Obsolete: QKH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O63 | C63 | sing | 1.43Å | 1.43Å | |
| C63 | C53 | sing | 1.52Å | 1.52Å | |
| O53 | C53 | sing | 1.44Å | 1.44Å | |
| O53 | C13 | sing | 1.43Å | 1.43Å | |
| O54 | C14 | sing | 1.42Å | 1.42Å | |
| O54 | C54 | sing | 1.43Å | 1.43Å | |
| O64 | C64 | sing | 1.43Å | 1.43Å | |
| C53 | C43 | sing | 1.53Å | 1.53Å | |
| C14 | O43 | sing | 1.41Å | 1.41Å | |
| C14 | C24 | sing | 1.53Å | 1.53Å | |
| C43 | O43 | sing | 1.44Å | 1.44Å | |
| C43 | C33 | sing | 1.52Å | 1.52Å | |
| C13 | C23 | sing | 1.52Å | 1.52Å | |
| C13 | O42 | sing | 1.42Å | 1.42Å | |
| O62 | C62 | sing | 1.43Å | 1.43Å | |
| C23 | C33 | sing | 1.53Å | 1.53Å | |
| C23 | O23 | sing | 1.43Å | 1.43Å | |
| C80 | O24 | sing | 1.42Å | 1.42Å | |
| C64 | C54 | sing | 1.52Å | 1.52Å | |
| C62 | C52 | sing | 1.52Å | 1.52Å | |
| C24 | O24 | sing | 1.42Å | 1.42Å | |
| C24 | C34 | sing | 1.52Å | 1.52Å | |
| C54 | C44 | sing | 1.53Å | 1.53Å | |
| C33 | O33 | sing | 1.43Å | 1.43Å | |
| O42 | C42 | sing | 1.43Å | 1.43Å | |
| C44 | C34 | sing | 1.51Å | 1.51Å | |
| C44 | O44 | sing | 1.43Å | 1.43Å | |
| C42 | C52 | sing | 1.53Å | 1.53Å | |
| C42 | C32 | sing | 1.52Å | 1.52Å | |
| C52 | O52 | sing | 1.43Å | 1.43Å | |
| C34 | O34 | sing | 1.43Å | 1.43Å | |
| O52 | C12 | sing | 1.42Å | 1.42Å | |
| O55 | C15 | sing | 1.42Å | 1.42Å | |
| O55 | C55 | sing | 1.43Å | 1.43Å | |
| C78 | O65 | sing | 1.43Å | 1.43Å | |
| O44 | C15 | sing | 1.41Å | 1.41Å | |
| C15 | C25 | sing | 1.54Å | 1.54Å | |
| O32 | C32 | sing | 1.43Å | 1.43Å | |
| C32 | C22 | sing | 1.52Å | 1.52Å | |
| C65 | O65 | sing | 1.44Å | 1.44Å | |
| C65 | C55 | sing | 1.53Å | 1.53Å | |
| C55 | C45 | sing | 1.54Å | 1.54Å | |
| C22 | C12 | sing | 1.52Å | 1.52Å | |
| C22 | O22 | sing | 1.43Å | 1.43Å | |
| C12 | O41 | sing | 1.43Å | 1.43Å | |
| O61 | C61 | sing | 1.43Å | 1.43Å | |
| C61 | C51 | sing | 1.53Å | 1.53Å | |
| C25 | O25 | sing | 1.42Å | 1.42Å | |
| C25 | C35 | sing | 1.53Å | 1.53Å | |
| O25 | C79 | sing | 1.42Å | 1.42Å | |
| O41 | C41 | sing | 1.42Å | 1.42Å | |
| C45 | C35 | sing | 1.53Å | 1.53Å | |
| C45 | O45 | sing | 1.41Å | 1.41Å | |
| C51 | C41 | sing | 1.52Å | 1.52Å | |
| C51 | O51 | sing | 1.43Å | 1.43Å | |
| C35 | O35 | sing | 1.44Å | 1.44Å | |
| C41 | C31 | sing | 1.53Å | 1.53Å | |
| O45 | C16 | sing | 1.42Å | 1.42Å | |
| C66 | C56 | sing | 1.53Å | 1.53Å | |
| C66 | O66 | sing | 1.44Å | 1.44Å | |
| O56 | C56 | sing | 1.43Å | 1.43Å | |
| O56 | C16 | sing | 1.42Å | 1.42Å | |
| O51 | C11 | sing | 1.43Å | 1.43Å | |
| C56 | C46 | sing | 1.53Å | 1.53Å | |
| C16 | C26 | sing | 1.53Å | 1.53Å | |
| C31 | O31 | sing | 1.43Å | 1.43Å | |
| C31 | C21 | sing | 1.53Å | 1.53Å | |
| C67 | C57 | sing | 1.52Å | 1.52Å | |
| C67 | O67 | sing | 1.44Å | 1.44Å | |
| O31 | C84 | sing | 1.42Å | 1.42Å | |
| O47 | C11 | sing | 1.44Å | 1.44Å | |
| O47 | C47 | sing | 1.42Å | 1.42Å | |
| C11 | C21 | sing | 1.53Å | 1.53Å | |
| C57 | C47 | sing | 1.54Å | 1.54Å | |
| C57 | O57 | sing | 1.42Å | 1.42Å | |
| C21 | O21 | sing | 1.43Å | 1.43Å | |
| C46 | O46 | sing | 1.41Å | 1.41Å | |
| C46 | C36 | sing | 1.53Å | 1.53Å | |
| O46 | C17 | sing | 1.43Å | 1.43Å | |
| C26 | O26 | sing | 1.42Å | 1.42Å | |
| C26 | C36 | sing | 1.52Å | 1.52Å | |
| C47 | C37 | sing | 1.52Å | 1.52Å | |
| O26 | C83 | sing | 1.43Å | 1.43Å | |
| C36 | O36 | sing | 1.44Å | 1.44Å | |
| O57 | C17 | sing | 1.43Å | 1.43Å | |
| C37 | O37 | sing | 1.43Å | 1.43Å | |
| C37 | C27 | sing | 1.52Å | 1.52Å | |
| C17 | C27 | sing | 1.53Å | 1.53Å | |
| C81 | O37 | sing | 1.42Å | 1.42Å | |
| C27 | O27 | sing | 1.42Å | 1.42Å | |
| O27 | C82 | sing | 1.43Å | 1.43Å | |
| O67 | HO67 | sing | 0.95Å | 0.95Å | |
| C67 | H671 | sing | 1.10Å | 1.10Å | |
| C67 | H672 | sing | 1.10Å | 1.10Å | |
| C57 | H57 | sing | 1.10Å | 1.10Å | |
| C47 | H47 | sing | 1.10Å | 1.10Å | |
| C17 | H17 | sing | 1.10Å | 1.10Å | |
| C27 | H27 | sing | 1.10Å | 1.10Å | |
| C37 | H37 | sing | 1.10Å | 1.10Å | |
| C81 | H811 | sing | 1.10Å | 1.10Å | |
| C81 | H812 | sing | 1.10Å | 1.10Å | |
| C81 | H813 | sing | 1.10Å | 1.10Å | |
| C82 | H821 | sing | 1.10Å | 1.10Å | |
| C82 | H822 | sing | 1.10Å | 1.10Å | |
| C82 | H823 | sing | 1.10Å | 1.10Å | |
| C46 | H46 | sing | 1.10Å | 1.10Å | |
| C36 | H36 | sing | 1.10Å | 1.10Å | |
| O36 | HO36 | sing | 0.95Å | 0.95Å | |
| C26 | H26 | sing | 1.10Å | 1.10Å | |
| C83 | H831 | sing | 1.10Å | 1.10Å | |
| C83 | H832 | sing | 1.10Å | 1.10Å | |
| C83 | H833 | sing | 1.10Å | 1.10Å | |
| C56 | H56 | sing | 1.10Å | 1.10Å | |
| C66 | H661 | sing | 1.10Å | 1.10Å | |
| C66 | H662 | sing | 1.10Å | 1.10Å | |
| O66 | HO66 | sing | 0.95Å | 0.95Å | |
| C16 | H16 | sing | 1.10Å | 1.10Å | |
| C45 | H45 | sing | 1.10Å | 1.10Å | |
| C35 | H35 | sing | 1.10Å | 1.10Å | |
| O35 | HO35 | sing | 0.95Å | 0.95Å | |
| C25 | H25 | sing | 1.10Å | 1.10Å | |
| C79 | H791 | sing | 1.10Å | 1.10Å | |
| C79 | H792 | sing | 1.10Å | 1.10Å | |
| C79 | H793 | sing | 1.10Å | 1.10Å | |
| C55 | H55 | sing | 1.10Å | 1.10Å | |
| C65 | H651 | sing | 1.10Å | 1.10Å | |
| C65 | H652 | sing | 1.10Å | 1.10Å | |
| C78 | H781 | sing | 1.10Å | 1.10Å | |
| C78 | H782 | sing | 1.10Å | 1.10Å | |
| C78 | H783 | sing | 1.10Å | 1.10Å | |
| C15 | H15 | sing | 1.10Å | 1.10Å | |
| C44 | H44 | sing | 1.10Å | 1.10Å | |
| C34 | H34 | sing | 1.10Å | 1.10Å | |
| O34 | HO34 | sing | 0.95Å | 0.95Å | |
| C24 | H24 | sing | 1.10Å | 1.10Å | |
| C80 | H801 | sing | 1.10Å | 1.10Å | |
| C80 | H802 | sing | 1.10Å | 1.10Å | |
| C80 | H803 | sing | 1.10Å | 1.10Å | |
| C54 | H54 | sing | 1.10Å | 1.10Å | |
| C64 | H641 | sing | 1.10Å | 1.10Å | |
| C64 | H642 | sing | 1.10Å | 1.10Å | |
| O64 | HO64 | sing | 0.95Å | 0.95Å | |
| C14 | H14 | sing | 1.10Å | 1.10Å | |
| C43 | H43 | sing | 1.10Å | 1.10Å | |
| C33 | H33 | sing | 1.10Å | 1.10Å | |
| O33 | HO33 | sing | 0.95Å | 0.95Å | |
| C23 | H23 | sing | 1.10Å | 1.10Å | |
| O23 | HO23 | sing | 0.95Å | 0.95Å | |
| C53 | H53 | sing | 1.10Å | 1.10Å | |
| C63 | H631 | sing | 1.10Å | 1.10Å | |
| C63 | H632 | sing | 1.10Å | 1.10Å | |
| O63 | HO63 | sing | 0.95Å | 0.95Å | |
| C13 | H13 | sing | 1.10Å | 1.10Å | |
| C42 | H42 | sing | 1.10Å | 1.10Å | |
| C32 | H32 | sing | 1.10Å | 1.10Å | |
| O32 | HO32 | sing | 0.95Å | 0.95Å | |
| C22 | H22 | sing | 1.10Å | 1.10Å | |
| O22 | HO22 | sing | 0.95Å | 0.95Å | |
| C52 | H52 | sing | 1.10Å | 1.10Å | |
| C62 | H621 | sing | 1.10Å | 1.10Å | |
| C62 | H622 | sing | 1.10Å | 1.10Å | |
| O62 | HO62 | sing | 0.95Å | 0.95Å | |
| C12 | H12 | sing | 1.10Å | 1.10Å | |
| C41 | H41 | sing | 1.10Å | 1.10Å | |
| C51 | H51 | sing | 1.10Å | 1.10Å | |
| C61 | H611 | sing | 1.10Å | 1.10Å | |
| C61 | H612 | sing | 1.10Å | 1.10Å | |
| O61 | HO61 | sing | 0.95Å | 0.95Å | |
| C11 | H11 | sing | 1.10Å | 1.10Å | |
| C31 | H31 | sing | 1.10Å | 1.10Å | |
| C84 | H841 | sing | 1.10Å | 1.10Å | |
| C84 | H842 | sing | 1.10Å | 1.10Å | |
| C84 | H843 | sing | 1.10Å | 1.10Å | |
| C21 | H21 | sing | 1.10Å | 1.10Å | |
| O21 | HO21 | sing | 0.95Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O63 | C63 | C53 | 110.6° | 110.6° |
| O63 | C63 | H631 | 109.1° | 109.1° |
| O63 | C63 | H632 | 108.8° | 108.8° |
| C63 | O63 | HO63 | 109.5° | 109.5° |
| C63 | C53 | O53 | 107.6° | 107.6° |
| C63 | C53 | C43 | 113.9° | 113.9° |
| C63 | C53 | H53 | 108.3° | 108.3° |
| C53 | C63 | H631 | 109.1° | 109.1° |
| C53 | C63 | H632 | 108.8° | 108.8° |
| C53 | O53 | C13 | 115.3° | 115.3° |
| O53 | C53 | C43 | 110.9° | 110.9° |
| O53 | C53 | H53 | 111.4° | 111.4° |
| O53 | C13 | C23 | 107.9° | 107.9° |
| O53 | C13 | O42 | 108.9° | 108.9° |
| O53 | C13 | H13 | 111.0° | 111.0° |
| C14 | O54 | C54 | 114.2° | 114.2° |
| O54 | C14 | O43 | 105.6° | 105.6° |
| O54 | C14 | C24 | 109.5° | 109.5° |
| O54 | C14 | H14 | 112.5° | 112.6° |
| O54 | C54 | C64 | 109.1° | 109.1° |
| O54 | C54 | C44 | 109.9° | 109.9° |
| O54 | C54 | H54 | 109.8° | 109.8° |
| O64 | C64 | C54 | 109.7° | 109.7° |
| O64 | C64 | H641 | 109.4° | 109.4° |
| O64 | C64 | H642 | 109.4° | 109.4° |
| C64 | O64 | HO64 | 109.5° | 109.5° |
| C53 | C43 | O43 | 113.1° | 113.1° |
| C53 | C43 | C33 | 109.4° | 109.4° |
| C53 | C43 | H43 | 106.2° | 106.2° |
| C43 | C53 | H53 | 104.8° | 104.8° |
| O43 | C14 | C24 | 111.0° | 111.0° |
| C14 | O43 | C43 | 115.0° | 115.0° |
| O43 | C14 | H14 | 111.0° | 111.0° |
| C14 | C24 | O24 | 110.1° | 110.1° |
| C14 | C24 | C34 | 110.7° | 110.7° |
| C14 | C24 | H24 | 107.9° | 107.9° |
| C24 | C14 | H14 | 107.2° | 107.3° |
| O43 | C43 | C33 | 107.0° | 107.0° |
| O43 | C43 | H43 | 108.7° | 108.7° |
| C43 | C33 | C23 | 111.9° | 111.9° |
| C43 | C33 | O33 | 108.5° | 108.5° |
| C33 | C43 | H43 | 112.5° | 112.5° |
| C43 | C33 | H33 | 108.7° | 108.7° |
| C23 | C13 | O42 | 109.8° | 109.8° |
| C13 | C23 | C33 | 110.7° | 110.7° |
| C13 | C23 | O23 | 109.4° | 109.4° |
| C13 | C23 | H23 | 108.7° | 108.7° |
| C23 | C13 | H13 | 110.1° | 110.1° |
| C13 | O42 | C42 | 116.5° | 116.5° |
| O42 | C13 | H13 | 109.1° | 109.1° |
| O62 | C62 | C52 | 108.7° | 108.7° |
| O62 | C62 | H621 | 109.8° | 109.8° |
| O62 | C62 | H622 | 109.9° | 109.9° |
| C62 | O62 | HO62 | 109.5° | 109.5° |
| C33 | C23 | O23 | 109.5° | 109.5° |
| C23 | C33 | O33 | 110.2° | 110.2° |
| C23 | C33 | H33 | 106.9° | 106.9° |
| C33 | C23 | H23 | 108.6° | 108.6° |
| O23 | C23 | H23 | 110.0° | 110.0° |
| C23 | O23 | HO23 | 109.5° | 109.5° |
| C80 | O24 | C24 | 112.2° | 112.2° |
| O24 | C80 | H801 | 109.5° | 109.5° |
| O24 | C80 | H802 | 109.4° | 109.4° |
| O24 | C80 | H803 | 109.5° | 109.5° |
| C64 | C54 | C44 | 110.6° | 110.6° |
| C64 | C54 | H54 | 109.1° | 109.1° |
| C54 | C64 | H641 | 109.4° | 109.4° |
| C54 | C64 | H642 | 109.3° | 109.3° |
| C62 | C52 | C42 | 110.2° | 110.2° |
| C62 | C52 | O52 | 107.4° | 107.4° |
| C62 | C52 | H52 | 111.4° | 111.4° |
| C52 | C62 | H621 | 109.7° | 109.7° |
| C52 | C62 | H622 | 109.9° | 109.9° |
| O24 | C24 | C34 | 108.5° | 108.5° |
| O24 | C24 | H24 | 110.1° | 110.1° |
| C24 | C34 | C44 | 109.2° | 109.2° |
| C24 | C34 | O34 | 110.5° | 110.5° |
| C24 | C34 | H34 | 109.3° | 109.3° |
| C34 | C24 | H24 | 109.6° | 109.6° |
| C54 | C44 | C34 | 109.9° | 109.9° |
| C54 | C44 | O44 | 111.7° | 111.7° |
| C54 | C44 | H44 | 107.3° | 107.3° |
| C44 | C54 | H54 | 108.3° | 108.3° |
| O33 | C33 | H33 | 110.5° | 110.5° |
| C33 | O33 | HO33 | 109.5° | 109.5° |
| O42 | C42 | C52 | 109.6° | 109.6° |
| O42 | C42 | C32 | 107.6° | 107.6° |
| O42 | C42 | H42 | 111.3° | 111.3° |
| C34 | C44 | O44 | 108.1° | 108.1° |
| C44 | C34 | O34 | 110.4° | 110.4° |
| C34 | C44 | H44 | 110.9° | 110.9° |
| C44 | C34 | H34 | 109.4° | 109.4° |
| C44 | O44 | C15 | 114.9° | 114.9° |
| O44 | C44 | H44 | 109.0° | 109.0° |
| C52 | C42 | C32 | 111.4° | 111.4° |
| C42 | C52 | O52 | 112.3° | 112.3° |
| C52 | C42 | H42 | 107.4° | 107.4° |
| C42 | C52 | H52 | 106.4° | 106.4° |
| C42 | C32 | O32 | 110.2° | 110.2° |
| C42 | C32 | C22 | 111.5° | 111.5° |
| C32 | C42 | H42 | 109.5° | 109.5° |
| C42 | C32 | H32 | 107.8° | 107.8° |
| C52 | O52 | C12 | 114.8° | 114.8° |
| O52 | C52 | H52 | 109.2° | 109.2° |
| O34 | C34 | H34 | 108.1° | 108.1° |
| C34 | O34 | HO34 | 109.5° | 109.5° |
| O52 | C12 | C22 | 108.1° | 108.1° |
| O52 | C12 | O41 | 108.4° | 108.4° |
| O52 | C12 | H12 | 111.2° | 111.2° |
| C15 | O55 | C55 | 114.0° | 114.0° |
| O55 | C15 | O44 | 107.0° | 107.0° |
| O55 | C15 | C25 | 111.2° | 111.2° |
| O55 | C15 | H15 | 109.7° | 109.7° |
| O55 | C55 | C65 | 108.5° | 108.5° |
| O55 | C55 | C45 | 109.7° | 109.7° |
| O55 | C55 | H55 | 111.0° | 111.0° |
| C78 | O65 | C65 | 114.5° | 114.5° |
| O65 | C78 | H781 | 109.5° | 109.5° |
| O65 | C78 | H782 | 109.4° | 109.4° |
| O65 | C78 | H783 | 109.5° | 109.5° |
| O44 | C15 | C25 | 108.7° | 108.7° |
| O44 | C15 | H15 | 112.2° | 112.2° |
| C15 | C25 | O25 | 107.6° | 107.6° |
| C15 | C25 | C35 | 110.4° | 110.4° |
| C15 | C25 | H25 | 110.1° | 110.1° |
| C25 | C15 | H15 | 108.1° | 108.1° |
| O32 | C32 | C22 | 110.1° | 110.1° |
| O32 | C32 | H32 | 109.2° | 109.2° |
| C32 | O32 | HO32 | 109.5° | 109.5° |
| C32 | C22 | C12 | 109.3° | 109.3° |
| C32 | C22 | O22 | 108.6° | 108.6° |
| C22 | C32 | H32 | 107.9° | 107.9° |
| C32 | C22 | H22 | 110.1° | 110.1° |
| O65 | C65 | C55 | 108.1° | 108.1° |
| O65 | C65 | H651 | 109.9° | 109.9° |
| O65 | C65 | H652 | 110.3° | 110.3° |
| C65 | C55 | C45 | 112.6° | 112.6° |
| C65 | C55 | H55 | 108.1° | 108.1° |
| C55 | C65 | H651 | 109.9° | 109.9° |
| C55 | C65 | H652 | 110.3° | 110.2° |
| C55 | C45 | C35 | 110.5° | 110.5° |
| C55 | C45 | O45 | 108.7° | 108.7° |
| C55 | C45 | H45 | 108.4° | 108.4° |
| C45 | C55 | H55 | 106.9° | 106.9° |
| C12 | C22 | O22 | 109.1° | 109.1° |
| C22 | C12 | O41 | 110.0° | 110.0° |
| C12 | C22 | H22 | 109.6° | 109.6° |
| C22 | C12 | H12 | 109.7° | 109.7° |
| O22 | C22 | H22 | 110.2° | 110.2° |
| C22 | O22 | HO22 | 109.5° | 109.5° |
| C12 | O41 | C41 | 111.4° | 111.4° |
| O41 | C12 | H12 | 109.4° | 109.4° |
| O61 | C61 | C51 | 109.1° | 109.1° |
| O61 | C61 | H611 | 109.6° | 109.6° |
| O61 | C61 | H612 | 109.7° | 109.7° |
| C61 | O61 | HO61 | 109.5° | 109.5° |
| C61 | C51 | C41 | 114.4° | 114.4° |
| C61 | C51 | O51 | 110.0° | 110.0° |
| C61 | C51 | H51 | 105.4° | 105.4° |
| C51 | C61 | H611 | 109.6° | 109.6° |
| C51 | C61 | H612 | 109.7° | 109.7° |
| O25 | C25 | C35 | 109.3° | 109.3° |
| C25 | O25 | C79 | 113.1° | 113.1° |
| O25 | C25 | H25 | 111.1° | 111.1° |
| C25 | C35 | C45 | 110.0° | 110.0° |
| C25 | C35 | O35 | 112.4° | 112.4° |
| C25 | C35 | H35 | 107.0° | 107.1° |
| C35 | C25 | H25 | 108.3° | 108.3° |
| O25 | C79 | H791 | 109.5° | 109.5° |
| O25 | C79 | H792 | 109.5° | 109.5° |
| O25 | C79 | H793 | 109.4° | 109.4° |
| O41 | C41 | C51 | 110.3° | 110.3° |
| O41 | C41 | C31 | 108.8° | 108.8° |
| O41 | C41 | H41 | 108.9° | 108.9° |
| C35 | C45 | O45 | 106.6° | 106.6° |
| C45 | C35 | O35 | 109.3° | 109.3° |
| C35 | C45 | H45 | 110.4° | 110.4° |
| C45 | C35 | H35 | 110.2° | 110.2° |
| C45 | O45 | C16 | 117.3° | 117.3° |
| O45 | C45 | H45 | 112.2° | 112.2° |
| C41 | C51 | O51 | 108.7° | 108.7° |
| C51 | C41 | C31 | 107.9° | 107.9° |
| C51 | C41 | H41 | 109.8° | 109.8° |
| C41 | C51 | H51 | 106.9° | 106.9° |
| C51 | O51 | C11 | 111.5° | 111.5° |
| O51 | C51 | H51 | 111.4° | 111.4° |
| O35 | C35 | H35 | 107.8° | 107.8° |
| C35 | O35 | HO35 | 109.5° | 109.5° |
| C41 | C31 | O31 | 111.1° | 111.1° |
| C41 | C31 | C21 | 109.6° | 109.6° |
| C31 | C41 | H41 | 111.2° | 111.2° |
| C41 | C31 | H31 | 109.2° | 109.2° |
| O45 | C16 | O56 | 109.4° | 109.4° |
| O45 | C16 | C26 | 108.2° | 108.2° |
| O45 | C16 | H16 | 109.9° | 109.9° |
| C56 | C66 | O66 | 106.7° | 106.7° |
| C66 | C56 | O56 | 109.7° | 109.7° |
| C66 | C56 | C46 | 112.1° | 112.1° |
| C66 | C56 | H56 | 107.8° | 107.8° |
| C56 | C66 | H661 | 110.4° | 110.4° |
| C56 | C66 | H662 | 111.0° | 111.0° |
| O66 | C66 | H661 | 110.4° | 110.4° |
| O66 | C66 | H662 | 111.0° | 111.0° |
| C66 | O66 | HO66 | 109.5° | 109.5° |
| C56 | O56 | C16 | 112.7° | 112.7° |
| O56 | C56 | C46 | 110.4° | 110.4° |
| O56 | C56 | H56 | 109.6° | 109.6° |
| O56 | C16 | C26 | 107.9° | 107.9° |
| O56 | C16 | H16 | 110.1° | 110.1° |
| O51 | C11 | O47 | 109.5° | 109.5° |
| O51 | C11 | C21 | 106.9° | 106.9° |
| O51 | C11 | H11 | 111.4° | 111.4° |
| C56 | C46 | O46 | 107.4° | 107.4° |
| C56 | C46 | C36 | 110.8° | 110.8° |
| C56 | C46 | H46 | 109.2° | 109.2° |
| C46 | C56 | H56 | 107.1° | 107.1° |
| C16 | C26 | O26 | 107.3° | 107.3° |
| C16 | C26 | C36 | 110.3° | 110.3° |
| C16 | C26 | H26 | 111.0° | 111.0° |
| C26 | C16 | H16 | 111.3° | 111.3° |
| O31 | C31 | C21 | 111.9° | 111.9° |
| C31 | O31 | C84 | 111.6° | 111.6° |
| O31 | C31 | H31 | 106.7° | 106.7° |
| C31 | C21 | C11 | 109.0° | 109.0° |
| C31 | C21 | O21 | 110.4° | 110.4° |
| C21 | C31 | H31 | 108.3° | 108.3° |
| C31 | C21 | H21 | 109.2° | 109.2° |
| C57 | C67 | O67 | 107.4° | 107.4° |
| C67 | C57 | C47 | 113.4° | 113.4° |
| C67 | C57 | O57 | 106.3° | 106.3° |
| C57 | C67 | H671 | 110.2° | 110.1° |
| C57 | C67 | H672 | 110.6° | 110.6° |
| C67 | C57 | H57 | 109.1° | 109.1° |
| C67 | O67 | HO67 | 109.5° | 109.5° |
| O67 | C67 | H671 | 110.1° | 110.2° |
| O67 | C67 | H672 | 110.6° | 110.6° |
| O31 | C84 | H841 | 109.5° | 109.5° |
| O31 | C84 | H842 | 109.5° | 109.5° |
| O31 | C84 | H843 | 109.5° | 109.5° |
| C11 | O47 | C47 | 114.4° | 114.4° |
| O47 | C11 | C21 | 110.2° | 110.2° |
| O47 | C11 | H11 | 108.2° | 108.2° |
| O47 | C47 | C57 | 111.4° | 111.4° |
| O47 | C47 | C37 | 107.8° | 107.8° |
| O47 | C47 | H47 | 109.3° | 109.3° |
| C11 | C21 | O21 | 109.7° | 109.7° |
| C21 | C11 | H11 | 110.7° | 110.7° |
| C11 | C21 | H21 | 110.0° | 110.0° |
| C47 | C57 | O57 | 109.5° | 109.5° |
| C57 | C47 | C37 | 109.4° | 109.4° |
| C47 | C57 | H57 | 105.8° | 105.8° |
| C57 | C47 | H47 | 107.6° | 107.6° |
| C57 | O57 | C17 | 111.8° | 111.8° |
| O57 | C57 | H57 | 113.0° | 113.0° |
| O21 | C21 | H21 | 108.5° | 108.5° |
| C21 | O21 | HO21 | 109.5° | 109.5° |
| O46 | C46 | C36 | 106.8° | 106.8° |
| C46 | O46 | C17 | 114.6° | 114.6° |
| O46 | C46 | H46 | 113.0° | 113.0° |
| C46 | C36 | C26 | 110.4° | 110.4° |
| C46 | C36 | O36 | 109.1° | 109.1° |
| C36 | C46 | H46 | 109.7° | 109.7° |
| C46 | C36 | H36 | 109.5° | 109.5° |
| O46 | C17 | O57 | 109.9° | 109.9° |
| O46 | C17 | C27 | 109.5° | 109.5° |
| O46 | C17 | H17 | 108.9° | 108.9° |
| O26 | C26 | C36 | 111.2° | 111.2° |
| C26 | O26 | C83 | 111.4° | 111.4° |
| O26 | C26 | H26 | 110.1° | 110.1° |
| C26 | C36 | O36 | 110.8° | 110.8° |
| C26 | C36 | H36 | 107.8° | 107.8° |
| C36 | C26 | H26 | 107.0° | 107.0° |
| C47 | C37 | O37 | 109.9° | 109.9° |
| C47 | C37 | C27 | 109.3° | 109.3° |
| C37 | C47 | H47 | 111.3° | 111.3° |
| C47 | C37 | H37 | 109.6° | 109.6° |
| O26 | C83 | H831 | 109.5° | 109.5° |
| O26 | C83 | H832 | 109.4° | 109.4° |
| O26 | C83 | H833 | 109.5° | 109.5° |
| O36 | C36 | H36 | 109.2° | 109.2° |
| C36 | O36 | HO36 | 109.5° | 109.5° |
| O57 | C17 | C27 | 108.8° | 108.8° |
| O57 | C17 | H17 | 109.6° | 109.6° |
| O37 | C37 | C27 | 110.5° | 110.5° |
| C37 | O37 | C81 | 113.1° | 113.1° |
| O37 | C37 | H37 | 108.5° | 108.5° |
| C37 | C27 | C17 | 111.3° | 111.3° |
| C37 | C27 | O27 | 108.5° | 108.5° |
| C37 | C27 | H27 | 109.3° | 109.3° |
| C27 | C37 | H37 | 109.1° | 109.1° |
| C17 | C27 | O27 | 110.6° | 110.6° |
| C27 | C17 | H17 | 110.0° | 110.0° |
| C17 | C27 | H27 | 107.2° | 107.2° |
| O37 | C81 | H811 | 109.5° | 109.5° |
| O37 | C81 | H812 | 109.4° | 109.4° |
| O37 | C81 | H813 | 109.5° | 109.5° |
| C27 | O27 | C82 | 111.9° | 111.9° |
| O27 | C27 | H27 | 110.0° | 110.0° |
| O27 | C82 | H821 | 109.5° | 109.5° |
| O27 | C82 | H822 | 109.5° | 109.5° |
| O27 | C82 | H823 | 109.5° | 109.5° |
| H671 | C67 | H672 | 107.9° | 107.9° |
| H811 | C81 | H812 | 109.5° | 109.5° |
| H811 | C81 | H813 | 109.5° | 109.5° |
| H812 | C81 | H813 | 109.4° | 109.5° |
| H821 | C82 | H822 | 109.5° | 109.4° |
| H821 | C82 | H823 | 109.5° | 109.5° |
| H822 | C82 | H823 | 109.5° | 109.5° |
| H831 | C83 | H832 | 109.5° | 109.5° |
| H831 | C83 | H833 | 109.5° | 109.5° |
| H832 | C83 | H833 | 109.5° | 109.5° |
| H661 | C66 | H662 | 107.4° | 107.4° |
| H791 | C79 | H792 | 109.5° | 109.5° |
| H791 | C79 | H793 | 109.5° | 109.5° |
| H792 | C79 | H793 | 109.5° | 109.5° |
| H651 | C65 | H652 | 108.4° | 108.4° |
| H781 | C78 | H782 | 109.4° | 109.5° |
| H781 | C78 | H783 | 109.5° | 109.4° |
| H782 | C78 | H783 | 109.5° | 109.5° |
| H801 | C80 | H802 | 109.5° | 109.5° |
| H801 | C80 | H803 | 109.5° | 109.5° |
| H802 | C80 | H803 | 109.5° | 109.5° |
| H641 | C64 | H642 | 109.7° | 109.7° |
| H631 | C63 | H632 | 110.4° | 110.4° |
| H621 | C62 | H622 | 108.9° | 108.9° |
| H611 | C61 | H612 | 109.2° | 109.2° |
| H841 | C84 | H842 | 109.5° | 109.5° |
| H841 | C84 | H843 | 109.4° | 109.4° |
| H842 | C84 | H843 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O63 | C63 | C53 | H631 | 120.0° | 120.0° |
| O63 | C63 | C53 | H632 | 119.5° | 119.5° |
| O63 | C63 | C53 | O53 | 63.3° | 63.3° |
| O63 | C63 | C53 | C43 | 60.0° | 60.0° |
| O63 | C63 | C53 | H53 | 176.1° | 176.1° |
| O63 | C63 | H631 | H632 | 119.5° | 119.5° |
| C63 | C53 | O53 | C43 | 125.1° | 125.1° |
| C63 | C53 | O53 | H53 | 118.6° | 118.6° |
| C63 | C53 | O53 | C13 | 174.8° | 174.8° |
| C63 | C53 | C43 | H53 | 118.2° | 118.2° |
| C63 | C53 | C43 | O43 | 67.2° | 67.2° |
| C63 | C53 | C43 | C33 | 173.6° | 173.6° |
| C63 | C53 | C43 | H43 | 52.0° | 52.0° |
| C53 | C63 | H631 | H632 | 119.5° | 119.5° |
| C53 | C63 | O63 | HO63 | 53.8° | 53.8° |
| O53 | C53 | C43 | H53 | 120.3° | 120.3° |
| O53 | C53 | C43 | O43 | 171.2° | 171.2° |
| O53 | C53 | C43 | C33 | 52.1° | 52.1° |
| C53 | O53 | C13 | C23 | 61.2° | 61.2° |
| C53 | O53 | C13 | O42 | 58.0° | 58.0° |
| O53 | C53 | C43 | H43 | 69.5° | 69.5° |
| O53 | C53 | C63 | H631 | 176.7° | 176.7° |
| O53 | C53 | C63 | H632 | 56.2° | 56.2° |
| C53 | O53 | C13 | H13 | 178.1° | 178.1° |
| C13 | O53 | C53 | C43 | 60.1° | 60.1° |
| O53 | C13 | C23 | O42 | 118.6° | 118.6° |
| O53 | C13 | C23 | H13 | 121.2° | 121.2° |
| O53 | C13 | O42 | H13 | 121.3° | 121.3° |
| O53 | C13 | C23 | C33 | 56.5° | 56.5° |
| O53 | C13 | C23 | O23 | 177.2° | 177.2° |
| O53 | C13 | O42 | C42 | 116.3° | 116.3° |
| O53 | C13 | C23 | H23 | 62.7° | 62.7° |
| C13 | O53 | C53 | H53 | 56.2° | 56.2° |
| O54 | C14 | O43 | C24 | 118.6° | 118.6° |
| O54 | C14 | O43 | H14 | 122.2° | 122.2° |
| O54 | C14 | C24 | H14 | 122.3° | 122.4° |
| O54 | C14 | O43 | C43 | 106.9° | 106.9° |
| C14 | O54 | C54 | C64 | 178.8° | 178.8° |
| O54 | C14 | C24 | O24 | 176.2° | 176.2° |
| O54 | C14 | C24 | C34 | 56.3° | 56.3° |
| C14 | O54 | C54 | C44 | 59.8° | 59.8° |
| O54 | C14 | C24 | H24 | 63.6° | 63.6° |
| C14 | O54 | C54 | H54 | 59.2° | 59.2° |
| O54 | C54 | C64 | O64 | 69.6° | 69.6° |
| C54 | O54 | C14 | O43 | 60.5° | 60.5° |
| C54 | O54 | C14 | C24 | 59.1° | 59.1° |
| O54 | C54 | C64 | C44 | 121.0° | 121.0° |
| O54 | C54 | C64 | H54 | 120.0° | 120.0° |
| O54 | C54 | C44 | H54 | 120.0° | 120.0° |
| O54 | C54 | C44 | C34 | 56.8° | 56.8° |
| O54 | C54 | C44 | O44 | 176.8° | 176.8° |
| O54 | C54 | C44 | H44 | 63.8° | 63.8° |
| O54 | C54 | C64 | H641 | 50.4° | 50.4° |
| O54 | C54 | C64 | H642 | 170.5° | 170.5° |
| C54 | O54 | C14 | H14 | 178.3° | 178.3° |
| O64 | C64 | C54 | H641 | 120.0° | 120.0° |
| O64 | C64 | C54 | H642 | 119.9° | 119.9° |
| O64 | C64 | C54 | C44 | 169.4° | 169.4° |
| O64 | C64 | C54 | H54 | 50.4° | 50.4° |
| O64 | C64 | H641 | H642 | 119.9° | 119.9° |
| C53 | C43 | O43 | C14 | 115.2° | 115.2° |
| C53 | C43 | O43 | C33 | 120.5° | 120.5° |
| C53 | C43 | O43 | H43 | 117.8° | 117.8° |
| C53 | C43 | C33 | H43 | 117.8° | 117.8° |
| C53 | C43 | C33 | C23 | 51.1° | 51.1° |
| C53 | C43 | C33 | O33 | 173.0° | 173.0° |
| C53 | C43 | C33 | H33 | 66.8° | 66.8° |
| C43 | C53 | C63 | H631 | 60.0° | 60.0° |
| C43 | C53 | C63 | H632 | 179.5° | 179.5° |
| O43 | C14 | C24 | H14 | 121.4° | 121.4° |
| C14 | O43 | C43 | C33 | 124.3° | 124.3° |
| O43 | C14 | C24 | O24 | 60.0° | 60.0° |
| O43 | C14 | C24 | C34 | 59.9° | 59.9° |
| O43 | C14 | C24 | H24 | 179.8° | 179.8° |
| C14 | O43 | C43 | H43 | 2.6° | 2.6° |
| C24 | C14 | O43 | C43 | 134.5° | 134.5° |
| C14 | C24 | O24 | C80 | 103.9° | 103.9° |
| C14 | C24 | O24 | C34 | 121.3° | 121.3° |
| C14 | C24 | O24 | H24 | 118.8° | 118.8° |
| C14 | C24 | C34 | H24 | 118.8° | 118.8° |
| C14 | C24 | C34 | C44 | 55.9° | 55.9° |
| C14 | C24 | C34 | O34 | 177.5° | 177.5° |
| C14 | C24 | C34 | H34 | 63.8° | 63.8° |
| O43 | C43 | C33 | H43 | 119.3° | 119.3° |
| O43 | C43 | C33 | C23 | 174.0° | 174.0° |
| O43 | C43 | C33 | O33 | 64.1° | 64.1° |
| C43 | O43 | C14 | H14 | 15.3° | 15.4° |
| O43 | C43 | C33 | H33 | 56.1° | 56.1° |
| O43 | C43 | C53 | H53 | 50.9° | 50.9° |
| C43 | C33 | C23 | C13 | 54.5° | 54.5° |
| C43 | C33 | C23 | O33 | 120.9° | 120.9° |
| C43 | C33 | C23 | H33 | 119.0° | 119.0° |
| C43 | C33 | C23 | O23 | 175.1° | 175.1° |
| C43 | C33 | O33 | H33 | 119.1° | 119.1° |
| C43 | C33 | O33 | HO33 | 124.5° | 124.5° |
| C43 | C33 | C23 | H23 | 64.8° | 64.8° |
| C33 | C43 | C53 | H53 | 68.2° | 68.2° |
| C23 | C13 | O42 | H13 | 120.8° | 120.7° |
| C13 | C23 | C33 | O23 | 120.6° | 120.6° |
| C13 | C23 | C33 | H23 | 119.3° | 119.3° |
| C13 | C23 | O23 | H23 | 119.3° | 119.3° |
| C13 | C23 | C33 | O33 | 175.4° | 175.4° |
| C23 | C13 | O42 | C42 | 125.7° | 125.7° |
| C13 | C23 | C33 | H33 | 64.5° | 64.5° |
| C13 | C23 | O23 | HO23 | 88.2° | 88.2° |
| O42 | C13 | C23 | C33 | 62.1° | 62.1° |
| O42 | C13 | C23 | O23 | 58.5° | 58.5° |
| C13 | O42 | C42 | C52 | 112.2° | 112.2° |
| C13 | O42 | C42 | C32 | 126.5° | 126.5° |
| O42 | C13 | C23 | H23 | 178.6° | 178.6° |
| C13 | O42 | C42 | H42 | 6.5° | 6.5° |
| O62 | C62 | C52 | H621 | 120.0° | 120.0° |
| O62 | C62 | C52 | H622 | 120.3° | 120.3° |
| O62 | C62 | C52 | C42 | 123.6° | 123.6° |
| O62 | C62 | C52 | O52 | 113.8° | 113.8° |
| O62 | C62 | C52 | H52 | 5.7° | 5.7° |
| O62 | C62 | H621 | H622 | 120.3° | 120.3° |
| C33 | C23 | O23 | H23 | 119.3° | 119.3° |
| C23 | C33 | O33 | H33 | 118.0° | 118.0° |
| C23 | C33 | C43 | H43 | 66.7° | 66.7° |
| C23 | C33 | O33 | HO33 | 112.6° | 112.6° |
| C33 | C23 | O23 | HO23 | 150.4° | 150.4° |
| C33 | C23 | C13 | H13 | 177.8° | 177.7° |
| O23 | C23 | C33 | O33 | 64.0° | 64.0° |
| O23 | C23 | C33 | H33 | 56.1° | 56.1° |
| O23 | C23 | C13 | H13 | 61.6° | 61.6° |
| C80 | O24 | C24 | C34 | 134.8° | 134.8° |
| C80 | O24 | C24 | H24 | 14.9° | 14.9° |
| O24 | C80 | H801 | H802 | 120.0° | 120.0° |
| O24 | C80 | H801 | H803 | 120.0° | 120.0° |
| O24 | C80 | H802 | H803 | 120.0° | 120.0° |
| C64 | C54 | C44 | H54 | 119.6° | 119.6° |
| C64 | C54 | C44 | C34 | 177.3° | 177.3° |
| C64 | C54 | C44 | O44 | 62.8° | 62.8° |
| C64 | C54 | C44 | H44 | 56.7° | 56.7° |
| C54 | C64 | H641 | H642 | 119.9° | 119.9° |
| C54 | C64 | O64 | HO64 | 92.6° | 92.6° |
| C62 | C52 | C42 | O42 | 75.3° | 75.3° |
| C62 | C52 | C42 | O52 | 119.8° | 119.8° |
| C62 | C52 | C42 | H52 | 120.9° | 120.9° |
| C62 | C52 | C42 | C32 | 165.8° | 165.8° |
| C62 | C52 | O52 | H52 | 120.9° | 120.9° |
| C62 | C52 | O52 | C12 | 176.8° | 176.8° |
| C62 | C52 | C42 | H42 | 45.8° | 45.8° |
| C52 | C62 | H621 | H622 | 120.3° | 120.3° |
| C52 | C62 | O62 | HO62 | 18.0° | 18.0° |
| O24 | C24 | C34 | H24 | 120.2° | 120.2° |
| O24 | C24 | C34 | C44 | 176.8° | 176.8° |
| O24 | C24 | C34 | O34 | 61.6° | 61.6° |
| O24 | C24 | C34 | H34 | 57.2° | 57.2° |
| C24 | O24 | C80 | H801 | 123.9° | 123.9° |
| C24 | O24 | C80 | H802 | 116.1° | 116.1° |
| C24 | O24 | C80 | H803 | 3.9° | 3.9° |
| O24 | C24 | C14 | H14 | 61.4° | 61.4° |
| C24 | C34 | C44 | C54 | 55.8° | 55.8° |
| C24 | C34 | C44 | O34 | 121.6° | 121.6° |
| C24 | C34 | C44 | H34 | 119.5° | 119.5° |
| C24 | C34 | C44 | O44 | 177.9° | 177.9° |
| C24 | C34 | O34 | H34 | 119.5° | 119.5° |
| C24 | C34 | C44 | H44 | 62.6° | 62.6° |
| C24 | C34 | O34 | HO34 | 154.6° | 154.6° |
| C34 | C24 | C14 | H14 | 178.6° | 178.7° |
| C54 | C44 | C34 | O44 | 122.1° | 122.1° |
| C54 | C44 | C34 | H44 | 118.4° | 118.4° |
| C54 | C44 | O44 | H44 | 118.4° | 118.4° |
| C54 | C44 | C34 | O34 | 177.4° | 177.4° |
| C54 | C44 | O44 | C15 | 120.5° | 120.5° |
| C54 | C44 | C34 | H34 | 63.8° | 63.8° |
| C44 | C54 | C64 | H641 | 70.6° | 70.6° |
| C44 | C54 | C64 | H642 | 49.5° | 49.5° |
| O33 | C33 | C43 | H43 | 55.2° | 55.2° |
| O33 | C33 | C23 | H23 | 56.1° | 56.1° |
| O42 | C42 | C52 | C32 | 118.9° | 118.9° |
| O42 | C42 | C52 | H42 | 121.1° | 121.1° |
| O42 | C42 | C32 | H42 | 121.1° | 121.1° |
| O42 | C42 | C52 | O52 | 165.0° | 165.0° |
| O42 | C42 | C32 | O32 | 69.5° | 69.5° |
| O42 | C42 | C32 | C22 | 167.9° | 167.9° |
| C42 | O42 | C13 | H13 | 5.0° | 5.0° |
| O42 | C42 | C32 | H32 | 49.7° | 49.7° |
| O42 | C42 | C52 | H52 | 45.6° | 45.6° |
| C34 | C44 | O44 | H44 | 120.7° | 120.7° |
| C44 | C34 | O34 | H34 | 119.6° | 119.6° |
| C34 | C44 | O44 | C15 | 118.5° | 118.5° |
| C44 | C34 | O34 | HO34 | 84.6° | 84.6° |
| C44 | C34 | C24 | H24 | 62.9° | 62.9° |
| C34 | C44 | C54 | H54 | 63.1° | 63.1° |
| O44 | C44 | C34 | O34 | 60.4° | 60.4° |
| C44 | O44 | C15 | O55 | 107.2° | 107.2° |
| C44 | O44 | C15 | C25 | 132.6° | 132.6° |
| C44 | O44 | C15 | H15 | 13.1° | 13.1° |
| O44 | C44 | C34 | H34 | 58.4° | 58.4° |
| O44 | C44 | C54 | H54 | 56.8° | 56.8° |
| C52 | C42 | C32 | H42 | 118.7° | 118.7° |
| C42 | C52 | O52 | H52 | 117.8° | 117.8° |
| C42 | C52 | O52 | C12 | 55.5° | 55.5° |
| C52 | C42 | C32 | O32 | 170.4° | 170.4° |
| C52 | C42 | C32 | C22 | 47.7° | 47.7° |
| C52 | C42 | C32 | H32 | 70.5° | 70.5° |
| C42 | C52 | C62 | H621 | 116.4° | 116.4° |
| C42 | C52 | C62 | H622 | 3.2° | 3.2° |
| C32 | C42 | C52 | O52 | 46.0° | 46.0° |
| C42 | C32 | O32 | C22 | 123.4° | 123.4° |
| C42 | C32 | O32 | H32 | 118.3° | 118.3° |
| C42 | C32 | C22 | H32 | 118.2° | 118.2° |
| C42 | C32 | C22 | C12 | 55.7° | 55.7° |
| C42 | C32 | C22 | O22 | 174.6° | 174.6° |
| C42 | C32 | O32 | HO32 | 166.6° | 166.6° |
| C42 | C32 | C22 | H22 | 64.7° | 64.7° |
| C32 | C42 | C52 | H52 | 73.4° | 73.4° |
| C52 | O52 | C12 | C22 | 62.8° | 62.8° |
| C52 | O52 | C12 | O41 | 56.5° | 56.5° |
| O52 | C52 | C42 | H42 | 73.9° | 73.9° |
| O52 | C52 | C62 | H621 | 6.3° | 6.3° |
| O52 | C52 | C62 | H622 | 125.9° | 125.9° |
| C52 | O52 | C12 | H12 | 176.8° | 176.8° |
| O34 | C34 | C44 | H44 | 59.0° | 59.0° |
| O34 | C34 | C24 | H24 | 58.6° | 58.6° |
| O52 | C12 | C22 | C32 | 61.4° | 61.4° |
| O52 | C12 | C22 | O41 | 118.2° | 118.2° |
| O52 | C12 | C22 | H12 | 121.4° | 121.4° |
| O52 | C12 | C22 | O22 | 180.0° | 180.0° |
| O52 | C12 | O41 | H12 | 121.4° | 121.4° |
| O52 | C12 | O41 | C41 | 111.2° | 111.2° |
| O52 | C12 | C22 | H22 | 59.3° | 59.3° |
| C12 | O52 | C52 | H52 | 62.3° | 62.3° |
| O55 | C15 | O44 | C25 | 120.2° | 120.2° |
| O55 | C15 | O44 | H15 | 120.4° | 120.4° |
| O55 | C15 | C25 | H15 | 120.4° | 120.4° |
| C15 | O55 | C55 | C65 | 176.1° | 176.1° |
| C15 | O55 | C55 | C45 | 60.5° | 60.5° |
| O55 | C15 | C25 | O25 | 173.0° | 173.0° |
| O55 | C15 | C25 | C35 | 53.7° | 53.7° |
| O55 | C15 | C25 | H25 | 65.8° | 65.8° |
| C15 | O55 | C55 | H55 | 57.4° | 57.4° |
| C55 | O55 | C15 | O44 | 59.4° | 59.4° |
| C55 | O55 | C15 | C25 | 59.2° | 59.2° |
| O55 | C55 | C65 | O65 | 67.4° | 67.4° |
| O55 | C55 | C65 | C45 | 121.6° | 121.6° |
| O55 | C55 | C65 | H55 | 120.5° | 120.5° |
| O55 | C55 | C45 | H55 | 120.5° | 120.5° |
| O55 | C55 | C45 | C35 | 57.0° | 57.0° |
| O55 | C55 | C45 | O45 | 173.7° | 173.7° |
| O55 | C55 | C45 | H45 | 64.1° | 64.1° |
| O55 | C55 | C65 | H651 | 172.6° | 172.6° |
| O55 | C55 | C65 | H652 | 53.2° | 53.1° |
| C55 | O55 | C15 | H15 | 178.7° | 178.7° |
| C78 | O65 | C65 | C55 | 157.7° | 157.7° |
| C78 | O65 | C65 | H651 | 82.3° | 82.3° |
| C78 | O65 | C65 | H652 | 37.1° | 37.1° |
| O65 | C78 | H781 | H782 | 120.0° | 120.0° |
| O65 | C78 | H781 | H783 | 120.0° | 120.0° |
| O65 | C78 | H782 | H783 | 120.0° | 120.0° |
| O44 | C15 | C25 | H15 | 122.0° | 122.0° |
| O44 | C15 | C25 | O25 | 55.4° | 55.4° |
| O44 | C15 | C25 | C35 | 63.8° | 63.8° |
| O44 | C15 | C25 | H25 | 176.6° | 176.6° |
| C15 | O44 | C44 | H44 | 2.2° | 2.2° |
| C15 | C25 | O25 | C35 | 119.9° | 119.9° |
| C15 | C25 | O25 | H25 | 120.5° | 120.5° |
| C15 | C25 | C35 | H25 | 120.6° | 120.6° |
| C15 | C25 | O25 | C79 | 124.8° | 124.8° |
| C15 | C25 | C35 | C45 | 51.9° | 51.9° |
| C15 | C25 | C35 | O35 | 173.9° | 173.9° |
| C15 | C25 | C35 | H35 | 67.9° | 67.9° |
| O32 | C32 | C22 | H32 | 119.1° | 119.1° |
| O32 | C32 | C22 | C12 | 178.4° | 178.4° |
| O32 | C32 | C22 | O22 | 62.7° | 62.7° |
| O32 | C32 | C42 | H42 | 51.6° | 51.6° |
| O32 | C32 | C22 | H22 | 58.0° | 58.0° |
| C32 | C22 | C12 | O22 | 118.6° | 118.6° |
| C32 | C22 | C12 | H22 | 120.7° | 120.7° |
| C32 | C22 | O22 | H22 | 120.6° | 120.6° |
| C32 | C22 | C12 | O41 | 56.8° | 56.8° |
| C22 | C32 | C42 | H42 | 71.0° | 71.0° |
| C22 | C32 | O32 | HO32 | 69.9° | 69.9° |
| C32 | C22 | O22 | HO22 | 112.0° | 112.0° |
| C32 | C22 | C12 | H12 | 177.2° | 177.2° |
| O65 | C65 | C55 | H651 | 120.0° | 120.0° |
| O65 | C65 | C55 | H652 | 120.6° | 120.6° |
| O65 | C65 | C55 | C45 | 54.2° | 54.2° |
| O65 | C65 | C55 | H55 | 172.1° | 172.1° |
| O65 | C65 | H651 | H652 | 120.6° | 120.6° |
| C65 | O65 | C78 | H781 | 141.6° | 141.5° |
| C65 | O65 | C78 | H782 | 98.5° | 98.5° |
| C65 | O65 | C78 | H783 | 21.6° | 21.6° |
| C65 | C55 | C45 | H55 | 118.5° | 118.5° |
| C65 | C55 | C45 | C35 | 178.0° | 178.0° |
| C65 | C55 | C45 | O45 | 65.4° | 65.4° |
| C65 | C55 | C45 | H45 | 56.8° | 56.8° |
| C55 | C65 | H651 | H652 | 120.6° | 120.6° |
| C55 | C45 | C35 | C25 | 54.0° | 54.0° |
| C55 | C45 | C35 | O45 | 117.9° | 117.9° |
| C55 | C45 | C35 | H45 | 119.9° | 119.9° |
| C55 | C45 | O45 | H45 | 119.9° | 119.9° |
| C55 | C45 | C35 | O35 | 177.8° | 177.8° |
| C55 | C45 | O45 | C16 | 108.7° | 108.7° |
| C55 | C45 | C35 | H35 | 63.8° | 63.9° |
| C45 | C55 | C65 | H651 | 65.8° | 65.8° |
| C45 | C55 | C65 | H652 | 174.8° | 174.8° |
| C12 | C22 | O22 | H22 | 120.3° | 120.3° |
| C22 | C12 | O41 | H12 | 120.5° | 120.5° |
| C22 | C12 | O41 | C41 | 130.7° | 130.7° |
| C12 | C22 | C32 | H32 | 62.5° | 62.5° |
| C12 | C22 | O22 | HO22 | 129.0° | 129.0° |
| O22 | C22 | C12 | O41 | 61.8° | 61.8° |
| O22 | C22 | C32 | H32 | 56.4° | 56.4° |
| O22 | C22 | C12 | H12 | 58.6° | 58.6° |
| C12 | O41 | C41 | C51 | 120.1° | 120.1° |
| C12 | O41 | C41 | C31 | 121.7° | 121.7° |
| O41 | C12 | C22 | H22 | 177.5° | 177.5° |
| C12 | O41 | C41 | H41 | 0.4° | 0.4° |
| O61 | C61 | C51 | H611 | 120.0° | 120.0° |
| O61 | C61 | C51 | H612 | 120.1° | 120.1° |
| O61 | C61 | C51 | C41 | 59.3° | 59.3° |
| O61 | C61 | C51 | O51 | 63.4° | 63.4° |
| O61 | C61 | C51 | H51 | 176.4° | 176.4° |
| O61 | C61 | H611 | H612 | 120.1° | 120.1° |
| C61 | C51 | C41 | O41 | 58.2° | 58.2° |
| C61 | C51 | C41 | O51 | 123.4° | 123.4° |
| C61 | C51 | C41 | H51 | 116.2° | 116.2° |
| C61 | C51 | O51 | H51 | 116.5° | 116.5° |
| C61 | C51 | C41 | C31 | 176.9° | 176.9° |
| C61 | C51 | O51 | C11 | 166.6° | 166.6° |
| C61 | C51 | C41 | H41 | 61.7° | 61.7° |
| C51 | C61 | H611 | H612 | 120.2° | 120.2° |
| C51 | C61 | O61 | HO61 | 150.9° | 150.9° |
| O25 | C25 | C35 | H25 | 121.3° | 121.3° |
| O25 | C25 | C35 | C45 | 170.0° | 170.0° |
| O25 | C25 | C35 | O35 | 67.9° | 67.9° |
| O25 | C25 | C35 | H35 | 50.2° | 50.2° |
| C25 | O25 | C79 | H791 | 85.1° | 85.1° |
| C25 | O25 | C79 | H792 | 154.9° | 154.9° |
| C25 | O25 | C79 | H793 | 34.9° | 34.9° |
| O25 | C25 | C15 | H15 | 66.6° | 66.6° |
| C35 | C25 | O25 | C79 | 115.3° | 115.3° |
| C25 | C35 | C45 | O35 | 123.9° | 123.9° |
| C25 | C35 | C45 | H35 | 117.8° | 117.9° |
| C25 | C35 | C45 | O45 | 171.9° | 171.9° |
| C25 | C35 | O35 | H35 | 117.7° | 117.7° |
| C25 | C35 | C45 | H45 | 66.0° | 66.0° |
| C25 | C35 | O35 | HO35 | 166.2° | 166.2° |
| C35 | C25 | C15 | H15 | 174.2° | 174.2° |
| C79 | O25 | C25 | H25 | 4.2° | 4.2° |
| O25 | C79 | H791 | H792 | 120.0° | 120.0° |
| O25 | C79 | H791 | H793 | 120.0° | 120.0° |
| O25 | C79 | H792 | H793 | 120.0° | 120.0° |
| O41 | C41 | C51 | C31 | 118.7° | 118.7° |
| O41 | C41 | C51 | H41 | 120.0° | 120.0° |
| O41 | C41 | C51 | O51 | 178.3° | 178.3° |
| O41 | C41 | C31 | H41 | 119.9° | 119.9° |
| O41 | C41 | C31 | O31 | 60.4° | 60.4° |
| O41 | C41 | C31 | C21 | 175.4° | 175.4° |
| C41 | O41 | C12 | H12 | 10.2° | 10.2° |
| O41 | C41 | C51 | H51 | 58.0° | 58.0° |
| O41 | C41 | C31 | H31 | 57.0° | 57.0° |
| C35 | C45 | O45 | H45 | 121.0° | 121.0° |
| C45 | C35 | O35 | H35 | 119.8° | 119.8° |
| C35 | C45 | O45 | C16 | 132.2° | 132.2° |
| C45 | C35 | O35 | HO35 | 43.8° | 43.8° |
| C45 | C35 | C25 | H25 | 68.7° | 68.7° |
| C35 | C45 | C55 | H55 | 63.5° | 63.5° |
| O45 | C45 | C35 | O35 | 64.3° | 64.3° |
| C45 | O45 | C16 | O56 | 119.5° | 119.5° |
| C45 | O45 | C16 | C26 | 123.1° | 123.1° |
| C45 | O45 | C16 | H16 | 1.5° | 1.5° |
| O45 | C45 | C35 | H35 | 54.1° | 54.0° |
| O45 | C45 | C55 | H55 | 53.2° | 53.2° |
| C41 | C51 | O51 | H51 | 117.5° | 117.5° |
| C51 | C41 | C31 | H41 | 120.4° | 120.4° |
| C41 | C51 | O51 | C11 | 67.4° | 67.4° |
| C51 | C41 | C31 | O31 | 179.9° | 179.9° |
| C51 | C41 | C31 | C21 | 55.8° | 55.8° |
| C41 | C51 | C61 | H611 | 60.7° | 60.7° |
| C41 | C51 | C61 | H612 | 179.5° | 179.5° |
| C51 | C41 | C31 | H31 | 62.6° | 62.6° |
| O51 | C51 | C41 | C31 | 59.7° | 59.7° |
| C51 | O51 | C11 | O47 | 52.5° | 52.5° |
| C51 | O51 | C11 | C21 | 66.8° | 66.8° |
| O51 | C51 | C41 | H41 | 61.7° | 61.7° |
| O51 | C51 | C61 | H611 | 176.6° | 176.6° |
| O51 | C51 | C61 | H612 | 56.8° | 56.8° |
| C51 | O51 | C11 | H11 | 172.1° | 172.1° |
| O35 | C35 | C45 | H45 | 57.9° | 57.9° |
| O35 | C35 | C25 | H25 | 53.3° | 53.3° |
| C41 | C31 | O31 | C21 | 122.8° | 122.8° |
| C41 | C31 | O31 | H31 | 118.9° | 118.9° |
| C41 | C31 | C21 | H31 | 119.0° | 119.0° |
| C41 | C31 | O31 | C84 | 123.0° | 123.0° |
| C41 | C31 | C21 | C11 | 56.9° | 56.9° |
| C41 | C31 | C21 | O21 | 177.4° | 177.4° |
| C31 | C41 | C51 | H51 | 60.7° | 60.7° |
| C41 | C31 | C21 | H21 | 63.3° | 63.3° |
| O45 | C16 | O56 | C56 | 52.2° | 52.2° |
| O45 | C16 | O56 | C26 | 117.5° | 117.5° |
| O45 | C16 | O56 | H16 | 120.9° | 120.9° |
| O45 | C16 | C26 | H16 | 120.8° | 120.8° |
| O45 | C16 | C26 | O26 | 63.0° | 63.0° |
| O45 | C16 | C26 | C36 | 58.2° | 58.2° |
| O45 | C16 | C26 | H26 | 176.7° | 176.7° |
| C16 | O45 | C45 | H45 | 11.2° | 11.2° |
| C56 | C66 | O66 | H661 | 120.0° | 120.0° |
| C56 | C66 | O66 | H662 | 121.0° | 121.0° |
| C66 | C56 | O56 | C46 | 124.0° | 124.0° |
| C66 | C56 | O56 | H56 | 118.2° | 118.2° |
| C66 | C56 | O56 | C16 | 173.8° | 173.8° |
| C66 | C56 | C46 | H56 | 118.1° | 118.1° |
| C66 | C56 | C46 | O46 | 68.3° | 68.3° |
| C66 | C56 | C46 | C36 | 175.5° | 175.5° |
| C66 | C56 | C46 | H46 | 54.5° | 54.5° |
| C56 | C66 | H661 | H662 | 121.1° | 121.1° |
| C56 | C66 | O66 | HO66 | 75.2° | 75.2° |
| O66 | C66 | C56 | O56 | 61.1° | 61.1° |
| O66 | C66 | C56 | C46 | 61.9° | 61.9° |
| O66 | C66 | C56 | H56 | 179.6° | 179.6° |
| O66 | C66 | H661 | H662 | 121.1° | 121.1° |
| O56 | C56 | C46 | H56 | 119.3° | 119.3° |
| C56 | O56 | C16 | C26 | 65.2° | 65.2° |
| O56 | C56 | C46 | O46 | 169.1° | 169.1° |
| O56 | C56 | C46 | C36 | 52.8° | 52.8° |
| O56 | C56 | C46 | H46 | 68.1° | 68.1° |
| O56 | C56 | C66 | H661 | 58.9° | 58.9° |
| O56 | C56 | C66 | H662 | 177.9° | 177.9° |
| C56 | O56 | C16 | H16 | 173.1° | 173.1° |
| C16 | O56 | C56 | C46 | 62.2° | 62.2° |
| O56 | C16 | C26 | H16 | 120.9° | 120.9° |
| O56 | C16 | C26 | O26 | 178.7° | 178.7° |
| O56 | C16 | C26 | C36 | 60.0° | 60.0° |
| O56 | C16 | C26 | H26 | 58.4° | 58.4° |
| C16 | O56 | C56 | H56 | 55.6° | 55.5° |
| O51 | C11 | C21 | C31 | 60.3° | 60.3° |
| O51 | C11 | O47 | C21 | 117.3° | 117.3° |
| O51 | C11 | O47 | H11 | 121.6° | 121.6° |
| O51 | C11 | O47 | C47 | 123.7° | 123.7° |
| O51 | C11 | C21 | H11 | 121.5° | 121.5° |
| O51 | C11 | C21 | O21 | 178.7° | 178.7° |
| C11 | O51 | C51 | H51 | 50.1° | 50.1° |
| O51 | C11 | C21 | H21 | 59.4° | 59.4° |
| C56 | C46 | O46 | C36 | 118.9° | 118.9° |
| C56 | C46 | O46 | H46 | 120.4° | 120.4° |
| C56 | C46 | C36 | H46 | 120.6° | 120.6° |
| C56 | C46 | O46 | C17 | 134.9° | 134.9° |
| C56 | C46 | C36 | C26 | 49.7° | 49.7° |
| C56 | C46 | C36 | O36 | 171.7° | 171.7° |
| C56 | C46 | C36 | H36 | 68.8° | 68.8° |
| C46 | C56 | C66 | H661 | 178.1° | 178.1° |
| C46 | C56 | C66 | H662 | 59.1° | 59.1° |
| C16 | C26 | C36 | C46 | 53.6° | 53.6° |
| C16 | C26 | O26 | C36 | 120.7° | 120.7° |
| C16 | C26 | O26 | H26 | 120.9° | 120.9° |
| C16 | C26 | C36 | H26 | 120.8° | 120.8° |
| C16 | C26 | O26 | C83 | 135.8° | 135.8° |
| C16 | C26 | C36 | O36 | 174.6° | 174.6° |
| C16 | C26 | C36 | H36 | 66.0° | 66.0° |
| O31 | C31 | C21 | H31 | 117.3° | 117.3° |
| O31 | C31 | C21 | C11 | 179.4° | 179.4° |
| O31 | C31 | C21 | O21 | 58.9° | 58.9° |
| O31 | C31 | C41 | H41 | 59.5° | 59.5° |
| C31 | O31 | C84 | H841 | 97.1° | 97.1° |
| C31 | O31 | C84 | H842 | 142.9° | 142.9° |
| C31 | O31 | C84 | H843 | 22.8° | 22.8° |
| O31 | C31 | C21 | H21 | 60.4° | 60.4° |
| C21 | C31 | O31 | C84 | 114.2° | 114.2° |
| C31 | C21 | C11 | O47 | 58.6° | 58.6° |
| C31 | C21 | C11 | O21 | 121.0° | 121.0° |
| C31 | C21 | C11 | H21 | 119.7° | 119.7° |
| C31 | C21 | O21 | H21 | 119.7° | 119.7° |
| C21 | C31 | C41 | H41 | 64.6° | 64.6° |
| C31 | C21 | C11 | H11 | 178.2° | 178.2° |
| C31 | C21 | O21 | HO21 | 165.2° | 165.2° |
| C57 | C67 | O67 | H671 | 120.0° | 120.0° |
| C57 | C67 | O67 | H672 | 120.8° | 120.8° |
| C67 | C57 | C47 | O47 | 63.6° | 63.6° |
| C67 | C57 | C47 | O57 | 118.5° | 118.5° |
| C67 | C57 | C47 | H57 | 119.5° | 119.5° |
| C67 | C57 | O57 | H57 | 119.5° | 119.5° |
| C67 | C57 | C47 | C37 | 177.3° | 177.3° |
| C67 | C57 | O57 | C17 | 172.4° | 172.4° |
| C57 | C67 | O67 | HO67 | 178.1° | 178.1° |
| C57 | C67 | H671 | H672 | 120.9° | 120.9° |
| C67 | C57 | C47 | H47 | 56.2° | 56.2° |
| O67 | C67 | C57 | C47 | 64.8° | 64.8° |
| O67 | C67 | C57 | O57 | 55.5° | 55.5° |
| O67 | C67 | H671 | H672 | 120.8° | 120.8° |
| O67 | C67 | C57 | H57 | 177.6° | 177.6° |
| C84 | O31 | C31 | H31 | 4.1° | 4.1° |
| O31 | C84 | H841 | H842 | 120.0° | 120.0° |
| O31 | C84 | H841 | H843 | 120.0° | 120.0° |
| O31 | C84 | H842 | H843 | 120.0° | 120.0° |
| O47 | C11 | C21 | H11 | 119.6° | 119.6° |
| C11 | O47 | C47 | C57 | 107.4° | 107.4° |
| O47 | C11 | C21 | O21 | 62.4° | 62.4° |
| C11 | O47 | C47 | C37 | 132.6° | 132.6° |
| C11 | O47 | C47 | H47 | 11.5° | 11.5° |
| O47 | C11 | C21 | H21 | 178.3° | 178.3° |
| C47 | O47 | C11 | C21 | 119.1° | 119.1° |
| O47 | C47 | C57 | C37 | 119.1° | 119.1° |
| O47 | C47 | C57 | H47 | 119.8° | 119.8° |
| O47 | C47 | C57 | O57 | 177.9° | 177.9° |
| O47 | C47 | C37 | H47 | 119.8° | 119.8° |
| O47 | C47 | C37 | O37 | 63.9° | 63.9° |
| O47 | C47 | C37 | C27 | 174.8° | 174.8° |
| O47 | C47 | C57 | H57 | 55.9° | 55.9° |
| O47 | C47 | C37 | H37 | 55.3° | 55.3° |
| C47 | O47 | C11 | H11 | 2.1° | 2.1° |
| C11 | C21 | O21 | H21 | 120.2° | 120.2° |
| C11 | C21 | C31 | H31 | 62.1° | 62.1° |
| C11 | C21 | O21 | HO21 | 74.6° | 74.6° |
| C47 | C57 | O57 | H57 | 117.7° | 117.7° |
| C57 | C47 | C37 | H47 | 118.8° | 118.8° |
| C47 | C57 | O57 | C17 | 64.8° | 64.8° |
| C57 | C47 | C37 | O37 | 174.8° | 174.8° |
| C57 | C47 | C37 | C27 | 53.4° | 53.4° |
| C47 | C57 | C67 | H671 | 175.2° | 175.2° |
| C47 | C57 | C67 | H672 | 56.0° | 56.0° |
| C57 | C47 | C37 | H37 | 66.1° | 66.1° |
| C57 | O57 | C17 | O46 | 56.8° | 56.8° |
| O57 | C57 | C47 | C37 | 58.9° | 58.9° |
| C57 | O57 | C17 | C27 | 63.2° | 63.2° |
| O57 | C57 | C67 | H671 | 64.5° | 64.5° |
| O57 | C57 | C67 | H672 | 176.3° | 176.3° |
| O57 | C57 | C47 | H47 | 62.2° | 62.2° |
| C57 | O57 | C17 | H17 | 176.5° | 176.4° |
| O21 | C21 | C11 | H11 | 57.2° | 57.2° |
| O21 | C21 | C31 | H31 | 58.5° | 58.5° |
| O46 | C46 | C36 | H46 | 122.7° | 122.7° |
| O46 | C46 | C36 | C26 | 166.4° | 166.4° |
| O46 | C46 | C36 | O36 | 71.6° | 71.6° |
| C46 | O46 | C17 | O57 | 107.2° | 107.2° |
| C46 | O46 | C17 | C27 | 133.3° | 133.3° |
| C46 | O46 | C17 | H17 | 13.0° | 12.9° |
| O46 | C46 | C36 | H36 | 47.8° | 47.8° |
| O46 | C46 | C56 | H56 | 49.8° | 49.8° |
| C36 | C46 | O46 | C17 | 106.2° | 106.2° |
| C46 | C36 | C26 | O26 | 172.5° | 172.5° |
| C46 | C36 | C26 | O36 | 121.0° | 121.0° |
| C46 | C36 | C26 | H36 | 119.6° | 119.6° |
| C46 | C36 | O36 | H36 | 119.7° | 119.7° |
| C46 | C36 | O36 | HO36 | 81.3° | 81.3° |
| C46 | C36 | C26 | H26 | 67.2° | 67.2° |
| C36 | C46 | C56 | H56 | 66.5° | 66.4° |
| O46 | C17 | O57 | C27 | 119.9° | 119.9° |
| O46 | C17 | O57 | H17 | 119.7° | 119.7° |
| O46 | C17 | C27 | C37 | 63.1° | 63.1° |
| O46 | C17 | C27 | H17 | 119.7° | 119.7° |
| O46 | C17 | C27 | O27 | 57.7° | 57.7° |
| O46 | C17 | C27 | H27 | 177.6° | 177.6° |
| C17 | O46 | C46 | H46 | 14.5° | 14.5° |
| O26 | C26 | C36 | H26 | 120.3° | 120.3° |
| O26 | C26 | C36 | O36 | 66.5° | 66.5° |
| O26 | C26 | C36 | H36 | 52.9° | 52.9° |
| C26 | O26 | C83 | H831 | 93.6° | 93.6° |
| C26 | O26 | C83 | H832 | 146.4° | 146.4° |
| C26 | O26 | C83 | H833 | 26.3° | 26.3° |
| O26 | C26 | C16 | H16 | 57.8° | 57.8° |
| C36 | C26 | O26 | C83 | 103.5° | 103.5° |
| C26 | C36 | O36 | H36 | 118.6° | 118.6° |
| C26 | C36 | C46 | H46 | 70.9° | 70.9° |
| C26 | C36 | O36 | HO36 | 156.9° | 156.9° |
| C36 | C26 | C16 | H16 | 179.1° | 179.1° |
| C47 | C37 | O37 | C27 | 120.6° | 120.6° |
| C47 | C37 | O37 | H37 | 119.8° | 119.8° |
| C47 | C37 | C27 | H37 | 119.8° | 119.8° |
| C47 | C37 | C27 | C17 | 53.4° | 53.4° |
| C47 | C37 | O37 | C81 | 117.4° | 117.4° |
| C47 | C37 | C27 | O27 | 175.4° | 175.4° |
| C37 | C47 | C57 | H57 | 63.2° | 63.2° |
| C47 | C37 | C27 | H27 | 64.7° | 64.7° |
| C83 | O26 | C26 | H26 | 14.9° | 14.9° |
| O26 | C83 | H831 | H832 | 120.0° | 120.0° |
| O26 | C83 | H831 | H833 | 120.0° | 120.0° |
| O26 | C83 | H832 | H833 | 120.0° | 120.0° |
| O36 | C36 | C46 | H46 | 51.1° | 51.1° |
| O36 | C36 | C26 | H26 | 53.8° | 53.8° |
| O57 | C17 | C27 | C37 | 57.1° | 57.1° |
| O57 | C17 | C27 | H17 | 120.1° | 120.1° |
| O57 | C17 | C27 | O27 | 177.8° | 177.8° |
| C17 | O57 | C57 | H57 | 52.9° | 52.9° |
| O57 | C17 | C27 | H27 | 62.3° | 62.3° |
| O37 | C37 | C27 | H37 | 119.2° | 119.2° |
| O37 | C37 | C27 | C17 | 174.4° | 174.4° |
| O37 | C37 | C27 | O27 | 63.6° | 63.6° |
| O37 | C37 | C47 | H47 | 56.0° | 56.0° |
| O37 | C37 | C27 | H27 | 56.3° | 56.3° |
| C37 | O37 | C81 | H811 | 130.1° | 130.1° |
| C37 | O37 | C81 | H812 | 109.9° | 109.9° |
| C37 | O37 | C81 | H813 | 10.1° | 10.1° |
| C37 | C27 | C17 | O27 | 120.7° | 120.7° |
| C37 | C27 | C17 | H27 | 119.4° | 119.4° |
| C27 | C37 | O37 | C81 | 121.9° | 121.9° |
| C37 | C27 | O27 | H27 | 119.5° | 119.5° |
| C37 | C27 | O27 | C82 | 113.2° | 113.2° |
| C27 | C37 | C47 | H47 | 65.4° | 65.4° |
| C37 | C27 | C17 | H17 | 177.2° | 177.2° |
| C17 | C27 | O27 | H27 | 118.2° | 118.2° |
| C17 | C27 | O27 | C82 | 124.4° | 124.4° |
| C17 | C27 | C37 | H37 | 66.4° | 66.4° |
| C81 | O37 | C37 | H37 | 2.4° | 2.4° |
| O37 | C81 | H811 | H812 | 120.0° | 120.0° |
| O37 | C81 | H811 | H813 | 120.0° | 120.0° |
| O37 | C81 | H812 | H813 | 120.0° | 120.0° |
| O27 | C27 | C17 | H17 | 62.1° | 62.0° |
| O27 | C27 | C37 | H37 | 55.5° | 55.5° |
| C27 | O27 | C82 | H821 | 75.9° | 75.9° |
| C27 | O27 | C82 | H822 | 164.1° | 164.1° |
| C27 | O27 | C82 | H823 | 44.1° | 44.1° |
| C82 | O27 | C27 | H27 | 6.2° | 6.2° |
| O27 | C82 | H821 | H822 | 120.0° | 120.0° |
| O27 | C82 | H821 | H823 | 120.0° | 120.0° |
| O27 | C82 | H822 | H823 | 120.0° | 120.0° |
| HO67 | O67 | C67 | H671 | 58.1° | 58.1° |
| HO67 | O67 | C67 | H672 | 61.1° | 61.1° |
| H671 | C67 | C57 | H57 | 57.6° | 57.5° |
| H672 | C67 | C57 | H57 | 61.6° | 61.7° |
| H57 | C57 | C47 | H47 | 175.7° | 175.7° |
| H47 | C47 | C37 | H37 | 175.1° | 175.1° |
| H17 | C17 | C27 | H27 | 57.8° | 57.8° |
| H27 | C27 | C37 | H37 | 175.5° | 175.5° |
| H811 | C81 | H812 | H813 | 120.0° | 120.0° |
| H821 | C82 | H822 | H823 | 120.0° | 120.0° |
| H46 | C46 | C36 | H36 | 170.6° | 170.6° |
| H46 | C46 | C56 | H56 | 172.6° | 172.6° |
| H36 | C36 | O36 | HO36 | 38.3° | 38.3° |
| H36 | C36 | C26 | H26 | 173.2° | 173.2° |
| H26 | C26 | C16 | H16 | 62.5° | 62.5° |
| H831 | C83 | H832 | H833 | 120.0° | 120.0° |
| H56 | C56 | C66 | H661 | 60.4° | 60.4° |
| H56 | C56 | C66 | H662 | 58.6° | 58.5° |
| H661 | C66 | O66 | HO66 | 164.8° | 164.8° |
| H662 | C66 | O66 | HO66 | 45.8° | 45.8° |
| H45 | C45 | C35 | H35 | 176.2° | 176.2° |
| H45 | C45 | C55 | H55 | 175.4° | 175.4° |
| H35 | C35 | O35 | HO35 | 76.1° | 76.0° |
| H35 | C35 | C25 | H25 | 171.5° | 171.5° |
| H25 | C25 | C15 | H15 | 54.7° | 54.7° |
| H791 | C79 | H792 | H793 | 120.0° | 120.0° |
| H55 | C55 | C65 | H651 | 52.1° | 52.1° |
| H55 | C55 | C65 | H652 | 67.4° | 67.4° |
| H781 | C78 | H782 | H783 | 120.0° | 120.0° |
| H44 | C44 | C34 | H34 | 177.8° | 177.8° |
| H44 | C44 | C54 | H54 | 176.2° | 176.2° |
| H34 | C34 | O34 | HO34 | 35.0° | 35.0° |
| H34 | C34 | C24 | H24 | 177.4° | 177.4° |
| H24 | C24 | C14 | H14 | 58.8° | 58.8° |
| H801 | C80 | H802 | H803 | 120.0° | 120.0° |
| H54 | C54 | C64 | H641 | 170.4° | 170.4° |
| H54 | C54 | C64 | H642 | 69.5° | 69.5° |
| H641 | C64 | O64 | HO64 | 27.4° | 27.4° |
| H642 | C64 | O64 | HO64 | 147.5° | 147.5° |
| H43 | C43 | C33 | H33 | 175.4° | 175.4° |
| H43 | C43 | C53 | H53 | 170.1° | 170.1° |
| H33 | C33 | O33 | HO33 | 5.4° | 5.4° |
| H33 | C33 | C23 | H23 | 176.2° | 176.2° |
| H23 | C23 | O23 | HO23 | 31.1° | 31.1° |
| H23 | C23 | C13 | H13 | 58.5° | 58.5° |
| H53 | C53 | C63 | H631 | 56.1° | 56.1° |
| H53 | C53 | C63 | H632 | 64.4° | 64.4° |
| H631 | C63 | O63 | HO63 | 66.2° | 66.2° |
| H632 | C63 | O63 | HO63 | 173.3° | 173.3° |
| H42 | C42 | C32 | H32 | 170.8° | 170.8° |
| H42 | C42 | C52 | H52 | 166.7° | 166.7° |
| H32 | C32 | O32 | HO32 | 48.4° | 48.4° |
| H32 | C32 | C22 | H22 | 177.1° | 177.1° |
| H22 | C22 | O22 | HO22 | 8.6° | 8.6° |
| H22 | C22 | C12 | H12 | 62.1° | 62.1° |
| H52 | C52 | C62 | H621 | 125.7° | 125.7° |
| H52 | C52 | C62 | H622 | 114.6° | 114.6° |
| H621 | C62 | O62 | HO62 | 102.0° | 102.0° |
| H622 | C62 | O62 | HO62 | 138.3° | 138.3° |
| H41 | C41 | C51 | H51 | 177.9° | 177.9° |
| H41 | C41 | C31 | H31 | 176.9° | 176.9° |
| H51 | C51 | C61 | H611 | 56.4° | 56.4° |
| H51 | C51 | C61 | H612 | 63.5° | 63.5° |
| H611 | C61 | O61 | HO61 | 30.9° | 30.9° |
| H612 | C61 | O61 | HO61 | 89.0° | 88.9° |
| H11 | C11 | C21 | H21 | 62.1° | 62.1° |
| H31 | C31 | C21 | H21 | 177.7° | 177.7° |
| H841 | C84 | H842 | H843 | 119.9° | 119.9° |
| H21 | C21 | O21 | HO21 | 45.5° | 45.5° |
