |
| C07 | C55 | H61 | 109.5° | 109.5° |
| C07 | C55 | H62 | 109.5° | 109.4° |
| C07 | C55 | H63 | 109.5° | 109.5° |
| C11 | C12 | C13 | 113.1° | 112.9° |
| C11 | C12 | H3 | 108.5° | 108.8° |
| C11 | C12 | H4 | 108.6° | 109.0° |
| C12 | C11 | H5 | 108.9° | 108.8° |
| C07 | C06 | C05 | 111.4° | 109.1° |
| C06 | C07 | C08 | 110.3° | 111.4° |
| C07 | C06 | H13 | 109.0° | 109.9° |
| C07 | C06 | H14 | 109.0° | 109.9° |
| C06 | C07 | H15 | 107.3° | 107.6° |
| C06 | C05 | C04 | 119.1° | 119.5° |
| C06 | C05 | C56 | 118.5° | 118.9° |
| C05 | C06 | H13 | 109.0° | 109.2° |
| C05 | C06 | H14 | 109.0° | 108.8° |
| O15 | C14 | C13 | 111.7° | 110.0° |
| O15 | C14 | C16 | 101.7° | 109.9° |
| C12 | C13 | C14 | 111.6° | 111.6° |
| C12 | C13 | C50 | 110.5° | 110.3° |
| C12 | C13 | H2 | 108.5° | 108.5° |
| C13 | C12 | H3 | 108.6° | 108.8° |
| C13 | C12 | H4 | 108.6° | 109.2° |
| C13 | C14 | C16 | 113.8° | 110.4° |
| C14 | C13 | C50 | 110.2° | 109.9° |
| C14 | C13 | H2 | 108.0° | 108.6° |
| C14 | C16 | O17 | 120.3° | 118.8° |
| C14 | C16 | C18 | 121.3° | 121.5° |
| O17 | C16 | C18 | 118.4° | 119.7° |
| C08 | C07 | H15 | 107.1° | 107.5° |
| C07 | C08 | H16 | 108.5° | 108.8° |
| C07 | C08 | H17 | 108.5° | 109.1° |
| C50 | C13 | H2 | 108.0° | 107.8° |
| C13 | C50 | H52 | 109.5° | 109.5° |
| C13 | C50 | H53 | 109.4° | 109.5° |
| C13 | C50 | H54 | 109.5° | 109.5° |
| C05 | C04 | C03 | 122.3° | 123.1° |
| C04 | C05 | C56 | 122.3° | 121.6° |
| C05 | C04 | H12 | 118.9° | 118.1° |
| C04 | C03 | C02 | 110.1° | 109.8° |
| C04 | C03 | C33 | 106.8° | 109.8° |
| C04 | C03 | H11 | 109.1° | 110.5° |
| C03 | C04 | H12 | 118.8° | 118.8° |
| C05 | C56 | H64 | 109.5° | 109.5° |
| C05 | C56 | H65 | 109.5° | 109.4° |
| C05 | C56 | H66 | 109.5° | 109.5° |
| C16 | C18 | O19 | 120.6° | 118.1° |
| C16 | C18 | N20 | 118.5° | 121.4° |
| C03 | C02 | C01 | 114.3° | 109.5° |
| C02 | C03 | C33 | 112.6° | 108.4° |
| C03 | C02 | H9 | 108.3° | 109.5° |
| C03 | C02 | H10 | 108.3° | 109.5° |
| C02 | C03 | H11 | 109.0° | 109.7° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C02 | C01 | H7 | 109.5° | 109.5° |
| C02 | C01 | H8 | 109.5° | 109.5° |
| C01 | C02 | H9 | 108.3° | 109.5° |
| C01 | C02 | H10 | 108.2° | 109.5° |
| C03 | C33 | O34 | 120.1° | 119.0° |
| C03 | C33 | C32 | 118.1° | 121.3° |
| C33 | C03 | H11 | 109.1° | 108.6° |
| O19 | C18 | N20 | 120.9° | 120.5° |
| C18 | N20 | C21 | 123.6° | 119.4° |
| C18 | N20 | C25 | 121.2° | 122.9° |
| O34 | C33 | C32 | 121.7° | 119.6° |
| N20 | C21 | C22 | 111.1° | 108.4° |
| C21 | N20 | C25 | 115.1° | 117.7° |
| N20 | C21 | H19 | 109.0° | 110.5° |
| N20 | C21 | H20 | 109.1° | 109.6° |
| C21 | C22 | C23 | 114.9° | 110.1° |
| C22 | C21 | H19 | 109.1° | 108.3° |
| C22 | C21 | H20 | 109.1° | 109.8° |
| C21 | C22 | H21 | 108.1° | 109.3° |
| C21 | C22 | H22 | 108.1° | 109.2° |
| C33 | C32 | C31 | 113.4° | 109.4° |
| C33 | C32 | H31 | 108.5° | 109.2° |
| C33 | C32 | H32 | 108.5° | 109.6° |
| N20 | C25 | C26 | 110.8° | 113.0° |
| N20 | C25 | C24 | 111.5° | 108.6° |
| N20 | C25 | H27 | 108.2° | 108.4° |
| C22 | C23 | C24 | 115.0° | 110.0° |
| C23 | C22 | H21 | 108.1° | 109.5° |
| C23 | C22 | H22 | 108.1° | 109.4° |
| C22 | C23 | H23 | 108.1° | 109.6° |
| C22 | C23 | H24 | 108.1° | 109.5° |
| C48 | C37 | C29 | 120.0° | 120.0° |
| C48 | C37 | C38 | 123.2° | 120.0° |
| C37 | C48 | H49 | 109.5° | 109.5° |
| C37 | C48 | H50 | 109.4° | 109.5° |
| C37 | C48 | H51 | 109.5° | 109.5° |
| C32 | C31 | C30 | 113.0° | 113.1° |
| C32 | C31 | O35 | 105.5° | 109.6° |
| C32 | C31 | H30 | 108.7° | 107.4° |
| C31 | C32 | H31 | 108.5° | 109.7° |
| C31 | C32 | H32 | 108.5° | 110.5° |
| C36 | C30 | C31 | 112.7° | 109.9° |
| C36 | C30 | C29 | 109.8° | 108.7° |
| C36 | C30 | H29 | 108.4° | 107.5° |
| C30 | C36 | H33 | 109.5° | 109.5° |
| C30 | C36 | H34 | 109.4° | 109.5° |
| C30 | C36 | H35 | 109.5° | 109.5° |
| C31 | C30 | C29 | 109.8° | 113.9° |
| C30 | C31 | O35 | 109.8° | 111.3° |
| C31 | C30 | H29 | 108.1° | 108.7° |
| C30 | C31 | H30 | 108.9° | 108.2° |
| C30 | C29 | O28 | 108.7° | 107.6° |
| C30 | C29 | C37 | 111.2° | 109.1° |
| C30 | C29 | H28 | 108.9° | 110.2° |
| C29 | C30 | H29 | 107.9° | 107.9° |
| C29 | O28 | C26 | 113.2° | 121.1° |
| O28 | C29 | C37 | 108.5° | 109.1° |
| O28 | C29 | H28 | 110.7° | 110.6° |
| O28 | C26 | C25 | 118.6° | 118.8° |
| O28 | C26 | O27 | 123.0° | 121.8° |
| C26 | C25 | C24 | 109.9° | 110.4° |
| C25 | C26 | O27 | 118.4° | 119.4° |
| C26 | C25 | H27 | 108.2° | 108.4° |
| C25 | C24 | C23 | 113.0° | 108.4° |
| C25 | C24 | H25 | 108.6° | 109.6° |
| C25 | C24 | H26 | 108.6° | 109.7° |
| C24 | C25 | H27 | 108.2° | 107.9° |
| C24 | C23 | H23 | 108.1° | 109.1° |
| C24 | C23 | H24 | 108.1° | 109.3° |
| C23 | C24 | H25 | 108.6° | 110.0° |
| C23 | C24 | H26 | 108.6° | 109.5° |
| O35 | C31 | H30 | 110.9° | 107.1° |
| C31 | O35 | H67 | 109.5° | 114.0° |
| C29 | C37 | C38 | 116.8° | 120.0° |
| C37 | C29 | H28 | 108.8° | 110.3° |
| C37 | C38 | C39 | 122.8° | 120.0° |
| C37 | C38 | H36 | 118.6° | 120.0° |
| C38 | C39 | C40 | 108.6° | 109.5° |
| C38 | C39 | C44 | 108.1° | 109.5° |
| C39 | C38 | H36 | 118.6° | 120.0° |
| C38 | C39 | H37 | 108.7° | 109.5° |
| C40 | C39 | C44 | 112.9° | 109.5° |
| C39 | C40 | C41 | 111.1° | 109.5° |
| C40 | C39 | H37 | 109.2° | 109.4° |
| C39 | C40 | H38 | 109.1° | 109.5° |
| C39 | C40 | H39 | 109.1° | 109.5° |
| C39 | C44 | C43 | 111.2° | 109.5° |
| C44 | C39 | H37 | 109.2° | 109.5° |
| C39 | C44 | H44 | 109.0° | 109.5° |
| C39 | C44 | H45 | 109.0° | 109.5° |
| C40 | C41 | C42 | 113.6° | 109.4° |
| C41 | C40 | H38 | 109.1° | 109.5° |
| C41 | C40 | H39 | 109.0° | 109.5° |
| C40 | C41 | H40 | 108.4° | 109.5° |
| C40 | C41 | H41 | 108.4° | 109.5° |
| C41 | C42 | C43 | 112.5° | 109.5° |
| C41 | C42 | O47 | 108.8° | 109.4° |
| C42 | C41 | H40 | 108.4° | 109.5° |
| C42 | C41 | H41 | 108.4° | 109.5° |
| C41 | C42 | H42 | 108.6° | 109.4° |
| C44 | C43 | C42 | 111.7° | 109.5° |
| C44 | C43 | O45 | 110.8° | 109.5° |
| C44 | C43 | H43 | 107.7° | 109.5° |
| C43 | C44 | H44 | 109.0° | 109.5° |
| C43 | C44 | H45 | 109.0° | 109.5° |
| C42 | C43 | O45 | 109.2° | 109.5° |
| C43 | C42 | O47 | 107.8° | 109.5° |
| C43 | C42 | H42 | 108.7° | 109.5° |
| C42 | C43 | H43 | 107.9° | 109.5° |
| C43 | O45 | C46 | 113.2° | 114.0° |
| O45 | C43 | H43 | 109.5° | 109.4° |
| O47 | C42 | H42 | 110.4° | 109.5° |
| C42 | O47 | H68 | 109.5° | 114.0° |
| O45 | C46 | H46 | 109.5° | 109.5° |
| O45 | C46 | H47 | 109.5° | 109.4° |
| O45 | C46 | H48 | 109.5° | 109.5° |
| H3 | C12 | H4 | 109.5° | 107.9° |
| H6 | C01 | H7 | 109.4° | 109.4° |
| H6 | C01 | H8 | 109.5° | 109.5° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H9 | C02 | H10 | 109.5° | 109.4° |
| H13 | C06 | H14 | 109.5° | 109.8° |
| H16 | C08 | H17 | 109.5° | 107.0° |
| H19 | C21 | H20 | 109.5° | 110.1° |
| H21 | C22 | H22 | 109.5° | 109.4° |
| H23 | C23 | H24 | 109.4° | 109.4° |
| H25 | C24 | H26 | 109.5° | 109.6° |
| H31 | C32 | H32 | 109.5° | 108.6° |
| H33 | C36 | H34 | 109.5° | 109.5° |
| H33 | C36 | H35 | 109.5° | 109.4° |
| H34 | C36 | H35 | 109.5° | 109.5° |
| H38 | C40 | H39 | 109.5° | 109.5° |
| H40 | C41 | H41 | 109.5° | 109.5° |
| H44 | C44 | H45 | 109.5° | 109.4° |
| H46 | C46 | H47 | 109.5° | 109.5° |
| H46 | C46 | H48 | 109.5° | 109.5° |
| H47 | C46 | H48 | 109.5° | 109.5° |
| H49 | C48 | H50 | 109.5° | 109.5° |
| H49 | C48 | H51 | 109.4° | 109.5° |
| H50 | C48 | H51 | 109.5° | 109.4° |
| H52 | C50 | H53 | 109.5° | 109.4° |
| H52 | C50 | H54 | 109.5° | 109.4° |
| H53 | C50 | H54 | 109.5° | 109.5° |
| H55 | C52 | H56 | 109.5° | 109.5° |
| H55 | C52 | H57 | 109.5° | 109.5° |
| H56 | C52 | H57 | 109.5° | 109.4° |
| H58 | C54 | H59 | 109.5° | 109.5° |
| H58 | C54 | H60 | 109.5° | 109.4° |
| H59 | C54 | H60 | 109.4° | 109.5° |
| H61 | C55 | H62 | 109.5° | 109.5° |
| H61 | C55 | H63 | 109.5° | 109.5° |
| H62 | C55 | H63 | 109.5° | 109.5° |
| H64 | C56 | H65 | 109.4° | 109.5° |
| H64 | C56 | H66 | 109.5° | 109.5° |
| H65 | C56 | H66 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C54 | O53 | C09 | C10 | 70.3° | 130.4° |
| C54 | O53 | C09 | C08 | 163.0° | 111.7° |
| C54 | O53 | C09 | H18 | 45.9° | 12.3° |
| O53 | C54 | H58 | H59 | 120.0° | 120.0° |
| O53 | C54 | H58 | H60 | 120.0° | 120.0° |
| O53 | C54 | H59 | H60 | 120.0° | 120.0° |
| O53 | C09 | C10 | C08 | 124.9° | 118.3° |
| O53 | C09 | C10 | H18 | 117.5° | 118.2° |
| O53 | C09 | C08 | H18 | 118.4° | 121.3° |
| O53 | C09 | C10 | C11 | 80.0° | 65.9° |
| O53 | C09 | C10 | O15 | 161.9° | 54.6° |
| O53 | C09 | C08 | C07 | 65.3° | 90.4° |
| O53 | C09 | C10 | H1 | 44.5° | 174.2° |
| O53 | C09 | C08 | H16 | 55.2° | 148.2° |
| O53 | C09 | C08 | H17 | 174.2° | 32.1° |
| C09 | O53 | C54 | H58 | 180.0° | 54.1° |
| C09 | O53 | C54 | H59 | 60.0° | 65.9° |
| C09 | O53 | C54 | H60 | 60.0° | 174.1° |
| O49 | C14 | O15 | C10 | 66.1° | 64.2° |
| O49 | C14 | O15 | C13 | 123.7° | 119.0° |
| O49 | C14 | O15 | C16 | 114.6° | 119.1° |
| O49 | C14 | C13 | C12 | 73.0° | 125.7° |
| O49 | C14 | C13 | C16 | 123.3° | 119.3° |
| O49 | C14 | C16 | O17 | 30.7° | 137.3° |
| O49 | C14 | C13 | C50 | 50.2° | 3.0° |
| O49 | C14 | C16 | C18 | 150.3° | 45.0° |
| O49 | C14 | C13 | H2 | 168.0° | 114.7° |
| C52 | O51 | C11 | C10 | 159.3° | 150.0° |
| C52 | O51 | C11 | C12 | 80.0° | 87.6° |
| C52 | O51 | C11 | H5 | 40.4° | 31.3° |
| O51 | C52 | H55 | H56 | 120.0° | 120.0° |
| O51 | C52 | H55 | H57 | 120.0° | 120.0° |
| O51 | C52 | H56 | H57 | 120.0° | 120.0° |
| O51 | C11 | C10 | C09 | 66.0° | 99.7° |
| O51 | C11 | C10 | C12 | 120.5° | 121.9° |
| O51 | C11 | C10 | H5 | 119.9° | 118.5° |
| O51 | C11 | C10 | O15 | 179.4° | 139.9° |
| O51 | C11 | C12 | H5 | 121.2° | 118.7° |
| O51 | C11 | C12 | C13 | 172.7° | 83.1° |
| O51 | C11 | C10 | H1 | 58.1° | 19.4° |
| O51 | C11 | C12 | H3 | 66.8° | 37.9° |
| O51 | C11 | C12 | H4 | 52.1° | 155.3° |
| C11 | O51 | C52 | H55 | 180.0° | 180.0° |
| C11 | O51 | C52 | H56 | 60.0° | 60.0° |
| C11 | O51 | C52 | H57 | 60.0° | 60.0° |
| C10 | C09 | C08 | H18 | 117.5° | 120.7° |
| C09 | C10 | C11 | O15 | 114.5° | 120.3° |
| C09 | C10 | C11 | H1 | 124.1° | 119.1° |
| C09 | C10 | O15 | H1 | 116.2° | 118.7° |
| C09 | C10 | C11 | C12 | 173.5° | 138.3° |
| C09 | C10 | O15 | C14 | 175.0° | 169.8° |
| C10 | C09 | C08 | C07 | 170.5° | 151.7° |
| C09 | C10 | C11 | H5 | 53.9° | 18.7° |
| C10 | C09 | C08 | H16 | 68.9° | 30.3° |
| C10 | C09 | C08 | H17 | 50.0° | 85.9° |
| C08 | C09 | C10 | C11 | 44.9° | 175.8° |
| C08 | C09 | C10 | O15 | 73.3° | 63.7° |
| C09 | C08 | C07 | C55 | 38.0° | 46.0° |
| C09 | C08 | C07 | C06 | 87.1° | 78.2° |
| C09 | C08 | C07 | H16 | 120.6° | 121.2° |
| C09 | C08 | C07 | H17 | 120.5° | 122.5° |
| C08 | C09 | C10 | H1 | 169.3° | 56.0° |
| C09 | C08 | C07 | H15 | 156.5° | 164.1° |
| C09 | C08 | H16 | H17 | 118.3° | 117.6° |
| C11 | C10 | O15 | H1 | 120.8° | 120.3° |
| C10 | C11 | C12 | H5 | 119.5° | 119.6° |
| C11 | C10 | O15 | C14 | 62.0° | 69.2° |
| C10 | C11 | C12 | C13 | 53.4° | 38.7° |
| C10 | C11 | C12 | H3 | 174.0° | 159.7° |
| C10 | C11 | C12 | H4 | 67.2° | 82.9° |
| C11 | C10 | C09 | H18 | 162.4° | 52.3° |
| O15 | C10 | C11 | C12 | 59.0° | 18.0° |
| C10 | O15 | C14 | C13 | 57.6° | 54.8° |
| C10 | O15 | C14 | C16 | 179.3° | 176.7° |
| O15 | C10 | C11 | H5 | 60.6° | 101.6° |
| O15 | C10 | C09 | H18 | 44.3° | 172.8° |
| C55 | C07 | C06 | C08 | 126.4° | 125.5° |
| C55 | C07 | C06 | H15 | 117.2° | 116.8° |
| C55 | C07 | C06 | C05 | 161.7° | 113.6° |
| C55 | C07 | C08 | H15 | 118.5° | 118.0° |
| C55 | C07 | C06 | H13 | 41.4° | 126.7° |
| C55 | C07 | C06 | H14 | 78.0° | 5.6° |
| C55 | C07 | C08 | H16 | 158.6° | 75.1° |
| C55 | C07 | C08 | H17 | 82.5° | 168.5° |
| C07 | C55 | H61 | H62 | 120.0° | 119.9° |
| C07 | C55 | H61 | H63 | 120.0° | 120.0° |
| C07 | C55 | H62 | H63 | 120.0° | 120.0° |
| C11 | C12 | C13 | H3 | 120.5° | 121.0° |
| C11 | C12 | C13 | H4 | 120.6° | 121.5° |
| C11 | C12 | C13 | C14 | 48.1° | 52.3° |
| C11 | C12 | C13 | C50 | 171.1° | 70.1° |
| C12 | C11 | C10 | H1 | 62.4° | 102.5° |
| C11 | C12 | C13 | H2 | 70.7° | 171.9° |
| C11 | C12 | H3 | H4 | 118.3° | 118.2° |
| C07 | C06 | C05 | H13 | 120.3° | 120.2° |
| C07 | C06 | C05 | H14 | 120.3° | 120.0° |
| C06 | C07 | C08 | H15 | 116.5° | 117.7° |
| C07 | C06 | C05 | C04 | 95.8° | 110.9° |
| C07 | C06 | C05 | C56 | 84.6° | 69.1° |
| C07 | C06 | H13 | H14 | 119.1° | 121.1° |
| C06 | C07 | C08 | H16 | 33.5° | 160.6° |
| C06 | C07 | C08 | H17 | 152.4° | 44.2° |
| C06 | C07 | C55 | H61 | 180.0° | 60.0° |
| C06 | C07 | C55 | H62 | 60.0° | 180.0° |
| C06 | C07 | C55 | H63 | 60.0° | 60.0° |
| C05 | C06 | C07 | C08 | 71.9° | 120.8° |
| C06 | C05 | C04 | C56 | 179.5° | 180.0° |
| C06 | C05 | C04 | C03 | 179.8° | 179.7° |
| C06 | C05 | C04 | H12 | 0.2° | 0.2° |
| C05 | C06 | H13 | H14 | 119.1° | 119.3° |
| C05 | C06 | C07 | H15 | 44.5° | 3.2° |
| C06 | C05 | C56 | H64 | 180.0° | 174.9° |
| C06 | C05 | C56 | H65 | 60.0° | 54.9° |
| C06 | C05 | C56 | H66 | 60.0° | 65.1° |
| O15 | C14 | C13 | C12 | 49.3° | 6.5° |
| O15 | C14 | C13 | C16 | 114.5° | 121.6° |
| O15 | C14 | C16 | O17 | 84.2° | 103.5° |
| O15 | C14 | C13 | C50 | 172.5° | 116.2° |
| O15 | C14 | C16 | C18 | 94.8° | 74.2° |
| C14 | O15 | C10 | H1 | 58.8° | 51.1° |
| O15 | C14 | C13 | H2 | 69.8° | 126.1° |
| O15 | C14 | O49 | H69 | 97.4° | 60.2° |
| C12 | C13 | C14 | C50 | 123.2° | 122.7° |
| C12 | C13 | C14 | H2 | 119.1° | 119.6° |
| C12 | C13 | C14 | C16 | 163.8° | 115.0° |
| C12 | C13 | C50 | H2 | 118.5° | 118.3° |
| C13 | C12 | H3 | H4 | 118.3° | 118.4° |
| C13 | C12 | C11 | H5 | 66.1° | 158.3° |
| C12 | C13 | C50 | H52 | 180.0° | 176.6° |
| C12 | C13 | C50 | H53 | 60.0° | 56.6° |
| C12 | C13 | C50 | H54 | 60.0° | 63.5° |
| C13 | C14 | C16 | O17 | 155.5° | 18.1° |
| C14 | C13 | C50 | H2 | 117.7° | 118.2° |
| C13 | C14 | C16 | C18 | 25.4° | 164.2° |
| C14 | C13 | C12 | H3 | 168.7° | 173.2° |
| C14 | C13 | C12 | H4 | 72.4° | 69.2° |
| C14 | C13 | C50 | H52 | 56.2° | 60.0° |
| C14 | C13 | C50 | H53 | 176.3° | 180.0° |
| C14 | C13 | C50 | H54 | 63.8° | 60.0° |
| C13 | C14 | O49 | H69 | 138.8° | 180.0° |
| C14 | C16 | O17 | C18 | 179.1° | 177.7° |
| C16 | C14 | C13 | C50 | 73.1° | 122.3° |
| C14 | C16 | C18 | O19 | 87.3° | 13.3° |
| C14 | C16 | C18 | N20 | 93.1° | 163.8° |
| C16 | C14 | C13 | H2 | 44.7° | 4.5° |
| C16 | C14 | O49 | H69 | 12.6° | 59.6° |
| O17 | C16 | C18 | O19 | 93.6° | 164.3° |
| O17 | C16 | C18 | N20 | 85.9° | 18.5° |
| C08 | C07 | C06 | H13 | 167.9° | 1.1° |
| C08 | C07 | C06 | H14 | 48.4° | 119.9° |
| C07 | C08 | H16 | H17 | 118.3° | 117.7° |
| C07 | C08 | C09 | H18 | 53.1° | 31.0° |
| C08 | C07 | C55 | H61 | 55.3° | 175.0° |
| C08 | C07 | C55 | H62 | 64.7° | 55.1° |
| C08 | C07 | C55 | H63 | 175.3° | 64.9° |
| C50 | C13 | C12 | H3 | 68.4° | 50.8° |
| C50 | C13 | C12 | H4 | 50.5° | 168.4° |
| C13 | C50 | H52 | H53 | 120.0° | 120.0° |
| C13 | C50 | H52 | H54 | 120.0° | 120.0° |
| C13 | C50 | H53 | H54 | 120.0° | 120.1° |
| C05 | C04 | C03 | H12 | 180.0° | 179.9° |
| C05 | C04 | C03 | C02 | 142.1° | 77.5° |
| C05 | C04 | C03 | C33 | 95.4° | 163.4° |
| C05 | C04 | C03 | H11 | 22.5° | 43.7° |
| C04 | C05 | C06 | H13 | 143.9° | 9.2° |
| C04 | C05 | C06 | H14 | 24.5° | 129.1° |
| C04 | C05 | C56 | H64 | 0.5° | 5.1° |
| C04 | C05 | C56 | H65 | 120.5° | 125.1° |
| C04 | C05 | C56 | H66 | 119.5° | 114.9° |
| C03 | C04 | C05 | C56 | 0.7° | 0.3° |
| C04 | C03 | C02 | C33 | 119.1° | 120.0° |
| C04 | C03 | C02 | H11 | 119.7° | 121.6° |
| C04 | C03 | C02 | C01 | 175.1° | 173.1° |
| C04 | C03 | C33 | H11 | 117.8° | 120.9° |
| C04 | C03 | C33 | O34 | 81.0° | 124.4° |
| C04 | C03 | C33 | C32 | 97.5° | 54.8° |
| C04 | C03 | C02 | H9 | 64.2° | 66.9° |
| C04 | C03 | C02 | H10 | 54.4° | 53.1° |
| C56 | C05 | C04 | H12 | 179.3° | 179.8° |
| C56 | C05 | C06 | H13 | 35.6° | 170.8° |
| C56 | C05 | C06 | H14 | 155.1° | 50.9° |
| C05 | C56 | H64 | H65 | 120.0° | 120.0° |
| C05 | C56 | H64 | H66 | 120.0° | 120.0° |
| C05 | C56 | H65 | H66 | 120.0° | 120.0° |
| C16 | C18 | O19 | N20 | 179.5° | 177.2° |
| C16 | C18 | N20 | C21 | 0.3° | 18.8° |
| C16 | C18 | N20 | C25 | 177.4° | 160.5° |
| C03 | C02 | C01 | H9 | 120.7° | 120.0° |
| C03 | C02 | C01 | H10 | 120.7° | 120.0° |
| C02 | C03 | C33 | H11 | 121.2° | 119.1° |
| C02 | C03 | C33 | O34 | 40.0° | 4.4° |
| C02 | C03 | C33 | C32 | 141.5° | 174.8° |
| C03 | C02 | C01 | H6 | 180.0° | 174.3° |
| C03 | C02 | C01 | H7 | 60.0° | 65.7° |
| C03 | C02 | C01 | H8 | 60.0° | 54.3° |
| C03 | C02 | H9 | H10 | 117.8° | 120.0° |
| C02 | C03 | C04 | H12 | 37.9° | 102.6° |
| C01 | C02 | C03 | C33 | 56.1° | 67.0° |
| C02 | C01 | H6 | H7 | 120.0° | 120.0° |
| C02 | C01 | H6 | H8 | 120.0° | 120.0° |
| C02 | C01 | H7 | H8 | 120.0° | 120.0° |
| C01 | C02 | H9 | H10 | 117.8° | 120.0° |
| C01 | C02 | C03 | H11 | 65.2° | 51.4° |
| C03 | C33 | O34 | C32 | 178.5° | 179.3° |
| C03 | C33 | C32 | C31 | 161.0° | 158.8° |
| C33 | C03 | C02 | H9 | 176.8° | 53.0° |
| C33 | C03 | C02 | H10 | 64.6° | 173.0° |
| C33 | C03 | C04 | H12 | 84.7° | 16.5° |
| C03 | C33 | C32 | H31 | 40.5° | 81.2° |
| C03 | C33 | C32 | H32 | 78.4° | 37.6° |
| O19 | C18 | N20 | C21 | 179.3° | 158.4° |
| O19 | C18 | N20 | C25 | 2.2° | 22.4° |
| C18 | N20 | C21 | C25 | 177.3° | 179.3° |
| C18 | N20 | C21 | C22 | 131.8° | 126.1° |
| C18 | N20 | C25 | C26 | 107.8° | 1.1° |
| C18 | N20 | C25 | C24 | 129.4° | 123.9° |
| C18 | N20 | C21 | H19 | 11.5° | 7.5° |
| C18 | N20 | C21 | H20 | 108.0° | 114.0° |
| C18 | N20 | C25 | H27 | 10.6° | 119.1° |
| O34 | C33 | C32 | C31 | 17.4° | 20.5° |
| O34 | C33 | C03 | H11 | 161.2° | 114.7° |
| O34 | C33 | C32 | H31 | 138.0° | 99.5° |
| O34 | C33 | C32 | H32 | 103.2° | 141.7° |
| N20 | C21 | C22 | H19 | 120.2° | 119.9° |
| N20 | C21 | C22 | H20 | 120.2° | 119.8° |
| N20 | C21 | C22 | C23 | 45.8° | 53.6° |
| C21 | N20 | C25 | C26 | 74.8° | 179.6° |
| C21 | N20 | C25 | C24 | 47.9° | 56.8° |
| N20 | C21 | H19 | H20 | 119.3° | 121.3° |
| N20 | C21 | C22 | H21 | 75.0° | 173.9° |
| N20 | C21 | C22 | H22 | 166.6° | 66.5° |
| C21 | N20 | C25 | H27 | 166.7° | 60.2° |
| C22 | C21 | N20 | C25 | 45.5° | 54.6° |
| C21 | C22 | C23 | H21 | 120.8° | 120.2° |
| C21 | C22 | C23 | H22 | 120.8° | 120.0° |
| C21 | C22 | C23 | C24 | 50.7° | 60.0° |
| C22 | C21 | H19 | H20 | 119.3° | 120.1° |
| C21 | C22 | H21 | H22 | 117.5° | 119.5° |
| C21 | C22 | C23 | H23 | 171.5° | 59.8° |
| C21 | C22 | C23 | H24 | 70.1° | 179.8° |
| C33 | C32 | C31 | H31 | 120.6° | 119.7° |
| C33 | C32 | C31 | H32 | 120.6° | 120.7° |
| C33 | C32 | C31 | C30 | 70.2° | 141.5° |
| C33 | C32 | C31 | O35 | 169.9° | 93.8° |
| C32 | C33 | C03 | H11 | 20.3° | 66.0° |
| C33 | C32 | C31 | H30 | 50.8° | 22.2° |
| C33 | C32 | H31 | H32 | 118.2° | 119.4° |
| N20 | C25 | C26 | O28 | 4.1° | 103.2° |
| N20 | C25 | C26 | C24 | 123.7° | 121.8° |
| N20 | C25 | C26 | H27 | 118.4° | 120.2° |
| N20 | C25 | C24 | H27 | 118.8° | 117.3° |
| N20 | C25 | C24 | C23 | 49.9° | 57.0° |
| N20 | C25 | C26 | O27 | 176.6° | 76.8° |
| C25 | N20 | C21 | H19 | 165.7° | 173.2° |
| C25 | N20 | C21 | H20 | 74.7° | 65.3° |
| N20 | C25 | C24 | H25 | 170.4° | 177.0° |
| N20 | C25 | C24 | H26 | 70.6° | 62.5° |
| C22 | C23 | C24 | C25 | 52.2° | 61.2° |
| C22 | C23 | C24 | H23 | 120.8° | 120.2° |
| C22 | C23 | C24 | H24 | 120.8° | 120.3° |
| C23 | C22 | C21 | H19 | 166.1° | 173.5° |
| C23 | C22 | C21 | H20 | 74.4° | 66.2° |
| C23 | C22 | H21 | H22 | 117.5° | 119.8° |
| C22 | C23 | H23 | H24 | 117.5° | 120.1° |
| C22 | C23 | C24 | H25 | 172.7° | 178.9° |
| C22 | C23 | C24 | H26 | 68.3° | 58.4° |
| C48 | C37 | C29 | C30 | 64.3° | 63.9° |
| C48 | C37 | C29 | O28 | 55.2° | 53.4° |
| C48 | C37 | C29 | C38 | 179.4° | 179.9° |
| C48 | C37 | C38 | C39 | 0.8° | 6.2° |
| C48 | C37 | C29 | H28 | 175.8° | 175.0° |
| C48 | C37 | C38 | H36 | 179.2° | 173.7° |
| C37 | C48 | H49 | H50 | 120.0° | 120.0° |
| C37 | C48 | H49 | H51 | 120.0° | 120.0° |
| C37 | C48 | H50 | H51 | 120.0° | 119.9° |
| C32 | C31 | C30 | C36 | 63.8° | 76.8° |
| C32 | C31 | C30 | O35 | 117.4° | 123.9° |
| C32 | C31 | C30 | H30 | 120.9° | 118.8° |
| C32 | C31 | C30 | C29 | 173.5° | 45.5° |
| C32 | C31 | O35 | H30 | 117.5° | 116.2° |
| C32 | C31 | C30 | H29 | 56.0° | 165.8° |
| C31 | C32 | H31 | H32 | 118.2° | 120.8° |
| C32 | C31 | O35 | H67 | 180.0° | 54.1° |
| C36 | C30 | C31 | C29 | 122.7° | 122.2° |
| C36 | C30 | C31 | H29 | 119.8° | 117.4° |
| C36 | C30 | C29 | H29 | 118.0° | 116.3° |
| C36 | C30 | C29 | O28 | 59.9° | 51.9° |
| C36 | C30 | C31 | O35 | 53.6° | 159.4° |
| C36 | C30 | C29 | C37 | 179.3° | 170.0° |
| C36 | C30 | C29 | H28 | 60.8° | 68.8° |
| C36 | C30 | C31 | H30 | 175.3° | 42.0° |
| C30 | C36 | H33 | H34 | 120.0° | 120.0° |
| C30 | C36 | H33 | H35 | 120.0° | 120.0° |
| C30 | C36 | H34 | H35 | 120.0° | 120.0° |
| C31 | C30 | C29 | H29 | 117.6° | 120.8° |
| C31 | C30 | C29 | O28 | 175.7° | 174.7° |
| C30 | C31 | O35 | H30 | 120.4° | 118.0° |
| C31 | C30 | C29 | C37 | 56.3° | 67.1° |
| C31 | C30 | C29 | H28 | 63.6° | 54.1° |
| C30 | C31 | C32 | H31 | 50.3° | 98.9° |
| C30 | C31 | C32 | H32 | 169.2° | 20.8° |
| C31 | C30 | C36 | H33 | 180.0° | 60.0° |
| C31 | C30 | C36 | H34 | 60.0° | 180.0° |
| C31 | C30 | C36 | H35 | 60.0° | 60.0° |
| C30 | C31 | O35 | H67 | 57.9° | 179.9° |
| C30 | C29 | O28 | C37 | 121.1° | 118.2° |
| C30 | C29 | O28 | H28 | 119.6° | 120.4° |
| C30 | C29 | O28 | C26 | 146.6° | 179.4° |
| C29 | C30 | C31 | O35 | 69.1° | 78.4° |
| C30 | C29 | C37 | H28 | 119.9° | 121.1° |
| C30 | C29 | C37 | C38 | 115.1° | 116.2° |
| C29 | C30 | C31 | H30 | 52.6° | 164.3° |
| C29 | C30 | C36 | H33 | 57.3° | 65.2° |
| C29 | C30 | C36 | H34 | 177.3° | 54.8° |
| C29 | C30 | C36 | H35 | 62.7° | 174.8° |
| C29 | O28 | C26 | C25 | 175.9° | 168.6° |
| O28 | C29 | C37 | H28 | 120.5° | 121.7° |
| O28 | C29 | C37 | C38 | 125.4° | 126.5° |
| C29 | O28 | C26 | O27 | 3.3° | 11.4° |
| O28 | C29 | C30 | H29 | 58.1° | 64.5° |
| O28 | C26 | C25 | O27 | 179.3° | 180.0° |
| O28 | C26 | C25 | C24 | 119.6° | 135.0° |
| C26 | O28 | C29 | C37 | 92.3° | 61.3° |
| O28 | C26 | C25 | H27 | 122.5° | 17.1° |
| C26 | O28 | C29 | H28 | 27.1° | 60.2° |
| C26 | C25 | C24 | H27 | 117.9° | 118.3° |
| C26 | C25 | C24 | C23 | 73.3° | 178.6° |
| C26 | C25 | C24 | H25 | 47.2° | 58.6° |
| C26 | C25 | C24 | H26 | 166.2° | 61.9° |
| C25 | C24 | C23 | H25 | 120.5° | 119.8° |
| C25 | C24 | C23 | H26 | 120.5° | 119.6° |
| C24 | C25 | C26 | O27 | 59.7° | 45.0° |
| C25 | C24 | C23 | H23 | 173.0° | 59.0° |
| C25 | C24 | C23 | H24 | 68.7° | 178.5° |
| C25 | C24 | H25 | H26 | 118.4° | 120.5° |
| C24 | C23 | C22 | H21 | 70.1° | 179.8° |
| C24 | C23 | C22 | H22 | 171.5° | 59.9° |
| C24 | C23 | H23 | H24 | 117.5° | 119.5° |
| C23 | C24 | H25 | H26 | 118.4° | 120.5° |
| C23 | C24 | C25 | H27 | 168.7° | 60.4° |
| O35 | C31 | C30 | H29 | 173.4° | 42.0° |
| O35 | C31 | C32 | H31 | 69.6° | 25.9° |
| O35 | C31 | C32 | H32 | 49.2° | 145.5° |
| C29 | C37 | C38 | C39 | 179.8° | 173.7° |
| C37 | C29 | C30 | H29 | 61.3° | 53.7° |
| C29 | C37 | C38 | H36 | 0.2° | 6.4° |
| C29 | C37 | C48 | H49 | 180.0° | 95.3° |
| C29 | C37 | C48 | H50 | 60.0° | 144.6° |
| C29 | C37 | C48 | H51 | 60.0° | 24.7° |
| C37 | C38 | C39 | H36 | 180.0° | 179.9° |
| C37 | C38 | C39 | C40 | 102.5° | 114.2° |
| C37 | C38 | C39 | C44 | 134.6° | 125.8° |
| C38 | C37 | C29 | H28 | 4.9° | 4.9° |
| C37 | C38 | C39 | H37 | 16.2° | 5.8° |
| C38 | C37 | C48 | H49 | 0.7° | 84.6° |
| C38 | C37 | C48 | H50 | 119.3° | 35.5° |
| C38 | C37 | C48 | H51 | 120.7° | 155.4° |
| O27 | C26 | C25 | H27 | 58.2° | 163.0° |
| C38 | C39 | C40 | C44 | 119.9° | 120.0° |
| C38 | C39 | C40 | H37 | 118.4° | 120.0° |
| C38 | C39 | C44 | H37 | 118.1° | 120.0° |
| C38 | C39 | C40 | C41 | 171.8° | 180.0° |
| C38 | C39 | C44 | C43 | 174.6° | 180.0° |
| C38 | C39 | C40 | H38 | 51.5° | 60.0° |
| C38 | C39 | C40 | H39 | 68.0° | 60.0° |
| C38 | C39 | C44 | H44 | 65.1° | 60.0° |
| C38 | C39 | C44 | H45 | 54.4° | 60.0° |
| C40 | C39 | C44 | H37 | 121.7° | 120.0° |
| C39 | C40 | C41 | H38 | 120.3° | 120.0° |
| C39 | C40 | C41 | H39 | 120.2° | 120.0° |
| C39 | C40 | C41 | C42 | 50.3° | 60.0° |
| C40 | C39 | C44 | C43 | 54.4° | 60.0° |
| C40 | C39 | C38 | H36 | 77.5° | 65.7° |
| C39 | C40 | H38 | H39 | 119.2° | 120.0° |
| C39 | C40 | C41 | H40 | 170.9° | 180.0° |
| C39 | C40 | C41 | H41 | 70.3° | 59.9° |
| C40 | C39 | C44 | H44 | 174.7° | 180.0° |
| C40 | C39 | C44 | H45 | 65.8° | 60.0° |
| C44 | C39 | C40 | C41 | 51.9° | 60.0° |
| C39 | C44 | C43 | H44 | 120.3° | 120.0° |
| C39 | C44 | C43 | H45 | 120.3° | 120.0° |
| C39 | C44 | C43 | C42 | 54.5° | 60.0° |
| C39 | C44 | C43 | O45 | 176.5° | 180.0° |
| C44 | C39 | C38 | H36 | 45.4° | 54.3° |
| C44 | C39 | C40 | H38 | 68.4° | 60.0° |
| C44 | C39 | C40 | H39 | 172.1° | 180.0° |
| C39 | C44 | C43 | H43 | 63.7° | 60.0° |
| C39 | C44 | H44 | H45 | 119.2° | 120.0° |
| C40 | C41 | C42 | H40 | 120.6° | 120.0° |
| C40 | C41 | C42 | H41 | 120.6° | 119.9° |
| C40 | C41 | C42 | C43 | 51.7° | 60.0° |
| C40 | C41 | C42 | O47 | 171.1° | 180.0° |
| C41 | C40 | C39 | H37 | 69.8° | 60.0° |
| C41 | C40 | H38 | H39 | 119.2° | 120.0° |
| C40 | C41 | H40 | H41 | 118.1° | 120.0° |
| C40 | C41 | C42 | H42 | 68.7° | 60.0° |
| C41 | C42 | C43 | C44 | 53.3° | 60.0° |
| C41 | C42 | C43 | O47 | 119.9° | 120.0° |
| C41 | C42 | C43 | H42 | 120.3° | 120.0° |
| C41 | C42 | C43 | O45 | 176.2° | 180.0° |
| C41 | C42 | O47 | H42 | 119.1° | 120.0° |
| C42 | C41 | C40 | H38 | 70.0° | 60.0° |
| C42 | C41 | C40 | H39 | 170.5° | 180.0° |
| C42 | C41 | H40 | H41 | 118.1° | 120.0° |
| C41 | C42 | C43 | H43 | 64.9° | 60.0° |
| C41 | C42 | O47 | H68 | 180.0° | 60.0° |
| C44 | C43 | C42 | O45 | 122.9° | 120.1° |
| C44 | C43 | C42 | H43 | 118.2° | 120.0° |
| C44 | C43 | O45 | H43 | 118.7° | 120.0° |
| C44 | C43 | C42 | O47 | 173.2° | 180.0° |
| C44 | C43 | O45 | C46 | 87.8° | 150.0° |
| C43 | C44 | C39 | H37 | 67.2° | 60.0° |
| C44 | C43 | C42 | H42 | 67.0° | 60.0° |
| C43 | C44 | H44 | H45 | 119.2° | 120.0° |
| C42 | C43 | O45 | H43 | 117.9° | 120.0° |
| C43 | C42 | O47 | H42 | 118.7° | 120.0° |
| C42 | C43 | O45 | C46 | 148.8° | 90.0° |
| C43 | C42 | C41 | H40 | 172.3° | 180.0° |
| C43 | C42 | C41 | H41 | 68.9° | 60.0° |
| C42 | C43 | C44 | H44 | 174.8° | 180.0° |
| C42 | C43 | C44 | H45 | 65.7° | 60.0° |
| C43 | C42 | O47 | H68 | 57.8° | 180.0° |
| O45 | C43 | C42 | O47 | 63.9° | 60.0° |
| O45 | C43 | C42 | H42 | 55.9° | 60.1° |
| O45 | C43 | C44 | H44 | 63.2° | 60.0° |
| O45 | C43 | C44 | H45 | 56.2° | 60.0° |
| C43 | O45 | C46 | H46 | 180.0° | 180.0° |
| C43 | O45 | C46 | H47 | 60.0° | 60.0° |
| C43 | O45 | C46 | H48 | 60.0° | 60.0° |
| O47 | C42 | C41 | H40 | 68.3° | 60.0° |
| O47 | C42 | C41 | H41 | 50.5° | 60.1° |
| O47 | C42 | C43 | H43 | 55.1° | 60.0° |
| C46 | O45 | C43 | H43 | 30.9° | 30.0° |
| O45 | C46 | H46 | H47 | 120.0° | 120.0° |
| O45 | C46 | H46 | H48 | 120.0° | 120.0° |
| O45 | C46 | H47 | H48 | 120.0° | 120.0° |
| H1 | C10 | C11 | H5 | 178.0° | 137.9° |
| H1 | C10 | C09 | H18 | 73.1° | 67.6° |
| H2 | C13 | C12 | H3 | 49.9° | 67.1° |
| H2 | C13 | C12 | H4 | 168.8° | 50.5° |
| H2 | C13 | C50 | H52 | 61.5° | 58.2° |
| H2 | C13 | C50 | H53 | 58.5° | 61.7° |
| H2 | C13 | C50 | H54 | 178.5° | 178.2° |
| H3 | C12 | C11 | H5 | 54.4° | 80.7° |
| H4 | C12 | C11 | H5 | 173.3° | 36.7° |
| H6 | C01 | H7 | H8 | 120.0° | 120.0° |
| H6 | C01 | C02 | H9 | 59.3° | 65.6° |
| H6 | C01 | C02 | H10 | 59.3° | 54.3° |
| H7 | C01 | C02 | H9 | 179.3° | 54.3° |
| H7 | C01 | C02 | H10 | 60.7° | 174.2° |
| H8 | C01 | C02 | H9 | 60.7° | 174.3° |
| H8 | C01 | C02 | H10 | 179.3° | 65.7° |
| H9 | C02 | C03 | H11 | 55.5° | 171.5° |
| H10 | C02 | C03 | H11 | 174.1° | 68.6° |
| H11 | C03 | C04 | H12 | 157.5° | 136.2° |
| H13 | C06 | C07 | H15 | 75.8° | 116.5° |
| H14 | C06 | C07 | H15 | 164.8° | 122.4° |
| H15 | C07 | C08 | H16 | 83.0° | 42.9° |
| H15 | C07 | C08 | H17 | 36.0° | 73.5° |
| H15 | C07 | C55 | H61 | 62.9° | 56.9° |
| H15 | C07 | C55 | H62 | 177.1° | 63.1° |
| H15 | C07 | C55 | H63 | 57.1° | 176.9° |
| H16 | C08 | C09 | H18 | 173.6° | 90.5° |
| H17 | C08 | C09 | H18 | 67.4° | 153.4° |
| H19 | C21 | C22 | H21 | 45.3° | 66.3° |
| H19 | C21 | C22 | H22 | 73.2° | 53.4° |
| H20 | C21 | C22 | H21 | 164.8° | 54.1° |
| H20 | C21 | C22 | H22 | 46.4° | 173.7° |
| H21 | C22 | C23 | H23 | 50.8° | 60.4° |
| H21 | C22 | C23 | H24 | 169.1° | 59.6° |
| H22 | C22 | C23 | H23 | 67.7° | 179.8° |
| H22 | C22 | C23 | H24 | 50.6° | 60.2° |
| H23 | C23 | C24 | H25 | 66.5° | 60.9° |
| H23 | C23 | C24 | H26 | 52.5° | 178.6° |
| H24 | C23 | C24 | H25 | 51.8° | 58.7° |
| H24 | C23 | C24 | H26 | 170.8° | 61.9° |
| H25 | C24 | C25 | H27 | 70.8° | 59.7° |
| H26 | C24 | C25 | H27 | 48.2° | 179.9° |
| H28 | C29 | C30 | H29 | 178.8° | 174.9° |
| H29 | C30 | C31 | H30 | 64.9° | 75.4° |
| H29 | C30 | C36 | H33 | 60.4° | 178.2° |
| H29 | C30 | C36 | H34 | 59.6° | 61.8° |
| H29 | C30 | C36 | H35 | 179.6° | 58.2° |
| H30 | C31 | C32 | H31 | 171.4° | 141.9° |
| H30 | C31 | C32 | H32 | 69.8° | 98.5° |
| H30 | C31 | O35 | H67 | 62.5° | 62.0° |
| H33 | C36 | H34 | H35 | 120.0° | 119.9° |
| H36 | C38 | C39 | H37 | 163.8° | 174.3° |
| H37 | C39 | C40 | H38 | 169.9° | 180.0° |
| H37 | C39 | C40 | H39 | 50.4° | 60.0° |
| H37 | C39 | C44 | H44 | 53.0° | 60.0° |
| H37 | C39 | C44 | H45 | 172.5° | 180.0° |
| H38 | C40 | C41 | H40 | 50.6° | 60.0° |
| H38 | C40 | C41 | H41 | 169.4° | 180.0° |
| H39 | C40 | C41 | H40 | 68.9° | 60.0° |
| H39 | C40 | C41 | H41 | 49.9° | 60.0° |
| H40 | C41 | C42 | H42 | 51.9° | 60.0° |
| H41 | C41 | C42 | H42 | 170.7° | 179.9° |
| H42 | C42 | C43 | H43 | 174.8° | 180.0° |
| H42 | C42 | O47 | H68 | 60.9° | 60.0° |
| H43 | C43 | C44 | H44 | 56.6° | 60.0° |
| H43 | C43 | C44 | H45 | 176.0° | 180.0° |
| H46 | C46 | H47 | H48 | 120.0° | 120.0° |
| H49 | C48 | H50 | H51 | 120.0° | 120.0° |
| H52 | C50 | H53 | H54 | 120.0° | 120.0° |
| H55 | C52 | H56 | H57 | 120.0° | 120.1° |
| H58 | C54 | H59 | H60 | 120.0° | 120.0° |
| H61 | C55 | H62 | H63 | 120.0° | 120.1° |
| H64 | C56 | H65 | H66 | 120.0° | 120.0° |
