A1JMB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.43Å | 1.42Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | O2 | sing | 1.43Å | 1.44Å | |
| O2 | C3 | sing | 1.43Å | 1.39Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | O3 | sing | 1.43Å | 1.42Å | |
| C3 | O4 | sing | 1.43Å | 1.43Å | |
| O4 | C5 | sing | 1.43Å | 1.44Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C6 | O5 | sing | 1.43Å | 1.44Å | |
| O5 | C7 | sing | 1.43Å | 1.40Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | O6 | sing | 1.43Å | 1.42Å | |
| C7 | O7 | sing | 1.43Å | 1.43Å | |
| O7 | C9 | sing | 1.43Å | 1.44Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| C10 | O8 | sing | 1.43Å | 1.45Å | |
| O8 | C11 | sing | 1.43Å | 1.40Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | O9 | sing | 1.43Å | 1.42Å | |
| C11 | O10 | sing | 1.43Å | 1.43Å | |
| O10 | C13 | sing | 1.43Å | 1.44Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C14 | O11 | sing | 1.43Å | 1.42Å | |
| C13 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | O12 | sing | 1.43Å | 1.43Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | O13 | sing | 1.43Å | 1.43Å | |
| C9 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | O14 | sing | 1.43Å | 1.43Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | O15 | sing | 1.43Å | 1.44Å | |
| O15 | C19 | sing | 1.43Å | 1.39Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | O16 | sing | 1.43Å | 1.45Å | |
| O16 | C21 | sing | 1.43Å | 1.39Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | O17 | sing | 1.43Å | 1.42Å | |
| C21 | O18 | sing | 1.43Å | 1.43Å | |
| O18 | C23 | sing | 1.43Å | 1.44Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C24 | O19 | sing | 1.43Å | 1.42Å | |
| C23 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | O20 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | O21 | sing | 1.43Å | 1.43Å | |
| C19 | O22 | sing | 1.43Å | 1.43Å | |
| O22 | C27 | sing | 1.43Å | 1.44Å | |
| C27 | C28 | sing | 1.53Å | 1.51Å | |
| C28 | O23 | sing | 1.43Å | 1.42Å | |
| C27 | C29 | sing | 1.53Å | 1.52Å | |
| C29 | O24 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | sing | 1.53Å | 1.52Å | |
| C30 | O25 | sing | 1.43Å | 1.43Å | |
| C5 | C31 | sing | 1.53Å | 1.53Å | |
| C31 | O26 | sing | 1.43Å | 1.43Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | O27 | sing | 1.43Å | 1.43Å | |
| O27 | C33 | sing | 1.43Å | 1.39Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | O28 | sing | 1.43Å | 1.45Å | |
| O28 | C35 | sing | 1.43Å | 1.39Å | |
| C35 | C36 | sing | 1.53Å | 1.52Å | |
| C36 | O29 | sing | 1.43Å | 1.42Å | |
| C36 | C37 | sing | 1.53Å | 1.52Å | |
| C37 | C38 | sing | 1.53Å | 1.52Å | |
| C38 | C39 | sing | 1.53Å | 1.53Å | |
| C39 | O30 | sing | 1.43Å | 1.44Å | |
| C39 | C40 | sing | 1.53Å | 1.51Å | |
| C40 | O31 | sing | 1.43Å | 1.42Å | |
| C38 | O32 | sing | 1.43Å | 1.43Å | |
| C37 | O33 | sing | 1.43Å | 1.43Å | |
| C34 | C41 | sing | 1.53Å | 1.52Å | |
| C41 | C42 | sing | 1.53Å | 1.52Å | |
| C42 | C43 | sing | 1.53Å | 1.53Å | |
| C43 | O34 | sing | 1.43Å | 1.44Å | |
| C43 | C44 | sing | 1.53Å | 1.51Å | |
| C44 | O35 | sing | 1.43Å | 1.42Å | |
| C42 | O36 | sing | 1.43Å | 1.43Å | |
| C41 | O37 | sing | 1.43Å | 1.43Å | |
| C2 | C45 | sing | 1.53Å | 1.53Å | |
| C45 | C46 | sing | 1.53Å | 1.51Å | |
| C46 | O38 | sing | 1.43Å | 1.42Å | |
| C45 | O39 | sing | 1.43Å | 1.44Å | |
| O39 | C47 | sing | 1.43Å | 1.42Å | |
| C47 | O40 | sing | 1.43Å | 1.40Å | |
| O40 | C48 | sing | 1.43Å | 1.44Å | |
| C48 | C49 | sing | 1.53Å | 1.53Å | |
| C49 | C50 | sing | 1.53Å | 1.51Å | |
| C50 | O41 | sing | 1.43Å | 1.42Å | |
| C49 | O42 | sing | 1.43Å | 1.44Å | |
| O42 | C51 | sing | 1.43Å | 1.41Å | |
| C51 | O43 | sing | 1.43Å | 1.40Å | |
| O43 | P1 | sing | 1.61Å | 1.60Å | |
| P1 | O44 | sing | 1.61Å | 1.61Å | |
| O44 | P2 | sing | 1.61Å | 1.60Å | |
| P2 | O45 | sing | 1.61Å | 1.49Å | |
| P2 | O46 | sing | 1.61Å | 1.60Å | |
| O46 | C52 | sing | 1.43Å | 1.38Å | |
| C52 | C53 | sing | 1.53Å | 1.51Å | |
| C53 | C54 | sing | 1.53Å | 1.52Å | |
| C54 | C55 | sing | 1.53Å | 1.52Å | |
| C54 | C56 | sing | 1.53Å | 1.53Å | |
| C56 | C57 | sing | 1.53Å | 1.53Å | |
| C57 | C58 | sing | 1.51Å | 1.50Å | |
| C58 | C59 | doub | 1.31Å | 1.34Å | |
| C59 | C60 | sing | 1.51Å | 1.51Å | |
| C60 | C61 | sing | 1.53Å | 1.53Å | |
| C61 | C62 | sing | 1.51Å | 1.50Å | |
| C62 | C63 | doub | 1.31Å | 1.34Å | |
| C63 | C64 | sing | 1.51Å | 1.51Å | |
| C63 | C65 | sing | 1.51Å | 1.51Å | |
| C65 | C66 | sing | 1.53Å | 1.53Å | |
| C66 | C67 | sing | 1.51Å | 1.50Å | |
| C67 | C68 | doub | 1.31Å | 1.33Å | |
| C68 | C69 | sing | 1.51Å | 1.51Å | |
| C69 | C70 | sing | 1.53Å | 1.53Å | |
| C70 | C71 | sing | 1.51Å | 1.50Å | |
| C71 | C72 | doub | 1.31Å | 1.33Å | |
| C72 | C73 | sing | 1.51Å | 1.50Å | |
| C72 | C74 | sing | 1.51Å | 1.50Å | |
| C68 | C75 | sing | 1.51Å | 1.50Å | |
| C59 | C76 | sing | 1.51Å | 1.51Å | |
| P2 | O47 | doub | 1.48Å | 1.48Å | |
| P1 | O48 | sing | 1.61Å | 1.48Å | |
| P1 | O49 | doub | 1.48Å | 1.48Å | |
| C51 | C77 | sing | 1.53Å | 1.53Å | |
| C77 | N1 | sing | 1.47Å | 1.46Å | |
| N1 | C78 | sing | 1.35Å | 1.33Å | |
| C78 | C79 | sing | 1.51Å | 1.50Å | |
| C78 | O50 | doub | 1.21Å | 1.22Å | |
| C48 | C80 | sing | 1.53Å | 1.53Å | |
| C80 | O51 | sing | 1.43Å | 1.42Å | |
| C47 | C81 | sing | 1.53Å | 1.52Å | |
| C81 | N2 | sing | 1.46Å | 1.46Å | |
| N2 | C82 | sing | 1.35Å | 1.33Å | |
| C82 | C83 | sing | 1.51Å | 1.50Å | |
| C82 | O52 | doub | 1.21Å | 1.22Å | |
| C1 | C81 | sing | 1.53Å | 1.53Å | |
| C4 | C32 | sing | 1.53Å | 1.53Å | |
| C8 | C18 | sing | 1.53Å | 1.53Å | |
| C12 | C16 | sing | 1.53Å | 1.52Å | |
| C20 | C30 | sing | 1.53Å | 1.52Å | |
| C22 | C26 | sing | 1.53Å | 1.52Å | |
| C33 | O34 | sing | 1.43Å | 1.43Å | |
| C35 | O30 | sing | 1.43Å | 1.43Å | |
| C77 | C80 | sing | 1.53Å | 1.53Å | |
| N1 | H130 | sing | 0.97Å | 1.00Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C24 | H37 | sing | 1.09Å | 1.10Å | |
| C26 | H41 | sing | 1.09Å | 1.10Å | |
| C28 | H44 | sing | 1.09Å | 1.10Å | |
| C28 | H45 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C33 | H54 | sing | 1.09Å | 1.10Å | |
| C32 | H53 | sing | 1.09Å | 1.10Å | |
| C31 | H51 | sing | 1.09Å | 1.10Å | |
| O3 | H6 | sing | 0.97Å | 0.95Å | |
| C25 | H39 | sing | 1.09Å | 1.10Å | |
| C23 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H56 | sing | 1.09Å | 1.10Å | |
| C27 | H43 | sing | 1.09Å | 1.10Å | |
| C29 | H47 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| N2 | H137 | sing | 0.97Å | 1.00Å | |
| C34 | H55 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H49 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C36 | H57 | sing | 1.09Å | 1.10Å | |
| C37 | H59 | sing | 1.09Å | 1.10Å | |
| C38 | H60 | sing | 1.09Å | 1.10Å | |
| C39 | H61 | sing | 1.09Å | 1.10Å | |
| C40 | H62 | sing | 1.09Å | 1.10Å | |
| C40 | H63 | sing | 1.09Å | 1.10Å | |
| C41 | H67 | sing | 1.09Å | 1.10Å | |
| C42 | H68 | sing | 1.09Å | 1.10Å | |
| C43 | H69 | sing | 1.09Å | 1.10Å | |
| C44 | H70 | sing | 1.09Å | 1.10Å | |
| C44 | H71 | sing | 1.09Å | 1.10Å | |
| C45 | H75 | sing | 1.09Å | 1.10Å | |
| C46 | H76 | sing | 1.09Å | 1.10Å | |
| C46 | H77 | sing | 1.09Å | 1.10Å | |
| C47 | H79 | sing | 1.09Å | 1.10Å | |
| C48 | H80 | sing | 1.09Å | 1.10Å | |
| C49 | H81 | sing | 1.09Å | 1.10Å | |
| C50 | H82 | sing | 1.09Å | 1.10Å | |
| C50 | H83 | sing | 1.09Å | 1.10Å | |
| C51 | H85 | sing | 1.09Å | 1.10Å | |
| C52 | H86 | sing | 1.09Å | 1.10Å | |
| C52 | H87 | sing | 1.09Å | 1.10Å | |
| C53 | H88 | sing | 1.09Å | 1.10Å | |
| C53 | H89 | sing | 1.09Å | 1.10Å | |
| C54 | H90 | sing | 1.09Å | 1.10Å | |
| C55 | H91 | sing | 1.09Å | 1.10Å | |
| C55 | H92 | sing | 1.09Å | 1.10Å | |
| C55 | H93 | sing | 1.09Å | 1.10Å | |
| C56 | H94 | sing | 1.09Å | 1.10Å | |
| C56 | H95 | sing | 1.09Å | 1.10Å | |
| C57 | H96 | sing | 1.09Å | 1.10Å | |
| C57 | H97 | sing | 1.09Å | 1.10Å | |
| C58 | H98 | sing | 1.08Å | 1.08Å | |
| C60 | H100 | sing | 1.09Å | 1.10Å | |
| C60 | H99 | sing | 1.09Å | 1.10Å | |
| C61 | H101 | sing | 1.09Å | 1.10Å | |
| C61 | H102 | sing | 1.09Å | 1.10Å | |
| C62 | H103 | sing | 1.08Å | 1.08Å | |
| C64 | H104 | sing | 1.09Å | 1.10Å | |
| C64 | H105 | sing | 1.09Å | 1.10Å | |
| C64 | H106 | sing | 1.09Å | 1.10Å | |
| C65 | H107 | sing | 1.09Å | 1.10Å | |
| C65 | H108 | sing | 1.09Å | 1.10Å | |
| C66 | H109 | sing | 1.09Å | 1.10Å | |
| C66 | H110 | sing | 1.09Å | 1.10Å | |
| C67 | H111 | sing | 1.08Å | 1.08Å | |
| C69 | H112 | sing | 1.09Å | 1.10Å | |
| C69 | H113 | sing | 1.09Å | 1.10Å | |
| C70 | H114 | sing | 1.09Å | 1.10Å | |
| C70 | H115 | sing | 1.09Å | 1.10Å | |
| C71 | H116 | sing | 1.08Å | 1.08Å | |
| C73 | H117 | sing | 1.09Å | 1.10Å | |
| C73 | H118 | sing | 1.09Å | 1.10Å | |
| C73 | H119 | sing | 1.09Å | 1.10Å | |
| C74 | H120 | sing | 1.09Å | 1.10Å | |
| C74 | H121 | sing | 1.09Å | 1.10Å | |
| C74 | H122 | sing | 1.09Å | 1.10Å | |
| C75 | H123 | sing | 1.09Å | 1.10Å | |
| C75 | H124 | sing | 1.09Å | 1.10Å | |
| C75 | H125 | sing | 1.09Å | 1.10Å | |
| C76 | H126 | sing | 1.09Å | 1.10Å | |
| C76 | H127 | sing | 1.09Å | 1.10Å | |
| C76 | H128 | sing | 1.09Å | 1.10Å | |
| C77 | H129 | sing | 1.09Å | 1.10Å | |
| C79 | H131 | sing | 1.09Å | 1.10Å | |
| C79 | H132 | sing | 1.09Å | 1.10Å | |
| C79 | H133 | sing | 1.09Å | 1.10Å | |
| C80 | H134 | sing | 1.09Å | 1.10Å | |
| C81 | H136 | sing | 1.09Å | 1.10Å | |
| C83 | H138 | sing | 1.09Å | 1.10Å | |
| C83 | H139 | sing | 1.09Å | 1.10Å | |
| C83 | H140 | sing | 1.09Å | 1.10Å | |
| O11 | H22 | sing | 0.97Å | 0.95Å | |
| O12 | H24 | sing | 0.97Å | 0.95Å | |
| O13 | H26 | sing | 0.97Å | 0.95Å | |
| O14 | H28 | sing | 0.97Å | 0.95Å | |
| O17 | H34 | sing | 0.97Å | 0.95Å | |
| O19 | H38 | sing | 0.97Å | 0.95Å | |
| O20 | H40 | sing | 0.97Å | 0.95Å | |
| O21 | H42 | sing | 0.97Å | 0.95Å | |
| O23 | H46 | sing | 0.97Å | 0.95Å | |
| O24 | H48 | sing | 0.97Å | 0.95Å | |
| O25 | H50 | sing | 0.97Å | 0.95Å | |
| O26 | H52 | sing | 0.97Å | 0.95Å | |
| O29 | H58 | sing | 0.97Å | 0.95Å | |
| O31 | H64 | sing | 0.97Å | 0.95Å | |
| O32 | H65 | sing | 0.97Å | 0.95Å | |
| O33 | H66 | sing | 0.97Å | 0.95Å | |
| O35 | H72 | sing | 0.97Å | 0.95Å | |
| O36 | H73 | sing | 0.97Å | 0.95Å | |
| O37 | H74 | sing | 0.97Å | 0.95Å | |
| O38 | H78 | sing | 0.97Å | 0.95Å | |
| O41 | H84 | sing | 0.97Å | 0.95Å | |
| O45 | H141 | sing | 0.97Å | 0.95Å | |
| O48 | H142 | sing | 0.97Å | 0.95Å | |
| O51 | H135 | sing | 0.97Å | 0.95Å | |
| O6 | H12 | sing | 0.97Å | 0.95Å | |
| O9 | H18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 113.1° | 109.6° |
| O1 | C1 | C81 | 107.3° | 109.5° |
| O1 | C1 | H2 | 109.7° | 109.6° |
| C1 | O1 | H1 | 109.5° | 114.0° |
| C1 | C2 | O2 | 111.4° | 109.5° |
| C1 | C2 | C45 | 106.4° | 109.2° |
| C2 | C1 | C81 | 110.0° | 109.0° |
| C2 | C1 | H2 | 108.4° | 109.5° |
| C1 | C2 | H3 | 109.9° | 109.5° |
| C2 | O2 | C3 | 119.1° | 114.0° |
| O2 | C2 | C45 | 108.0° | 109.5° |
| O2 | C2 | H3 | 111.2° | 109.5° |
| O2 | C3 | C4 | 108.2° | 109.5° |
| O2 | C3 | O4 | 113.9° | 109.5° |
| O2 | C3 | H4 | 109.1° | 109.5° |
| C3 | C4 | O3 | 110.0° | 109.5° |
| C4 | C3 | O4 | 109.4° | 109.4° |
| C3 | C4 | C32 | 109.2° | 109.2° |
| C3 | C4 | H5 | 108.8° | 109.6° |
| C4 | C3 | H4 | 107.4° | 109.4° |
| O3 | C4 | C32 | 110.0° | 109.6° |
| O3 | C4 | H5 | 110.1° | 109.5° |
| C4 | O3 | H6 | 109.5° | 114.0° |
| C3 | O4 | C5 | 111.7° | 114.1° |
| O4 | C3 | H4 | 108.6° | 109.5° |
| O4 | C5 | C6 | 107.1° | 109.5° |
| O4 | C5 | C31 | 109.4° | 109.5° |
| O4 | C5 | H7 | 110.1° | 109.4° |
| C5 | C6 | O5 | 108.3° | 109.4° |
| C6 | C5 | C31 | 112.2° | 109.5° |
| C6 | C5 | H7 | 109.1° | 109.5° |
| C5 | C6 | H8 | 109.8° | 109.4° |
| C5 | C6 | H9 | 109.8° | 109.5° |
| C6 | O5 | C7 | 115.8° | 114.0° |
| O5 | C6 | H8 | 109.8° | 109.5° |
| O5 | C6 | H9 | 109.7° | 109.5° |
| O5 | C7 | C8 | 107.0° | 109.5° |
| O5 | C7 | O7 | 111.5° | 109.4° |
| O5 | C7 | H10 | 110.1° | 109.5° |
| C7 | C8 | O6 | 110.2° | 109.5° |
| C8 | C7 | O7 | 109.9° | 109.4° |
| C7 | C8 | C18 | 108.3° | 109.2° |
| C8 | C7 | H10 | 108.4° | 109.6° |
| C7 | C8 | H11 | 108.8° | 109.5° |
| O6 | C8 | C18 | 110.5° | 109.5° |
| O6 | C8 | H11 | 110.2° | 109.5° |
| C8 | O6 | H12 | 109.5° | 114.0° |
| C7 | O7 | C9 | 114.4° | 114.1° |
| O7 | C7 | H10 | 109.8° | 109.5° |
| O7 | C9 | C10 | 107.7° | 109.5° |
| O7 | C9 | C17 | 111.9° | 109.4° |
| O7 | C9 | H13 | 108.9° | 109.5° |
| C9 | C10 | O8 | 110.2° | 109.5° |
| C10 | C9 | C17 | 112.6° | 109.5° |
| C9 | C10 | H14 | 109.3° | 109.5° |
| C9 | C10 | H15 | 109.3° | 109.5° |
| C10 | C9 | H13 | 107.9° | 109.4° |
| C10 | O8 | C11 | 115.5° | 114.0° |
| O8 | C10 | H14 | 109.3° | 109.5° |
| O8 | C10 | H15 | 109.3° | 109.5° |
| O8 | C11 | C12 | 108.1° | 109.4° |
| O8 | C11 | O10 | 111.8° | 109.5° |
| O8 | C11 | H16 | 109.4° | 109.5° |
| C11 | C12 | O9 | 109.9° | 109.5° |
| C12 | C11 | O10 | 110.5° | 109.4° |
| C11 | C12 | C16 | 110.4° | 109.2° |
| C12 | C11 | H16 | 107.8° | 109.5° |
| C11 | C12 | H17 | 108.1° | 109.5° |
| O9 | C12 | C16 | 110.7° | 109.5° |
| O9 | C12 | H17 | 109.5° | 109.5° |
| C12 | O9 | H18 | 109.5° | 114.0° |
| C11 | O10 | C13 | 113.7° | 114.1° |
| O10 | C11 | H16 | 109.1° | 109.5° |
| O10 | C13 | C14 | 106.7° | 109.5° |
| O10 | C13 | C15 | 109.9° | 109.4° |
| O10 | C13 | H19 | 109.9° | 109.5° |
| C13 | C14 | O11 | 111.3° | 109.5° |
| C14 | C13 | C15 | 112.7° | 109.4° |
| C14 | C13 | H19 | 108.9° | 109.5° |
| C13 | C14 | H20 | 109.0° | 109.5° |
| C13 | C14 | H21 | 109.0° | 109.5° |
| O11 | C14 | H20 | 109.0° | 109.5° |
| O11 | C14 | H21 | 109.0° | 109.4° |
| C14 | O11 | H22 | 109.5° | 114.0° |
| C13 | C15 | O12 | 109.6° | 109.5° |
| C13 | C15 | C16 | 109.9° | 109.1° |
| C15 | C13 | H19 | 108.7° | 109.5° |
| C13 | C15 | H23 | 108.7° | 109.5° |
| O12 | C15 | C16 | 110.0° | 109.6° |
| O12 | C15 | H23 | 110.0° | 109.6° |
| C15 | O12 | H24 | 109.5° | 114.0° |
| C15 | C16 | O13 | 110.4° | 109.6° |
| C15 | C16 | C12 | 110.8° | 109.1° |
| C16 | C15 | H23 | 108.7° | 109.6° |
| C15 | C16 | H25 | 108.2° | 109.6° |
| O13 | C16 | C12 | 109.6° | 109.5° |
| O13 | C16 | H25 | 109.5° | 109.5° |
| C16 | O13 | H26 | 109.5° | 114.0° |
| C9 | C17 | O14 | 107.8° | 109.5° |
| C9 | C17 | C18 | 109.5° | 109.2° |
| C9 | C17 | H27 | 109.0° | 109.6° |
| C17 | C9 | H13 | 107.7° | 109.5° |
| O14 | C17 | C18 | 111.1° | 109.6° |
| O14 | C17 | H27 | 110.4° | 109.5° |
| C17 | O14 | H28 | 109.5° | 114.0° |
| C17 | C18 | O15 | 110.4° | 109.5° |
| C17 | C18 | C8 | 109.7° | 109.0° |
| C18 | C17 | H27 | 109.0° | 109.6° |
| C17 | C18 | H29 | 109.0° | 109.5° |
| C18 | O15 | C19 | 116.8° | 114.0° |
| O15 | C18 | C8 | 108.5° | 109.5° |
| O15 | C18 | H29 | 110.2° | 109.6° |
| O15 | C19 | C20 | 107.4° | 109.5° |
| O15 | C19 | O22 | 110.0° | 109.5° |
| O15 | C19 | H30 | 109.9° | 109.5° |
| C19 | C20 | O16 | 106.4° | 109.5° |
| C20 | C19 | O22 | 112.1° | 109.4° |
| C19 | C20 | C30 | 109.7° | 109.2° |
| C19 | C20 | H31 | 110.6° | 109.5° |
| C20 | C19 | H30 | 108.0° | 109.5° |
| C20 | O16 | C21 | 121.7° | 114.0° |
| O16 | C20 | C30 | 107.3° | 109.5° |
| O16 | C20 | H31 | 111.9° | 109.5° |
| O16 | C21 | C22 | 108.4° | 109.5° |
| O16 | C21 | O18 | 111.6° | 109.5° |
| O16 | C21 | H32 | 109.9° | 109.5° |
| C21 | C22 | O17 | 110.1° | 109.5° |
| C22 | C21 | O18 | 109.3° | 109.4° |
| C21 | C22 | C26 | 109.5° | 109.2° |
| C22 | C21 | H32 | 108.2° | 109.5° |
| C21 | C22 | H33 | 108.4° | 109.5° |
| O17 | C22 | C26 | 110.6° | 109.5° |
| O17 | C22 | H33 | 109.7° | 109.5° |
| C22 | O17 | H34 | 109.5° | 114.0° |
| C21 | O18 | C23 | 113.2° | 114.1° |
| O18 | C21 | H32 | 109.4° | 109.5° |
| O18 | C23 | C24 | 106.9° | 109.5° |
| O18 | C23 | C25 | 111.4° | 109.4° |
| O18 | C23 | H35 | 109.2° | 109.5° |
| C23 | C24 | O19 | 109.9° | 109.4° |
| C24 | C23 | C25 | 113.2° | 109.5° |
| C23 | C24 | H36 | 109.4° | 109.5° |
| C23 | C24 | H37 | 109.4° | 109.4° |
| C24 | C23 | H35 | 108.2° | 109.5° |
| O19 | C24 | H36 | 109.3° | 109.5° |
| O19 | C24 | H37 | 109.3° | 109.5° |
| C24 | O19 | H38 | 109.5° | 114.0° |
| C23 | C25 | O20 | 109.2° | 109.5° |
| C23 | C25 | C26 | 110.7° | 109.1° |
| C23 | C25 | H39 | 108.4° | 109.5° |
| C25 | C23 | H35 | 108.0° | 109.5° |
| O20 | C25 | C26 | 110.1° | 109.6° |
| O20 | C25 | H39 | 109.8° | 109.5° |
| C25 | O20 | H40 | 109.5° | 114.0° |
| C25 | C26 | O21 | 110.1° | 109.5° |
| C25 | C26 | C22 | 110.8° | 109.1° |
| C25 | C26 | H41 | 108.3° | 109.6° |
| C26 | C25 | H39 | 108.6° | 109.5° |
| O21 | C26 | C22 | 109.7° | 109.6° |
| O21 | C26 | H41 | 109.6° | 109.5° |
| C26 | O21 | H42 | 109.5° | 114.0° |
| C19 | O22 | C27 | 113.4° | 114.1° |
| O22 | C19 | H30 | 109.5° | 109.5° |
| O22 | C27 | C28 | 107.1° | 109.4° |
| O22 | C27 | C29 | 107.4° | 109.4° |
| O22 | C27 | H43 | 110.3° | 109.5° |
| C27 | C28 | O23 | 111.0° | 109.5° |
| C28 | C27 | C29 | 113.8° | 109.5° |
| C27 | C28 | H44 | 109.1° | 109.5° |
| C27 | C28 | H45 | 109.1° | 109.5° |
| C28 | C27 | H43 | 109.2° | 109.5° |
| O23 | C28 | H44 | 109.1° | 109.4° |
| O23 | C28 | H45 | 109.1° | 109.5° |
| C28 | O23 | H46 | 109.5° | 114.0° |
| C27 | C29 | O24 | 109.7° | 109.5° |
| C27 | C29 | C30 | 107.5° | 109.2° |
| C29 | C27 | H43 | 109.0° | 109.5° |
| C27 | C29 | H47 | 109.3° | 109.6° |
| O24 | C29 | C30 | 110.2° | 109.5° |
| O24 | C29 | H47 | 110.7° | 109.6° |
| C29 | O24 | H48 | 109.5° | 114.0° |
| C29 | C30 | O25 | 110.4° | 109.5° |
| C29 | C30 | C20 | 108.3° | 109.1° |
| C30 | C29 | H47 | 109.4° | 109.5° |
| C29 | C30 | H49 | 109.1° | 109.5° |
| O25 | C30 | C20 | 109.6° | 109.6° |
| O25 | C30 | H49 | 110.3° | 109.6° |
| C30 | O25 | H50 | 109.5° | 114.0° |
| C5 | C31 | O26 | 109.2° | 109.6° |
| C5 | C31 | C32 | 110.3° | 109.1° |
| C31 | C5 | H7 | 108.9° | 109.5° |
| C5 | C31 | H51 | 108.5° | 109.5° |
| O26 | C31 | C32 | 110.5° | 109.5° |
| O26 | C31 | H51 | 109.8° | 109.6° |
| C31 | O26 | H52 | 109.5° | 113.9° |
| C31 | C32 | O27 | 109.0° | 109.5° |
| C31 | C32 | C4 | 111.4° | 109.1° |
| C31 | C32 | H53 | 109.4° | 109.6° |
| C32 | C31 | H51 | 108.5° | 109.5° |
| C32 | O27 | C33 | 114.9° | 114.0° |
| O27 | C32 | C4 | 106.9° | 109.5° |
| O27 | C32 | H53 | 110.7° | 109.5° |
| O27 | C33 | C34 | 108.1° | 109.5° |
| O27 | C33 | O34 | 109.6° | 109.5° |
| O27 | C33 | H54 | 110.3° | 109.5° |
| C33 | C34 | O28 | 104.1° | 109.5° |
| C33 | C34 | C41 | 106.7° | 109.2° |
| C34 | C33 | O34 | 110.6° | 109.4° |
| C34 | C33 | H54 | 108.4° | 109.5° |
| C33 | C34 | H55 | 110.9° | 109.5° |
| C34 | O28 | C35 | 118.4° | 114.0° |
| O28 | C34 | C41 | 111.6° | 109.6° |
| O28 | C34 | H55 | 112.1° | 109.5° |
| O28 | C35 | C36 | 108.7° | 109.5° |
| O28 | C35 | O30 | 109.2° | 109.5° |
| O28 | C35 | H56 | 110.4° | 109.5° |
| C35 | C36 | O29 | 110.3° | 109.5° |
| C35 | C36 | C37 | 108.4° | 109.1° |
| C36 | C35 | O30 | 110.0° | 109.4° |
| C36 | C35 | H56 | 108.6° | 109.5° |
| C35 | C36 | H57 | 108.6° | 109.5° |
| O29 | C36 | C37 | 110.8° | 109.5° |
| O29 | C36 | H57 | 110.0° | 109.5° |
| C36 | O29 | H58 | 109.5° | 114.0° |
| C36 | C37 | C38 | 108.2° | 109.1° |
| C36 | C37 | O33 | 109.8° | 109.5° |
| C37 | C36 | H57 | 108.7° | 109.6° |
| C36 | C37 | H59 | 108.8° | 109.5° |
| C37 | C38 | C39 | 106.4° | 109.1° |
| C37 | C38 | O32 | 110.4° | 109.5° |
| C38 | C37 | O33 | 110.9° | 109.6° |
| C38 | C37 | H59 | 108.9° | 109.6° |
| C37 | C38 | H60 | 109.8° | 109.5° |
| C38 | C39 | O30 | 108.9° | 109.5° |
| C38 | C39 | C40 | 114.1° | 109.4° |
| C39 | C38 | O32 | 109.6° | 109.5° |
| C39 | C38 | H60 | 109.6° | 109.5° |
| C38 | C39 | H61 | 108.6° | 109.5° |
| O30 | C39 | C40 | 106.8° | 109.5° |
| C39 | O30 | C35 | 113.2° | 114.1° |
| O30 | C39 | H61 | 109.7° | 109.5° |
| C39 | C40 | O31 | 109.9° | 109.5° |
| C40 | C39 | H61 | 108.8° | 109.5° |
| C39 | C40 | H62 | 109.4° | 109.5° |
| C39 | C40 | H63 | 109.4° | 109.5° |
| O31 | C40 | H62 | 109.3° | 109.5° |
| O31 | C40 | H63 | 109.4° | 109.4° |
| C40 | O31 | H64 | 109.5° | 114.0° |
| O32 | C38 | H60 | 111.0° | 109.6° |
| C38 | O32 | H65 | 109.5° | 114.0° |
| O33 | C37 | H59 | 110.1° | 109.6° |
| C37 | O33 | H66 | 109.5° | 114.1° |
| C34 | C41 | C42 | 107.9° | 109.0° |
| C34 | C41 | O37 | 111.4° | 109.5° |
| C41 | C34 | H55 | 111.1° | 109.6° |
| C34 | C41 | H67 | 108.2° | 109.6° |
| C41 | C42 | C43 | 109.3° | 109.1° |
| C41 | C42 | O36 | 109.9° | 109.5° |
| C42 | C41 | O37 | 111.6° | 109.5° |
| C42 | C41 | H67 | 108.2° | 109.5° |
| C41 | C42 | H68 | 109.0° | 109.5° |
| C42 | C43 | O34 | 111.3° | 109.4° |
| C42 | C43 | C44 | 113.1° | 109.4° |
| C43 | C42 | O36 | 109.4° | 109.6° |
| C43 | C42 | H68 | 108.8° | 109.5° |
| C42 | C43 | H69 | 108.1° | 109.5° |
| O34 | C43 | C44 | 106.7° | 109.5° |
| C43 | O34 | C33 | 114.1° | 114.1° |
| O34 | C43 | H69 | 109.2° | 109.5° |
| C43 | C44 | O35 | 111.2° | 109.5° |
| C44 | C43 | H69 | 108.3° | 109.5° |
| C43 | C44 | H70 | 109.0° | 109.5° |
| C43 | C44 | H71 | 109.0° | 109.5° |
| O35 | C44 | H70 | 109.1° | 109.4° |
| O35 | C44 | H71 | 109.1° | 109.5° |
| C44 | O35 | H72 | 109.5° | 114.0° |
| O36 | C42 | H68 | 110.3° | 109.5° |
| C42 | O36 | H73 | 109.5° | 114.0° |
| O37 | C41 | H67 | 109.4° | 109.6° |
| C41 | O37 | H74 | 109.5° | 114.0° |
| C2 | C45 | C46 | 113.3° | 109.5° |
| C2 | C45 | O39 | 109.0° | 109.4° |
| C45 | C2 | H3 | 109.8° | 109.6° |
| C2 | C45 | H75 | 108.8° | 109.4° |
| C45 | C46 | O38 | 111.0° | 109.5° |
| C46 | C45 | O39 | 106.8° | 109.5° |
| C46 | C45 | H75 | 108.9° | 109.5° |
| C45 | C46 | H76 | 109.1° | 109.5° |
| C45 | C46 | H77 | 109.1° | 109.5° |
| O38 | C46 | H76 | 109.1° | 109.4° |
| O38 | C46 | H77 | 109.1° | 109.4° |
| C46 | O38 | H78 | 109.5° | 114.0° |
| C45 | O39 | C47 | 114.5° | 114.1° |
| O39 | C45 | H75 | 110.0° | 109.5° |
| O39 | C47 | O40 | 111.3° | 109.5° |
| O39 | C47 | C81 | 110.2° | 109.4° |
| O39 | C47 | H79 | 109.3° | 109.5° |
| C47 | O40 | C48 | 123.2° | 114.0° |
| O40 | C47 | C81 | 108.3° | 109.5° |
| O40 | C47 | H79 | 109.6° | 109.5° |
| O40 | C48 | C49 | 107.0° | 109.5° |
| O40 | C48 | C80 | 113.4° | 109.5° |
| O40 | C48 | H80 | 109.6° | 109.6° |
| C48 | C49 | C50 | 113.1° | 109.5° |
| C48 | C49 | O42 | 109.7° | 109.4° |
| C49 | C48 | C80 | 110.0° | 109.2° |
| C49 | C48 | H80 | 108.4° | 109.5° |
| C48 | C49 | H81 | 108.5° | 109.5° |
| C49 | C50 | O41 | 111.2° | 109.5° |
| C50 | C49 | O42 | 107.0° | 109.5° |
| C50 | C49 | H81 | 108.7° | 109.5° |
| C49 | C50 | H82 | 109.0° | 109.4° |
| C49 | C50 | H83 | 109.0° | 109.5° |
| O41 | C50 | H82 | 109.0° | 109.5° |
| O41 | C50 | H83 | 109.0° | 109.5° |
| C50 | O41 | H84 | 109.5° | 114.0° |
| C49 | O42 | C51 | 112.1° | 114.1° |
| O42 | C49 | H81 | 109.7° | 109.5° |
| O42 | C51 | O43 | 109.1° | 109.5° |
| O42 | C51 | C77 | 107.8° | 109.4° |
| O42 | C51 | H85 | 110.9° | 109.5° |
| C51 | O43 | P1 | 124.3° | 123.0° |
| O43 | C51 | C77 | 108.7° | 109.5° |
| O43 | C51 | H85 | 111.0° | 109.5° |
| O43 | P1 | O44 | 105.4° | 109.4° |
| O43 | P1 | O48 | 109.1° | 109.5° |
| O43 | P1 | O49 | 107.9° | 109.4° |
| P1 | O44 | P2 | 131.2° | 134.0° |
| O44 | P1 | O48 | 109.7° | 109.5° |
| O44 | P1 | O49 | 107.7° | 109.5° |
| O44 | P2 | O45 | 109.2° | 109.5° |
| O44 | P2 | O46 | 104.0° | 109.5° |
| O44 | P2 | O47 | 108.3° | 109.5° |
| O45 | P2 | O46 | 109.5° | 109.5° |
| O45 | P2 | O47 | 117.7° | 109.5° |
| P2 | O45 | H141 | 109.5° | 114.0° |
| P2 | O46 | C52 | 121.8° | 123.0° |
| O46 | P2 | O47 | 107.3° | 109.4° |
| O46 | C52 | C53 | 109.3° | 109.5° |
| O46 | C52 | H86 | 109.5° | 109.5° |
| O46 | C52 | H87 | 109.5° | 109.5° |
| C52 | C53 | C54 | 116.8° | 109.5° |
| C53 | C52 | H86 | 109.5° | 109.4° |
| C53 | C52 | H87 | 109.5° | 109.4° |
| C52 | C53 | H88 | 107.6° | 109.5° |
| C52 | C53 | H89 | 107.6° | 109.4° |
| C53 | C54 | C55 | 110.4° | 109.5° |
| C53 | C54 | C56 | 112.9° | 109.5° |
| C54 | C53 | H88 | 107.6° | 109.5° |
| C54 | C53 | H89 | 107.6° | 109.5° |
| C53 | C54 | H90 | 107.5° | 109.5° |
| C55 | C54 | C56 | 111.2° | 109.4° |
| C55 | C54 | H90 | 107.3° | 109.5° |
| C54 | C55 | H91 | 109.5° | 109.5° |
| C54 | C55 | H92 | 109.5° | 109.4° |
| C54 | C55 | H93 | 109.5° | 109.4° |
| C54 | C56 | C57 | 114.6° | 109.5° |
| C56 | C54 | H90 | 107.3° | 109.5° |
| C54 | C56 | H94 | 108.2° | 109.5° |
| C54 | C56 | H95 | 108.2° | 109.4° |
| C56 | C57 | C58 | 112.2° | 109.5° |
| C57 | C56 | H94 | 108.2° | 109.5° |
| C57 | C56 | H95 | 108.2° | 109.5° |
| C56 | C57 | H96 | 108.8° | 109.5° |
| C56 | C57 | H97 | 108.8° | 109.4° |
| C57 | C58 | C59 | 130.0° | 120.0° |
| C58 | C57 | H96 | 108.8° | 109.5° |
| C58 | C57 | H97 | 108.8° | 109.4° |
| C57 | C58 | H98 | 115.0° | 120.1° |
| C58 | C59 | C60 | 122.6° | 120.0° |
| C58 | C59 | C76 | 123.1° | 120.0° |
| C59 | C58 | H98 | 115.0° | 120.0° |
| C59 | C60 | C61 | 118.1° | 109.4° |
| C60 | C59 | C76 | 114.3° | 120.0° |
| C59 | C60 | H100 | 107.3° | 109.4° |
| C59 | C60 | H99 | 107.3° | 109.5° |
| C60 | C61 | C62 | 115.7° | 109.5° |
| C61 | C60 | H100 | 107.3° | 109.5° |
| C61 | C60 | H99 | 107.3° | 109.5° |
| C60 | C61 | H101 | 107.9° | 109.5° |
| C60 | C61 | H102 | 107.9° | 109.5° |
| C61 | C62 | C63 | 129.9° | 120.0° |
| C62 | C61 | H101 | 107.9° | 109.4° |
| C62 | C61 | H102 | 107.9° | 109.5° |
| C61 | C62 | H103 | 115.0° | 120.0° |
| C62 | C63 | C64 | 124.6° | 120.1° |
| C62 | C63 | C65 | 120.4° | 120.0° |
| C63 | C62 | H103 | 115.0° | 120.0° |
| C64 | C63 | C65 | 114.9° | 120.0° |
| C63 | C64 | H104 | 109.5° | 109.4° |
| C63 | C64 | H105 | 109.5° | 109.5° |
| C63 | C64 | H106 | 109.5° | 109.4° |
| C63 | C65 | C66 | 115.3° | 109.5° |
| C63 | C65 | H107 | 108.0° | 109.5° |
| C63 | C65 | H108 | 108.0° | 109.5° |
| C65 | C66 | C67 | 112.2° | 109.5° |
| C66 | C65 | H107 | 108.0° | 109.5° |
| C66 | C65 | H108 | 108.0° | 109.5° |
| C65 | C66 | H109 | 108.8° | 109.4° |
| C65 | C66 | H110 | 108.8° | 109.5° |
| C66 | C67 | C68 | 128.5° | 120.0° |
| C67 | C66 | H109 | 108.8° | 109.5° |
| C67 | C66 | H110 | 108.8° | 109.5° |
| C66 | C67 | H111 | 115.8° | 120.0° |
| C67 | C68 | C69 | 121.2° | 120.0° |
| C67 | C68 | C75 | 124.0° | 120.0° |
| C68 | C67 | H111 | 115.7° | 120.0° |
| C68 | C69 | C70 | 115.6° | 109.5° |
| C69 | C68 | C75 | 114.9° | 120.0° |
| C68 | C69 | H112 | 107.9° | 109.5° |
| C68 | C69 | H113 | 107.9° | 109.5° |
| C69 | C70 | C71 | 114.3° | 109.5° |
| C70 | C69 | H112 | 107.9° | 109.5° |
| C70 | C69 | H113 | 107.9° | 109.4° |
| C69 | C70 | H114 | 108.3° | 109.5° |
| C69 | C70 | H115 | 108.2° | 109.5° |
| C70 | C71 | C72 | 128.0° | 120.0° |
| C71 | C70 | H114 | 108.3° | 109.4° |
| C71 | C70 | H115 | 108.3° | 109.5° |
| C70 | C71 | H116 | 116.0° | 120.0° |
| C71 | C72 | C73 | 122.9° | 120.0° |
| C71 | C72 | C74 | 122.6° | 120.0° |
| C72 | C71 | H116 | 116.0° | 120.0° |
| C73 | C72 | C74 | 114.6° | 120.0° |
| C72 | C73 | H117 | 109.5° | 109.5° |
| C72 | C73 | H118 | 109.5° | 109.5° |
| C72 | C73 | H119 | 109.5° | 109.5° |
| C72 | C74 | H120 | 109.5° | 109.4° |
| C72 | C74 | H121 | 109.5° | 109.5° |
| C72 | C74 | H122 | 109.5° | 109.5° |
| C68 | C75 | H123 | 109.5° | 109.4° |
| C68 | C75 | H124 | 109.5° | 109.5° |
| C68 | C75 | H125 | 109.5° | 109.5° |
| C59 | C76 | H126 | 109.5° | 109.5° |
| C59 | C76 | H127 | 109.5° | 109.4° |
| C59 | C76 | H128 | 109.5° | 109.5° |
| O48 | P1 | O49 | 116.4° | 109.5° |
| P1 | O48 | H142 | 109.5° | 114.0° |
| C51 | C77 | N1 | 111.3° | 109.5° |
| C51 | C77 | C80 | 110.7° | 109.2° |
| C77 | C51 | H85 | 109.2° | 109.5° |
| C51 | C77 | H129 | 107.4° | 109.5° |
| C77 | N1 | C78 | 122.2° | 120.0° |
| N1 | C77 | C80 | 111.5° | 109.5° |
| C77 | N1 | H130 | 118.9° | 120.0° |
| N1 | C77 | H129 | 108.3° | 109.5° |
| N1 | C78 | C79 | 116.1° | 120.0° |
| N1 | C78 | O50 | 122.1° | 120.0° |
| C78 | N1 | H130 | 118.9° | 120.0° |
| C79 | C78 | O50 | 121.8° | 120.0° |
| C78 | C79 | H131 | 109.5° | 109.5° |
| C78 | C79 | H132 | 109.4° | 109.5° |
| C78 | C79 | H133 | 109.4° | 109.4° |
| C48 | C80 | O51 | 111.1° | 109.5° |
| C48 | C80 | C77 | 110.7° | 109.0° |
| C80 | C48 | H80 | 108.4° | 109.5° |
| C48 | C80 | H134 | 108.4° | 109.5° |
| O51 | C80 | C77 | 108.3° | 109.6° |
| O51 | C80 | H134 | 109.9° | 109.6° |
| C80 | O51 | H135 | 109.5° | 114.0° |
| C47 | C81 | N2 | 111.2° | 109.5° |
| C47 | C81 | C1 | 108.7° | 109.2° |
| C81 | C47 | H79 | 108.0° | 109.5° |
| C47 | C81 | H136 | 108.5° | 109.6° |
| C81 | N2 | C82 | 122.5° | 120.0° |
| N2 | C81 | C1 | 110.8° | 109.5° |
| C81 | N2 | H137 | 118.8° | 120.0° |
| N2 | C81 | H136 | 109.3° | 109.6° |
| N2 | C82 | C83 | 115.9° | 120.0° |
| N2 | C82 | O52 | 122.2° | 120.0° |
| C82 | N2 | H137 | 118.7° | 120.0° |
| C83 | C82 | O52 | 121.9° | 120.0° |
| C82 | C83 | H138 | 109.5° | 109.5° |
| C82 | C83 | H139 | 109.5° | 109.5° |
| C82 | C83 | H140 | 109.5° | 109.5° |
| C81 | C1 | H2 | 108.3° | 109.6° |
| C1 | C81 | H136 | 108.4° | 109.5° |
| C32 | C4 | H5 | 108.7° | 109.5° |
| C4 | C32 | H53 | 109.4° | 109.6° |
| C18 | C8 | H11 | 108.8° | 109.6° |
| C8 | C18 | H29 | 109.0° | 109.6° |
| C12 | C16 | H25 | 108.2° | 109.6° |
| C16 | C12 | H17 | 108.2° | 109.6° |
| C30 | C20 | H31 | 110.8° | 109.6° |
| C20 | C30 | H49 | 109.1° | 109.6° |
| C26 | C22 | H33 | 108.5° | 109.6° |
| C22 | C26 | H41 | 108.3° | 109.6° |
| O34 | C33 | H54 | 109.8° | 109.5° |
| O30 | C35 | H56 | 109.9° | 109.5° |
| C80 | C77 | H129 | 107.4° | 109.6° |
| C77 | C80 | H134 | 108.4° | 109.6° |
| H8 | C6 | H9 | 109.5° | 109.5° |
| H14 | C10 | H15 | 109.5° | 109.4° |
| H36 | C24 | H37 | 109.5° | 109.5° |
| H44 | C28 | H45 | 109.5° | 109.5° |
| H20 | C14 | H21 | 109.5° | 109.5° |
| H62 | C40 | H63 | 109.5° | 109.5° |
| H70 | C44 | H71 | 109.5° | 109.5° |
| H76 | C46 | H77 | 109.5° | 109.5° |
| H82 | C50 | H83 | 109.5° | 109.5° |
| H86 | C52 | H87 | 109.5° | 109.5° |
| H88 | C53 | H89 | 109.4° | 109.4° |
| H91 | C55 | H92 | 109.4° | 109.5° |
| H91 | C55 | H93 | 109.5° | 109.5° |
| H92 | C55 | H93 | 109.5° | 109.5° |
| H94 | C56 | H95 | 109.5° | 109.5° |
| H96 | C57 | H97 | 109.5° | 109.5° |
| H100 | C60 | H99 | 109.5° | 109.5° |
| H101 | C61 | H102 | 109.5° | 109.4° |
| H104 | C64 | H105 | 109.5° | 109.5° |
| H104 | C64 | H106 | 109.4° | 109.5° |
| H105 | C64 | H106 | 109.5° | 109.5° |
| H107 | C65 | H108 | 109.5° | 109.5° |
| H109 | C66 | H110 | 109.5° | 109.5° |
| H112 | C69 | H113 | 109.5° | 109.5° |
| H114 | C70 | H115 | 109.5° | 109.5° |
| H117 | C73 | H118 | 109.4° | 109.5° |
| H117 | C73 | H119 | 109.5° | 109.5° |
| H118 | C73 | H119 | 109.5° | 109.4° |
| H120 | C74 | H121 | 109.5° | 109.5° |
| H120 | C74 | H122 | 109.4° | 109.5° |
| H121 | C74 | H122 | 109.5° | 109.4° |
| H123 | C75 | H124 | 109.5° | 109.5° |
| H123 | C75 | H125 | 109.4° | 109.5° |
| H124 | C75 | H125 | 109.4° | 109.5° |
| H126 | C76 | H127 | 109.4° | 109.5° |
| H126 | C76 | H128 | 109.5° | 109.5° |
| H127 | C76 | H128 | 109.5° | 109.5° |
| H131 | C79 | H132 | 109.5° | 109.5° |
| H131 | C79 | H133 | 109.5° | 109.5° |
| H132 | C79 | H133 | 109.5° | 109.5° |
| H138 | C83 | H139 | 109.4° | 109.4° |
| H138 | C83 | H140 | 109.5° | 109.4° |
| H139 | C83 | H140 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | C81 | 119.9° | 119.9° |
| O1 | C1 | C2 | H2 | 121.8° | 120.3° |
| O1 | C1 | C2 | O2 | 62.0° | 63.2° |
| O1 | C1 | C2 | C45 | 179.4° | 176.8° |
| O1 | C1 | C81 | C47 | 178.3° | 176.9° |
| O1 | C1 | C81 | N2 | 55.9° | 63.2° |
| O1 | C1 | C81 | H2 | 118.3° | 120.3° |
| O1 | C1 | C2 | H3 | 61.7° | 56.9° |
| O1 | C1 | C81 | H136 | 64.0° | 56.9° |
| C1 | C2 | O2 | C45 | 116.5° | 119.8° |
| C1 | C2 | O2 | H3 | 122.9° | 120.1° |
| C1 | C2 | O2 | C3 | 76.4° | 132.9° |
| C1 | C2 | C45 | H3 | 118.9° | 120.0° |
| C1 | C2 | C45 | C46 | 179.2° | 177.6° |
| C1 | C2 | C45 | O39 | 60.4° | 57.6° |
| C2 | C1 | C81 | C47 | 58.2° | 57.0° |
| C2 | C1 | C81 | N2 | 179.3° | 176.9° |
| C2 | C1 | C81 | H2 | 118.3° | 119.8° |
| C2 | C1 | O1 | H1 | 180.0° | 180.0° |
| C1 | C2 | C45 | H75 | 59.5° | 62.4° |
| C2 | C1 | C81 | H136 | 59.4° | 63.0° |
| C2 | O2 | C3 | C4 | 65.5° | 172.8° |
| C2 | O2 | C3 | O4 | 172.6° | 67.2° |
| O2 | C2 | C45 | H3 | 121.4° | 120.1° |
| O2 | C2 | C45 | C46 | 61.1° | 62.5° |
| O2 | C2 | C45 | O39 | 179.9° | 177.5° |
| O2 | C2 | C1 | C81 | 178.1° | 176.9° |
| O2 | C2 | C1 | H2 | 59.8° | 57.1° |
| C2 | O2 | C3 | H4 | 51.1° | 52.8° |
| O2 | C2 | C45 | H75 | 60.2° | 57.6° |
| O2 | C3 | C4 | O4 | 124.7° | 120.0° |
| O2 | C3 | C4 | H4 | 117.6° | 120.0° |
| O2 | C3 | C4 | O3 | 62.5° | 57.7° |
| O2 | C3 | O4 | H4 | 121.8° | 120.1° |
| O2 | C3 | O4 | C5 | 172.8° | 178.9° |
| C3 | O2 | C2 | C45 | 167.0° | 107.3° |
| O2 | C3 | C4 | C32 | 176.6° | 177.6° |
| O2 | C3 | C4 | H5 | 58.2° | 62.4° |
| C3 | O2 | C2 | H3 | 46.5° | 12.8° |
| C3 | C4 | O3 | C32 | 120.3° | 119.7° |
| C3 | C4 | O3 | H5 | 119.9° | 120.1° |
| C4 | C3 | O4 | H4 | 116.9° | 119.9° |
| C4 | C3 | O4 | C5 | 66.0° | 61.1° |
| C3 | C4 | C32 | C31 | 52.4° | 57.0° |
| C3 | C4 | C32 | O27 | 171.3° | 176.8° |
| C3 | C4 | C32 | H5 | 118.5° | 120.0° |
| C3 | C4 | C32 | H53 | 68.7° | 63.0° |
| C3 | C4 | O3 | H6 | 180.0° | 60.3° |
| O3 | C4 | C3 | O4 | 62.1° | 62.4° |
| O3 | C4 | C32 | C31 | 68.5° | 62.9° |
| O3 | C4 | C32 | O27 | 50.5° | 56.9° |
| O3 | C4 | C32 | H5 | 120.6° | 120.1° |
| O3 | C4 | C3 | H4 | 179.8° | 177.7° |
| O3 | C4 | C32 | H53 | 170.4° | 177.1° |
| C3 | O4 | C5 | C6 | 174.4° | 178.9° |
| C3 | O4 | C5 | C31 | 63.8° | 61.1° |
| O4 | C3 | C4 | C32 | 58.7° | 57.6° |
| O4 | C3 | C4 | H5 | 177.1° | 177.5° |
| C3 | O4 | C5 | H7 | 55.8° | 58.9° |
| O4 | C5 | C6 | C31 | 120.0° | 120.0° |
| O4 | C5 | C6 | H7 | 119.2° | 120.0° |
| O4 | C5 | C6 | O5 | 71.6° | 66.6° |
| O4 | C5 | C31 | H7 | 120.4° | 119.9° |
| O4 | C5 | C31 | O26 | 176.7° | 177.5° |
| O4 | C5 | C31 | C32 | 55.1° | 57.5° |
| O4 | C5 | C6 | H8 | 48.2° | 53.4° |
| O4 | C5 | C6 | H9 | 168.6° | 173.4° |
| C5 | O4 | C3 | H4 | 51.0° | 58.8° |
| O4 | C5 | C31 | H51 | 63.6° | 62.4° |
| C5 | C6 | O5 | H8 | 119.8° | 119.9° |
| C5 | C6 | O5 | H9 | 119.8° | 120.0° |
| C5 | C6 | O5 | C7 | 128.9° | 178.7° |
| C6 | C5 | C31 | H7 | 120.9° | 120.0° |
| C6 | C5 | C31 | O26 | 64.6° | 62.5° |
| C6 | C5 | C31 | C32 | 173.8° | 177.6° |
| C5 | C6 | H8 | H9 | 120.5° | 120.0° |
| C6 | C5 | C31 | H51 | 55.1° | 57.7° |
| C6 | O5 | C7 | C8 | 176.6° | 169.0° |
| C6 | O5 | C7 | O7 | 63.2° | 71.1° |
| O5 | C6 | C5 | C31 | 48.4° | 53.5° |
| O5 | C6 | C5 | H7 | 169.1° | 173.5° |
| O5 | C6 | H8 | H9 | 120.5° | 120.1° |
| C6 | O5 | C7 | H10 | 58.9° | 48.9° |
| O5 | C7 | C8 | O7 | 121.2° | 119.9° |
| O5 | C7 | C8 | H10 | 118.8° | 120.1° |
| O5 | C7 | C8 | O6 | 177.6° | 177.7° |
| O5 | C7 | O7 | H10 | 122.3° | 120.0° |
| O5 | C7 | O7 | C9 | 59.2° | 58.8° |
| O5 | C7 | C8 | C18 | 61.4° | 62.3° |
| C7 | O5 | C6 | H8 | 9.1° | 61.4° |
| C7 | O5 | C6 | H9 | 111.3° | 58.6° |
| O5 | C7 | C8 | H11 | 56.7° | 57.7° |
| C7 | C8 | O6 | C18 | 119.6° | 119.7° |
| C7 | C8 | O6 | H11 | 120.1° | 120.1° |
| C8 | C7 | O7 | H10 | 119.2° | 120.1° |
| C8 | C7 | O7 | C9 | 59.2° | 61.1° |
| C7 | C8 | C18 | C17 | 59.0° | 57.0° |
| C7 | C8 | C18 | O15 | 179.7° | 176.8° |
| C7 | C8 | C18 | H11 | 118.1° | 120.0° |
| C7 | C8 | C18 | H29 | 60.3° | 62.9° |
| C7 | C8 | O6 | H12 | 180.0° | 60.0° |
| O6 | C8 | C7 | O7 | 61.2° | 62.4° |
| O6 | C8 | C18 | C17 | 61.8° | 62.9° |
| O6 | C8 | C18 | O15 | 58.9° | 56.9° |
| O6 | C8 | C18 | H11 | 121.1° | 120.1° |
| O6 | C8 | C7 | H10 | 58.8° | 57.7° |
| O6 | C8 | C18 | H29 | 178.9° | 177.2° |
| C7 | O7 | C9 | C10 | 179.9° | 178.9° |
| C7 | O7 | C9 | C17 | 55.8° | 61.1° |
| O7 | C7 | C8 | C18 | 59.8° | 57.6° |
| O7 | C7 | C8 | H11 | 177.9° | 177.6° |
| C7 | O7 | C9 | H13 | 63.1° | 58.9° |
| O7 | C9 | C10 | C17 | 123.9° | 119.9° |
| O7 | C9 | C10 | H13 | 117.4° | 120.1° |
| O7 | C9 | C10 | O8 | 62.6° | 65.1° |
| O7 | C9 | C17 | H13 | 119.6° | 120.1° |
| O7 | C9 | C17 | O14 | 173.6° | 177.5° |
| O7 | C9 | C17 | C18 | 52.5° | 57.6° |
| C9 | O7 | C7 | H10 | 178.4° | 178.8° |
| O7 | C9 | C10 | H14 | 57.5° | 174.9° |
| O7 | C9 | C10 | H15 | 177.3° | 54.9° |
| O7 | C9 | C17 | H27 | 66.6° | 62.4° |
| C9 | C10 | O8 | H14 | 120.1° | 120.0° |
| C9 | C10 | O8 | H15 | 120.1° | 120.0° |
| C9 | C10 | O8 | C11 | 89.6° | 180.0° |
| C10 | C9 | C17 | H13 | 118.9° | 120.0° |
| C10 | C9 | C17 | O14 | 64.9° | 62.5° |
| C10 | C9 | C17 | C18 | 174.0° | 177.6° |
| C9 | C10 | H14 | H15 | 119.7° | 120.0° |
| C10 | C9 | C17 | H27 | 54.9° | 57.6° |
| C10 | O8 | C11 | C12 | 173.7° | 170.0° |
| C10 | O8 | C11 | O10 | 64.5° | 70.1° |
| O8 | C10 | C9 | C17 | 61.3° | 175.0° |
| O8 | C10 | H14 | H15 | 119.7° | 120.0° |
| C10 | O8 | C11 | H16 | 56.5° | 50.0° |
| O8 | C10 | C9 | H13 | 180.0° | 55.0° |
| O8 | C11 | C12 | O10 | 122.6° | 119.9° |
| O8 | C11 | C12 | H16 | 118.2° | 120.0° |
| O8 | C11 | C12 | O9 | 169.4° | 177.7° |
| O8 | C11 | O10 | H16 | 121.2° | 120.1° |
| O8 | C11 | O10 | C13 | 60.9° | 58.8° |
| O8 | C11 | C12 | C16 | 68.1° | 62.4° |
| C11 | O8 | C10 | H14 | 30.5° | 60.0° |
| C11 | O8 | C10 | H15 | 150.3° | 60.0° |
| O8 | C11 | C12 | H17 | 50.1° | 57.6° |
| C11 | C12 | O9 | C16 | 122.2° | 119.7° |
| C11 | C12 | O9 | H17 | 118.5° | 120.1° |
| C12 | C11 | O10 | H16 | 118.3° | 120.0° |
| C12 | C11 | O10 | C13 | 59.6° | 61.2° |
| C11 | C12 | C16 | C15 | 52.9° | 56.9° |
| C11 | C12 | C16 | O13 | 175.1° | 176.8° |
| C11 | C12 | C16 | H17 | 118.1° | 120.0° |
| C11 | C12 | C16 | H25 | 65.6° | 63.0° |
| C11 | C12 | O9 | H18 | 180.0° | 60.0° |
| O9 | C12 | C11 | O10 | 67.9° | 62.3° |
| O9 | C12 | C16 | C15 | 69.0° | 62.9° |
| O9 | C12 | C16 | O13 | 53.2° | 57.0° |
| O9 | C12 | C16 | H17 | 120.0° | 120.1° |
| O9 | C12 | C16 | H25 | 172.5° | 177.1° |
| O9 | C12 | C11 | H16 | 51.2° | 57.7° |
| C11 | O10 | C13 | C14 | 176.9° | 178.9° |
| C11 | O10 | C13 | C15 | 60.6° | 61.2° |
| O10 | C11 | C12 | C16 | 54.5° | 57.6° |
| C11 | O10 | C13 | H19 | 59.0° | 58.8° |
| O10 | C11 | C12 | H17 | 172.7° | 177.6° |
| O10 | C13 | C14 | C15 | 120.7° | 119.9° |
| O10 | C13 | C14 | H19 | 118.6° | 120.1° |
| O10 | C13 | C14 | O11 | 60.0° | 65.1° |
| O10 | C13 | C15 | H19 | 120.4° | 120.0° |
| O10 | C13 | C15 | O12 | 177.4° | 177.5° |
| O10 | C13 | C15 | C16 | 56.4° | 57.6° |
| O10 | C13 | C15 | H23 | 62.5° | 62.3° |
| C13 | O10 | C11 | H16 | 177.9° | 178.8° |
| O10 | C13 | C14 | H20 | 179.7° | 174.9° |
| O10 | C13 | C14 | H21 | 60.3° | 54.9° |
| C13 | C14 | O11 | H20 | 120.3° | 120.0° |
| C13 | C14 | O11 | H21 | 120.3° | 120.0° |
| C14 | C13 | C15 | H19 | 120.8° | 120.0° |
| C14 | C13 | C15 | O12 | 63.8° | 62.5° |
| C14 | C13 | C15 | C16 | 175.2° | 177.6° |
| C14 | C13 | C15 | H23 | 56.4° | 57.6° |
| C13 | C14 | H20 | H21 | 119.1° | 120.1° |
| C13 | C14 | O11 | H22 | 180.0° | 180.0° |
| O11 | C14 | C13 | C15 | 179.3° | 175.0° |
| O11 | C14 | C13 | H19 | 58.6° | 55.0° |
| O11 | C14 | H20 | H21 | 119.2° | 119.9° |
| C13 | C15 | O12 | C16 | 120.9° | 119.7° |
| C13 | C15 | O12 | H23 | 119.4° | 120.1° |
| C13 | C15 | C16 | H23 | 118.8° | 119.9° |
| C13 | C15 | C16 | O13 | 175.6° | 176.8° |
| C13 | C15 | C16 | C12 | 54.0° | 57.0° |
| C13 | C15 | C16 | H25 | 64.6° | 63.0° |
| C15 | C13 | C14 | H20 | 59.0° | 55.0° |
| C15 | C13 | C14 | H21 | 60.4° | 65.0° |
| C13 | C15 | O12 | H24 | 180.0° | 179.9° |
| O12 | C15 | C16 | H23 | 120.5° | 120.2° |
| O12 | C15 | C16 | O13 | 63.7° | 63.3° |
| O12 | C15 | C16 | C12 | 174.7° | 176.9° |
| O12 | C15 | C13 | H19 | 57.0° | 57.5° |
| O12 | C15 | C16 | H25 | 56.2° | 56.9° |
| C15 | C16 | O13 | C12 | 122.4° | 119.6° |
| C15 | C16 | O13 | H25 | 119.1° | 120.2° |
| C15 | C16 | C12 | H25 | 118.5° | 119.9° |
| C16 | C15 | C13 | H19 | 63.9° | 62.4° |
| C15 | C16 | C12 | H17 | 171.0° | 176.9° |
| C16 | C15 | O12 | H24 | 59.1° | 60.3° |
| C15 | C16 | O13 | H26 | 180.0° | 180.0° |
| O13 | C16 | C12 | H25 | 119.3° | 120.2° |
| O13 | C16 | C15 | H23 | 56.8° | 57.0° |
| O13 | C16 | C12 | H17 | 66.8° | 63.2° |
| C9 | C17 | O14 | C18 | 120.1° | 119.7° |
| C9 | C17 | O14 | H27 | 118.9° | 120.1° |
| C9 | C17 | C18 | H27 | 119.1° | 120.0° |
| C9 | C17 | C18 | O15 | 174.9° | 176.8° |
| C9 | C17 | C18 | C8 | 55.4° | 57.0° |
| C17 | C9 | C10 | H14 | 178.6° | 55.0° |
| C17 | C9 | C10 | H15 | 58.8° | 65.0° |
| C9 | C17 | C18 | H29 | 63.9° | 62.9° |
| C9 | C17 | O14 | H28 | 180.0° | 60.3° |
| O14 | C17 | C18 | H27 | 121.9° | 120.1° |
| O14 | C17 | C18 | O15 | 66.1° | 63.3° |
| O14 | C17 | C18 | C8 | 174.4° | 176.9° |
| O14 | C17 | C18 | H29 | 55.1° | 57.0° |
| O14 | C17 | C9 | H13 | 53.9° | 57.5° |
| C17 | C18 | O15 | C8 | 120.3° | 119.6° |
| C17 | C18 | O15 | H29 | 120.5° | 120.2° |
| C17 | C18 | O15 | C19 | 88.8° | 145.2° |
| C17 | C18 | C8 | H29 | 119.3° | 119.9° |
| C17 | C18 | C8 | H11 | 177.1° | 176.9° |
| C18 | C17 | C9 | H13 | 67.1° | 62.4° |
| C18 | C17 | O14 | H28 | 59.9° | 180.0° |
| C18 | O15 | C19 | C20 | 177.2° | 165.7° |
| C18 | O15 | C19 | O22 | 60.6° | 74.4° |
| O15 | C18 | C8 | H29 | 120.0° | 120.3° |
| O15 | C18 | C8 | H11 | 62.2° | 63.2° |
| O15 | C18 | C17 | H27 | 55.8° | 56.9° |
| C18 | O15 | C19 | H30 | 60.0° | 45.6° |
| O15 | C19 | C20 | O22 | 120.9° | 119.9° |
| O15 | C19 | C20 | H30 | 118.5° | 120.1° |
| O15 | C19 | C20 | O16 | 175.0° | 177.7° |
| O15 | C19 | O22 | H30 | 120.9° | 120.1° |
| O15 | C19 | O22 | C27 | 63.2° | 58.8° |
| C19 | O15 | C18 | C8 | 150.9° | 95.3° |
| O15 | C19 | C20 | C30 | 69.3° | 62.3° |
| O15 | C19 | C20 | H31 | 53.3° | 57.6° |
| C19 | O15 | C18 | H29 | 31.7° | 25.0° |
| C19 | C20 | O16 | C30 | 117.4° | 119.7° |
| C19 | C20 | O16 | H31 | 120.9° | 120.1° |
| C19 | C20 | O16 | C21 | 59.6° | 104.0° |
| C20 | C19 | O22 | H30 | 119.8° | 120.0° |
| C20 | C19 | O22 | C27 | 56.1° | 61.1° |
| C19 | C20 | C30 | C29 | 55.7° | 57.0° |
| C19 | C20 | C30 | O25 | 176.2° | 176.8° |
| C19 | C20 | C30 | H31 | 122.4° | 120.0° |
| C19 | C20 | C30 | H49 | 62.9° | 62.9° |
| C20 | O16 | C21 | C22 | 150.6° | 166.9° |
| C20 | O16 | C21 | O18 | 89.0° | 73.2° |
| O16 | C20 | C19 | O22 | 64.1° | 62.3° |
| O16 | C20 | C30 | C29 | 59.5° | 63.0° |
| O16 | C20 | C30 | O25 | 61.0° | 56.9° |
| O16 | C20 | C30 | H31 | 122.4° | 120.1° |
| C20 | O16 | C21 | H32 | 32.6° | 46.8° |
| O16 | C20 | C19 | H30 | 56.5° | 57.6° |
| O16 | C20 | C30 | H49 | 178.1° | 177.2° |
| O16 | C21 | C22 | O18 | 121.9° | 120.0° |
| O16 | C21 | C22 | H32 | 119.1° | 120.1° |
| O16 | C21 | C22 | O17 | 175.8° | 177.7° |
| O16 | C21 | O18 | H32 | 121.8° | 120.1° |
| O16 | C21 | O18 | C23 | 57.8° | 58.8° |
| C21 | O16 | C20 | C30 | 177.0° | 136.3° |
| O16 | C21 | C22 | C26 | 62.4° | 62.4° |
| C21 | O16 | C20 | H31 | 61.3° | 16.1° |
| O16 | C21 | C22 | H33 | 55.8° | 57.6° |
| C21 | C22 | O17 | C26 | 121.2° | 119.7° |
| C21 | C22 | O17 | H33 | 119.2° | 120.1° |
| C22 | C21 | O18 | H32 | 118.3° | 119.9° |
| C22 | C21 | O18 | C23 | 62.1° | 61.2° |
| C21 | C22 | C26 | C25 | 55.2° | 57.0° |
| C21 | C22 | C26 | O21 | 176.9° | 176.9° |
| C21 | C22 | C26 | H33 | 118.1° | 119.9° |
| C21 | C22 | C26 | H41 | 63.5° | 62.9° |
| C21 | C22 | O17 | H34 | 180.0° | 60.0° |
| O17 | C22 | C21 | O18 | 62.4° | 62.3° |
| O17 | C22 | C26 | C25 | 66.4° | 62.9° |
| O17 | C22 | C26 | O21 | 55.3° | 57.0° |
| O17 | C22 | C26 | H33 | 120.3° | 120.2° |
| O17 | C22 | C21 | H32 | 56.7° | 57.7° |
| O17 | C22 | C26 | H41 | 174.9° | 177.1° |
| C21 | O18 | C23 | C24 | 177.5° | 178.9° |
| C21 | O18 | C23 | C25 | 58.4° | 61.1° |
| O18 | C21 | C22 | C26 | 59.5° | 57.6° |
| O18 | C21 | C22 | H33 | 177.6° | 177.6° |
| C21 | O18 | C23 | H35 | 60.7° | 58.8° |
| O18 | C23 | C24 | C25 | 123.0° | 120.0° |
| O18 | C23 | C24 | H35 | 117.4° | 120.0° |
| O18 | C23 | C24 | O19 | 63.2° | 65.0° |
| O18 | C23 | C25 | H35 | 119.8° | 120.0° |
| O18 | C23 | C25 | O20 | 173.1° | 177.5° |
| O18 | C23 | C25 | C26 | 51.7° | 57.6° |
| C23 | O18 | C21 | H32 | 179.6° | 178.9° |
| O18 | C23 | C24 | H36 | 176.7° | 174.9° |
| O18 | C23 | C24 | H37 | 56.8° | 55.0° |
| O18 | C23 | C25 | H39 | 67.3° | 62.3° |
| C23 | C24 | O19 | H36 | 120.1° | 120.0° |
| C23 | C24 | O19 | H37 | 120.1° | 119.9° |
| C24 | C23 | C25 | H35 | 119.8° | 120.0° |
| C24 | C23 | C25 | O20 | 66.4° | 62.4° |
| C24 | C23 | C25 | C26 | 172.1° | 177.6° |
| C23 | C24 | H36 | H37 | 119.8° | 119.9° |
| C24 | C23 | C25 | H39 | 53.1° | 57.7° |
| C23 | C24 | O19 | H38 | 180.0° | 180.0° |
| O19 | C24 | C23 | C25 | 173.8° | 175.0° |
| O19 | C24 | H36 | H37 | 119.8° | 120.1° |
| O19 | C24 | C23 | H35 | 54.2° | 55.0° |
| C23 | C25 | O20 | C26 | 121.8° | 119.7° |
| C23 | C25 | O20 | H39 | 118.7° | 120.1° |
| C23 | C25 | C26 | H39 | 118.9° | 119.9° |
| C23 | C25 | C26 | O21 | 172.8° | 176.9° |
| C23 | C25 | C26 | C22 | 51.2° | 57.0° |
| C25 | C23 | C24 | H36 | 53.8° | 55.0° |
| C25 | C23 | C24 | H37 | 66.1° | 65.0° |
| C23 | C25 | C26 | H41 | 67.4° | 63.0° |
| C23 | C25 | O20 | H40 | 180.0° | 179.6° |
| O20 | C25 | C26 | H39 | 120.2° | 120.2° |
| O20 | C25 | C26 | O21 | 66.4° | 63.2° |
| O20 | C25 | C26 | C22 | 172.1° | 176.9° |
| O20 | C25 | C26 | H41 | 53.4° | 56.9° |
| O20 | C25 | C23 | H35 | 53.3° | 57.5° |
| C25 | C26 | O21 | C22 | 122.2° | 119.6° |
| C25 | C26 | O21 | H41 | 119.0° | 120.2° |
| C25 | C26 | C22 | H41 | 118.7° | 120.0° |
| C25 | C26 | C22 | H33 | 173.3° | 176.9° |
| C26 | C25 | C23 | H35 | 68.1° | 62.4° |
| C26 | C25 | O20 | H40 | 58.2° | 60.0° |
| C25 | C26 | O21 | H42 | 180.0° | 179.5° |
| O21 | C26 | C22 | H41 | 119.6° | 120.2° |
| O21 | C26 | C22 | H33 | 65.0° | 63.2° |
| O21 | C26 | C25 | H39 | 53.9° | 57.0° |
| C19 | O22 | C27 | C28 | 175.0° | 178.9° |
| C19 | O22 | C27 | C29 | 62.4° | 61.2° |
| O22 | C19 | C20 | C30 | 51.6° | 57.6° |
| O22 | C19 | C20 | H31 | 174.1° | 177.6° |
| C19 | O22 | C27 | H43 | 56.3° | 58.9° |
| O22 | C27 | C28 | C29 | 118.5° | 119.9° |
| O22 | C27 | C28 | H43 | 119.4° | 120.0° |
| O22 | C27 | C28 | O23 | 179.2° | 65.1° |
| O22 | C27 | C29 | H43 | 119.5° | 120.0° |
| O22 | C27 | C29 | O24 | 175.0° | 177.5° |
| O22 | C27 | C29 | C30 | 65.1° | 57.6° |
| O22 | C27 | C28 | H44 | 60.6° | 175.0° |
| O22 | C27 | C28 | H45 | 58.9° | 54.9° |
| O22 | C27 | C29 | H47 | 53.5° | 62.3° |
| C27 | O22 | C19 | H30 | 175.9° | 178.9° |
| C27 | C28 | O23 | H44 | 120.2° | 120.0° |
| C27 | C28 | O23 | H45 | 120.2° | 120.0° |
| C28 | C27 | C29 | H43 | 122.2° | 120.0° |
| C28 | C27 | C29 | O24 | 56.7° | 62.5° |
| C28 | C27 | C29 | C30 | 176.5° | 177.5° |
| C27 | C28 | H44 | H45 | 119.3° | 120.1° |
| C28 | C27 | C29 | H47 | 64.8° | 57.6° |
| C27 | C28 | O23 | H46 | 180.0° | 180.0° |
| O23 | C28 | C27 | C29 | 62.3° | 175.0° |
| O23 | C28 | H44 | H45 | 119.3° | 120.0° |
| O23 | C28 | C27 | H43 | 59.8° | 54.9° |
| C27 | C29 | O24 | C30 | 118.1° | 119.7° |
| C27 | C29 | O24 | H47 | 120.7° | 120.2° |
| C27 | C29 | C30 | H47 | 118.6° | 119.9° |
| C27 | C29 | C30 | O25 | 176.9° | 176.9° |
| C27 | C29 | C30 | C20 | 63.1° | 57.0° |
| C29 | C27 | C28 | H44 | 57.9° | 55.1° |
| C29 | C27 | C28 | H45 | 177.4° | 65.0° |
| C27 | C29 | C30 | H49 | 55.5° | 62.9° |
| C27 | C29 | O24 | H48 | 180.0° | 60.1° |
| O24 | C29 | C30 | H47 | 121.9° | 120.2° |
| O24 | C29 | C30 | O25 | 57.4° | 63.2° |
| O24 | C29 | C30 | C20 | 177.4° | 176.9° |
| O24 | C29 | C27 | H43 | 65.5° | 57.5° |
| O24 | C29 | C30 | H49 | 64.0° | 57.0° |
| C29 | C30 | O25 | C20 | 119.2° | 119.6° |
| C29 | C30 | O25 | H49 | 120.7° | 120.1° |
| C29 | C30 | C20 | H49 | 118.6° | 119.9° |
| C29 | C30 | C20 | H31 | 178.1° | 176.9° |
| C30 | C29 | C27 | H43 | 54.3° | 62.4° |
| C30 | C29 | O24 | H48 | 61.9° | 179.8° |
| C29 | C30 | O25 | H50 | 180.0° | 60.4° |
| O25 | C30 | C20 | H49 | 120.9° | 120.3° |
| O25 | C30 | C20 | H31 | 61.4° | 63.2° |
| O25 | C30 | C29 | H47 | 64.6° | 56.9° |
| C5 | C31 | O26 | C32 | 121.5° | 119.7° |
| C5 | C31 | O26 | H51 | 118.9° | 120.1° |
| C5 | C31 | C32 | H51 | 118.7° | 119.8° |
| C5 | C31 | C32 | O27 | 168.7° | 176.8° |
| C5 | C31 | C32 | C4 | 51.0° | 57.0° |
| C31 | C5 | C6 | H8 | 168.2° | 173.4° |
| C31 | C5 | C6 | H9 | 71.4° | 66.6° |
| C5 | C31 | C32 | H53 | 70.1° | 63.0° |
| C5 | C31 | O26 | H52 | 180.0° | 60.0° |
| O26 | C31 | C32 | H51 | 120.5° | 120.2° |
| O26 | C31 | C32 | O27 | 70.5° | 63.2° |
| O26 | C31 | C32 | C4 | 171.8° | 176.9° |
| O26 | C31 | C5 | H7 | 56.3° | 57.5° |
| O26 | C31 | C32 | H53 | 50.7° | 56.9° |
| C31 | C32 | O27 | C4 | 120.5° | 119.6° |
| C31 | C32 | O27 | H53 | 120.4° | 120.2° |
| C31 | C32 | O27 | C33 | 98.3° | 150.4° |
| C31 | C32 | C4 | H53 | 121.0° | 120.0° |
| C31 | C32 | C4 | H5 | 170.9° | 177.0° |
| C32 | C31 | C5 | H7 | 65.3° | 62.4° |
| C32 | C31 | O26 | H52 | 58.5° | 179.7° |
| C32 | O27 | C33 | C34 | 170.1° | 170.0° |
| O27 | C32 | C4 | H53 | 120.0° | 120.2° |
| C32 | O27 | C33 | O34 | 69.2° | 70.1° |
| O27 | C32 | C4 | H5 | 70.1° | 63.2° |
| C32 | O27 | C33 | H54 | 51.8° | 50.0° |
| O27 | C32 | C31 | H51 | 50.0° | 57.0° |
| O27 | C33 | C34 | O34 | 120.1° | 120.0° |
| O27 | C33 | C34 | H54 | 119.5° | 120.0° |
| O27 | C33 | C34 | O28 | 176.6° | 177.7° |
| O27 | C33 | C34 | C41 | 58.5° | 62.4° |
| O27 | C33 | O34 | C43 | 61.4° | 58.8° |
| C33 | O27 | C32 | C4 | 141.2° | 90.0° |
| O27 | C33 | O34 | H54 | 121.3° | 120.1° |
| C33 | O27 | C32 | H53 | 22.1° | 30.2° |
| O27 | C33 | C34 | H55 | 62.6° | 57.6° |
| C33 | C34 | O28 | C41 | 114.7° | 119.7° |
| C33 | C34 | O28 | H55 | 119.9° | 120.1° |
| C33 | C34 | O28 | C35 | 164.2° | 90.0° |
| C33 | C34 | C41 | H55 | 121.0° | 119.9° |
| C33 | C34 | C41 | C42 | 63.0° | 57.0° |
| C34 | C33 | O34 | C43 | 57.8° | 61.2° |
| C33 | C34 | C41 | O37 | 174.2° | 176.8° |
| C34 | C33 | O34 | H54 | 119.6° | 120.0° |
| C33 | C34 | C41 | H67 | 53.8° | 62.9° |
| C34 | O28 | C35 | C36 | 173.4° | 170.0° |
| O28 | C34 | C41 | H55 | 126.0° | 120.1° |
| O28 | C34 | C41 | C42 | 50.1° | 62.9° |
| O28 | C34 | C41 | O37 | 72.8° | 56.9° |
| O28 | C34 | C33 | O34 | 56.6° | 62.4° |
| C34 | O28 | C35 | O30 | 66.7° | 70.1° |
| O28 | C34 | C33 | H54 | 63.8° | 57.7° |
| C34 | O28 | C35 | H56 | 54.3° | 50.0° |
| O28 | C34 | C41 | H67 | 166.9° | 177.2° |
| O28 | C35 | C36 | O30 | 119.4° | 120.0° |
| O28 | C35 | C36 | H56 | 120.2° | 120.1° |
| O28 | C35 | C36 | O29 | 176.3° | 177.7° |
| O28 | C35 | C36 | C37 | 62.3° | 62.4° |
| O28 | C35 | O30 | C39 | 60.3° | 58.8° |
| C35 | O28 | C34 | C41 | 81.1° | 150.3° |
| O28 | C35 | O30 | H56 | 121.3° | 120.1° |
| C35 | O28 | C34 | H55 | 44.3° | 30.1° |
| O28 | C35 | C36 | H57 | 55.6° | 57.6° |
| C35 | C36 | O29 | C37 | 120.0° | 119.7° |
| C35 | C36 | O29 | H57 | 119.8° | 120.1° |
| C35 | C36 | C37 | H57 | 117.9° | 119.9° |
| C35 | C36 | C37 | C38 | 60.8° | 57.0° |
| C36 | C35 | O30 | C39 | 58.8° | 61.2° |
| C35 | C36 | C37 | O33 | 178.0° | 176.9° |
| C36 | C35 | O30 | H56 | 119.6° | 119.9° |
| C35 | C36 | C37 | H59 | 57.4° | 62.9° |
| C35 | C36 | O29 | H58 | 180.0° | 60.1° |
| O29 | C36 | C37 | H57 | 121.0° | 120.2° |
| O29 | C36 | C37 | C38 | 60.3° | 62.9° |
| O29 | C36 | C37 | O33 | 61.0° | 57.0° |
| O29 | C36 | C35 | O30 | 64.3° | 62.3° |
| O29 | C36 | C35 | H56 | 56.1° | 57.7° |
| O29 | C36 | C37 | H59 | 178.5° | 177.2° |
| C36 | C37 | C38 | O33 | 120.6° | 119.8° |
| C36 | C37 | C38 | H59 | 118.1° | 119.8° |
| C36 | C37 | C38 | C39 | 63.0° | 57.0° |
| C36 | C37 | C38 | O32 | 178.1° | 176.9° |
| C36 | C37 | O33 | H59 | 119.8° | 120.1° |
| C37 | C36 | C35 | O30 | 57.1° | 57.6° |
| C37 | C36 | C35 | H56 | 177.5° | 177.6° |
| C36 | C37 | C38 | H60 | 55.4° | 62.9° |
| C37 | C36 | O29 | H58 | 60.0° | 179.7° |
| C36 | C37 | O33 | H66 | 180.0° | 60.0° |
| C37 | C38 | C39 | O32 | 119.4° | 119.9° |
| C37 | C38 | C39 | H60 | 118.6° | 119.9° |
| C37 | C38 | C39 | O30 | 62.2° | 57.6° |
| C37 | C38 | C39 | C40 | 178.6° | 177.6° |
| C37 | C38 | O32 | H60 | 121.9° | 120.2° |
| C38 | C37 | O33 | H59 | 120.6° | 120.3° |
| C38 | C37 | C36 | H57 | 178.7° | 176.9° |
| C37 | C38 | C39 | H61 | 57.2° | 62.4° |
| C37 | C38 | O32 | H65 | 180.0° | 60.0° |
| C38 | C37 | O33 | H66 | 60.4° | 179.5° |
| C38 | C39 | O30 | C40 | 123.6° | 120.0° |
| C38 | C39 | O30 | H61 | 118.7° | 120.0° |
| C38 | C39 | C40 | H61 | 121.3° | 120.0° |
| C38 | C39 | C40 | O31 | 178.6° | 175.0° |
| C39 | C38 | O32 | H60 | 121.2° | 120.2° |
| C39 | C38 | C37 | O33 | 176.4° | 176.8° |
| C38 | C39 | O30 | C35 | 61.7° | 61.2° |
| C39 | C38 | C37 | H59 | 55.1° | 62.9° |
| C38 | C39 | C40 | H62 | 58.5° | 55.0° |
| C38 | C39 | C40 | H63 | 61.4° | 65.1° |
| C39 | C38 | O32 | H65 | 63.2° | 179.6° |
| O30 | C39 | C40 | H61 | 118.3° | 120.0° |
| O30 | C39 | C40 | O31 | 61.1° | 65.1° |
| O30 | C39 | C38 | O32 | 178.4° | 177.5° |
| C39 | O30 | C35 | H56 | 178.4° | 178.9° |
| O30 | C39 | C38 | H60 | 56.3° | 62.2° |
| O30 | C39 | C40 | H62 | 178.9° | 175.0° |
| O30 | C39 | C40 | H63 | 59.0° | 54.9° |
| C39 | C40 | O31 | H62 | 120.1° | 120.0° |
| C39 | C40 | O31 | H63 | 120.1° | 120.0° |
| C40 | C39 | C38 | O32 | 59.2° | 62.5° |
| C40 | C39 | O30 | C35 | 174.6° | 178.8° |
| C40 | C39 | C38 | H60 | 62.8° | 57.8° |
| C39 | C40 | H62 | H63 | 119.8° | 120.0° |
| C39 | C40 | O31 | H64 | 180.0° | 180.0° |
| O31 | C40 | C39 | H61 | 57.2° | 55.0° |
| O31 | C40 | H62 | H63 | 119.8° | 120.0° |
| O32 | C38 | C37 | O33 | 57.5° | 63.3° |
| O32 | C38 | C37 | H59 | 63.8° | 57.0° |
| O32 | C38 | C39 | H61 | 62.2° | 57.5° |
| O33 | C37 | C36 | H57 | 60.1° | 63.2° |
| O33 | C37 | C38 | H60 | 65.2° | 57.0° |
| C34 | C41 | C42 | O37 | 122.7° | 119.9° |
| C34 | C41 | C42 | H67 | 116.9° | 119.9° |
| C34 | C41 | C42 | C43 | 60.2° | 57.0° |
| C34 | C41 | C42 | O36 | 179.7° | 176.9° |
| C34 | C41 | O37 | H67 | 119.6° | 120.3° |
| C41 | C34 | C33 | O34 | 61.6° | 57.6° |
| C41 | C34 | C33 | H54 | 178.0° | 177.6° |
| C34 | C41 | C42 | H68 | 58.7° | 62.9° |
| C34 | C41 | O37 | H74 | 180.0° | 180.0° |
| C41 | C42 | C43 | O36 | 120.5° | 119.9° |
| C41 | C42 | C43 | H68 | 118.9° | 119.9° |
| C41 | C42 | C43 | O34 | 54.2° | 57.6° |
| C41 | C42 | C43 | C44 | 174.3° | 177.6° |
| C41 | C42 | O36 | H68 | 120.2° | 120.1° |
| C42 | C41 | O37 | H67 | 119.7° | 120.2° |
| C42 | C41 | C34 | H55 | 176.0° | 176.9° |
| C41 | C42 | C43 | H69 | 65.8° | 62.4° |
| C41 | C42 | O36 | H73 | 180.0° | 180.0° |
| C42 | C41 | O37 | H74 | 59.4° | 60.5° |
| C42 | C43 | O34 | C44 | 123.8° | 119.9° |
| C42 | C43 | O34 | H69 | 119.3° | 120.0° |
| C42 | C43 | C44 | H69 | 119.7° | 120.0° |
| C42 | C43 | C44 | O35 | 178.2° | 175.0° |
| C43 | C42 | O36 | H68 | 119.7° | 120.2° |
| C43 | C42 | C41 | O37 | 177.2° | 176.9° |
| C42 | C43 | O34 | C33 | 53.7° | 61.2° |
| C43 | C42 | C41 | H67 | 56.7° | 62.9° |
| C42 | C43 | C44 | H70 | 58.0° | 55.1° |
| C42 | C43 | C44 | H71 | 61.5° | 65.0° |
| C43 | C42 | O36 | H73 | 59.9° | 60.3° |
| O34 | C43 | C44 | H69 | 117.5° | 120.1° |
| O34 | C43 | C44 | O35 | 59.0° | 65.1° |
| O34 | C43 | C42 | O36 | 174.7° | 177.5° |
| C43 | O34 | C33 | H54 | 177.3° | 178.9° |
| O34 | C43 | C42 | H68 | 64.7° | 62.3° |
| O34 | C43 | C44 | H70 | 179.3° | 175.0° |
| O34 | C43 | C44 | H71 | 61.2° | 54.9° |
| C43 | C44 | O35 | H70 | 120.2° | 120.0° |
| C43 | C44 | O35 | H71 | 120.3° | 120.0° |
| C44 | C43 | C42 | O36 | 65.2° | 62.5° |
| C44 | C43 | O34 | C33 | 177.5° | 178.9° |
| C44 | C43 | C42 | H68 | 55.4° | 57.7° |
| C43 | C44 | H70 | H71 | 119.2° | 120.1° |
| C43 | C44 | O35 | H72 | 180.0° | 180.0° |
| O35 | C44 | C43 | H69 | 58.5° | 55.0° |
| O35 | C44 | H70 | H71 | 119.2° | 119.9° |
| O36 | C42 | C41 | O37 | 57.0° | 63.2° |
| O36 | C42 | C41 | H67 | 63.5° | 57.0° |
| O36 | C42 | C43 | H69 | 54.7° | 57.5° |
| O37 | C41 | C34 | H55 | 53.2° | 63.2° |
| O37 | C41 | C42 | H68 | 64.0° | 56.9° |
| C2 | C45 | C46 | O39 | 120.1° | 120.0° |
| C2 | C45 | C46 | H75 | 121.2° | 120.0° |
| C2 | C45 | C46 | O38 | 59.3° | 174.7° |
| C2 | C45 | O39 | H75 | 119.2° | 119.9° |
| C2 | C45 | O39 | C47 | 61.9° | 61.1° |
| C45 | C2 | C1 | C81 | 60.6° | 57.0° |
| C45 | C2 | C1 | H2 | 57.6° | 62.9° |
| C2 | C45 | C46 | H76 | 60.9° | 54.7° |
| C2 | C45 | C46 | H77 | 179.5° | 65.4° |
| C45 | C46 | O38 | H76 | 120.2° | 120.0° |
| C45 | C46 | O38 | H77 | 120.2° | 120.0° |
| C46 | C45 | O39 | H75 | 118.1° | 120.0° |
| C46 | C45 | O39 | C47 | 175.3° | 178.9° |
| C46 | C45 | C2 | H3 | 60.3° | 57.6° |
| C45 | C46 | H76 | H77 | 119.3° | 120.0° |
| C45 | C46 | O38 | H78 | 180.0° | 179.9° |
| O38 | C46 | C45 | O39 | 179.4° | 65.4° |
| O38 | C46 | C45 | H75 | 61.9° | 54.7° |
| O38 | C46 | H76 | H77 | 119.3° | 120.0° |
| C45 | O39 | C47 | O40 | 178.9° | 178.9° |
| C45 | O39 | C47 | C81 | 58.7° | 61.2° |
| O39 | C45 | C2 | H3 | 58.5° | 62.4° |
| O39 | C45 | C46 | H76 | 59.2° | 174.6° |
| O39 | C45 | C46 | H77 | 60.4° | 54.6° |
| C45 | O39 | C47 | H79 | 59.9° | 58.9° |
| O39 | C47 | O40 | C81 | 121.3° | 119.9° |
| O39 | C47 | O40 | H79 | 121.1° | 120.0° |
| O39 | C47 | O40 | C48 | 67.7° | 68.0° |
| O39 | C47 | C81 | H79 | 119.4° | 120.0° |
| O39 | C47 | C81 | N2 | 177.1° | 177.5° |
| O39 | C47 | C81 | C1 | 54.9° | 57.6° |
| C47 | O39 | C45 | H75 | 57.3° | 58.8° |
| O39 | C47 | C81 | H136 | 62.8° | 62.3° |
| C47 | O40 | C48 | C49 | 166.4° | 103.8° |
| C47 | O40 | C48 | C80 | 72.1° | 136.5° |
| O40 | C47 | C81 | H79 | 118.6° | 120.1° |
| O40 | C47 | C81 | N2 | 61.0° | 62.5° |
| O40 | C47 | C81 | C1 | 176.8° | 177.6° |
| C47 | O40 | C48 | H80 | 49.1° | 16.3° |
| O40 | C47 | C81 | H136 | 59.2° | 57.7° |
| O40 | C48 | C49 | C80 | 123.6° | 119.9° |
| O40 | C48 | C49 | H80 | 118.1° | 120.1° |
| O40 | C48 | C49 | C50 | 61.9° | 62.5° |
| O40 | C48 | C49 | O42 | 178.7° | 177.5° |
| O40 | C48 | C80 | H80 | 121.9° | 120.2° |
| O40 | C48 | C80 | O51 | 70.1° | 63.3° |
| C48 | O40 | C47 | C81 | 171.0° | 172.1° |
| O40 | C48 | C80 | C77 | 169.6° | 176.9° |
| C48 | O40 | C47 | H79 | 53.3° | 52.0° |
| O40 | C48 | C49 | H81 | 58.8° | 57.6° |
| O40 | C48 | C80 | H134 | 50.8° | 57.0° |
| C48 | C49 | C50 | O42 | 120.9° | 119.9° |
| C48 | C49 | C50 | H81 | 120.6° | 120.1° |
| C48 | C49 | C50 | O41 | 59.2° | 173.1° |
| C48 | C49 | O42 | H81 | 119.1° | 120.0° |
| C48 | C49 | O42 | C51 | 65.4° | 61.1° |
| C49 | C48 | C80 | H80 | 118.3° | 119.9° |
| C49 | C48 | C80 | O51 | 170.2° | 176.9° |
| C49 | C48 | C80 | C77 | 49.9° | 57.0° |
| C48 | C49 | C50 | H82 | 179.5° | 53.1° |
| C48 | C49 | C50 | H83 | 61.1° | 66.9° |
| C49 | C48 | C80 | H134 | 69.0° | 62.9° |
| C49 | C50 | O41 | H82 | 120.3° | 119.9° |
| C49 | C50 | O41 | H83 | 120.3° | 120.0° |
| C50 | C49 | O42 | H81 | 117.8° | 120.1° |
| C50 | C49 | O42 | C51 | 171.5° | 178.9° |
| C50 | C49 | C48 | C80 | 174.5° | 177.6° |
| C50 | C49 | C48 | H80 | 56.1° | 57.6° |
| C49 | C50 | H82 | H83 | 119.2° | 120.0° |
| C49 | C50 | O41 | H84 | 180.0° | 180.0° |
| O41 | C50 | C49 | O42 | 61.7° | 67.0° |
| O41 | C50 | C49 | H81 | 179.8° | 53.0° |
| O41 | C50 | H82 | H83 | 119.2° | 120.0° |
| C49 | O42 | C51 | O43 | 51.8° | 58.8° |
| C49 | O42 | C51 | C77 | 66.1° | 61.1° |
| O42 | C49 | C48 | C80 | 55.1° | 57.6° |
| O42 | C49 | C48 | H80 | 63.2° | 62.3° |
| O42 | C49 | C50 | H82 | 58.5° | 173.1° |
| O42 | C49 | C50 | H83 | 178.0° | 53.0° |
| C49 | O42 | C51 | H85 | 174.4° | 178.9° |
| O42 | C51 | O43 | C77 | 117.4° | 119.9° |
| O42 | C51 | O43 | H85 | 122.5° | 120.0° |
| O42 | C51 | O43 | P1 | 71.2° | 90.1° |
| O42 | C51 | C77 | H85 | 120.6° | 120.0° |
| O42 | C51 | C77 | N1 | 176.8° | 177.5° |
| O42 | C51 | C77 | C80 | 58.6° | 57.6° |
| C51 | O42 | C49 | H81 | 53.7° | 58.8° |
| O42 | C51 | C77 | H129 | 58.4° | 62.4° |
| C51 | O43 | P1 | O44 | 74.1° | 175.0° |
| C51 | O43 | P1 | O48 | 43.6° | 65.0° |
| C51 | O43 | P1 | O49 | 171.0° | 55.0° |
| O43 | C51 | C77 | H85 | 121.2° | 120.1° |
| O43 | C51 | C77 | N1 | 65.0° | 57.6° |
| O43 | C51 | C77 | C80 | 59.6° | 62.3° |
| O43 | C51 | C77 | H129 | 176.6° | 177.7° |
| O43 | P1 | O44 | O48 | 117.3° | 120.0° |
| O43 | P1 | O44 | O49 | 115.0° | 119.9° |
| O43 | P1 | O44 | P2 | 56.7° | 165.0° |
| O43 | P1 | O48 | O49 | 122.4° | 120.0° |
| P1 | O43 | C51 | C77 | 171.4° | 150.0° |
| P1 | O43 | C51 | H85 | 51.3° | 29.9° |
| O43 | P1 | O48 | H142 | 122.4° | 60.0° |
| P1 | O44 | P2 | O45 | 74.9° | 75.0° |
| P1 | O44 | P2 | O46 | 168.4° | 165.0° |
| P1 | O44 | P2 | O47 | 54.5° | 45.0° |
| O44 | P1 | O48 | O49 | 122.6° | 120.0° |
| O44 | P1 | O48 | H142 | 122.6° | 60.0° |
| O44 | P2 | O45 | O46 | 113.2° | 120.0° |
| O44 | P2 | O45 | O47 | 124.0° | 120.0° |
| O44 | P2 | O46 | O47 | 114.6° | 120.0° |
| O44 | P2 | O46 | C52 | 61.2° | 175.0° |
| P2 | O44 | P1 | O48 | 174.0° | 75.0° |
| P2 | O44 | P1 | O49 | 58.3° | 45.1° |
| O44 | P2 | O45 | H141 | 124.1° | 60.0° |
| O45 | P2 | O46 | O47 | 128.8° | 120.0° |
| O45 | P2 | O46 | C52 | 55.4° | 65.0° |
| P2 | O46 | C52 | C53 | 177.9° | 180.0° |
| P2 | O46 | C52 | H86 | 62.1° | 60.0° |
| P2 | O46 | C52 | H87 | 58.0° | 60.0° |
| O46 | P2 | O45 | H141 | 122.7° | 60.0° |
| O46 | C52 | C53 | H86 | 120.0° | 120.0° |
| O46 | C52 | C53 | H87 | 120.0° | 120.0° |
| O46 | C52 | C53 | C54 | 177.6° | 180.0° |
| C52 | O46 | P2 | O47 | 175.8° | 55.0° |
| O46 | C52 | H86 | H87 | 120.1° | 120.0° |
| O46 | C52 | C53 | H88 | 61.4° | 60.0° |
| O46 | C52 | C53 | H89 | 56.5° | 60.0° |
| C52 | C53 | C54 | H88 | 121.1° | 120.0° |
| C52 | C53 | C54 | H89 | 121.1° | 120.0° |
| C52 | C53 | C54 | C55 | 57.7° | 65.0° |
| C52 | C53 | C54 | C56 | 177.2° | 175.0° |
| C53 | C52 | H86 | H87 | 120.1° | 119.9° |
| C52 | C53 | H88 | H89 | 116.7° | 119.9° |
| C52 | C53 | C54 | H90 | 59.1° | 55.0° |
| C53 | C54 | C55 | C56 | 126.0° | 120.0° |
| C53 | C54 | C55 | H90 | 116.9° | 120.0° |
| C53 | C54 | C56 | H90 | 118.2° | 120.1° |
| C53 | C54 | C56 | C57 | 171.9° | 175.0° |
| C54 | C53 | C52 | H86 | 57.6° | 60.0° |
| C54 | C53 | C52 | H87 | 62.5° | 60.0° |
| C54 | C53 | H88 | H89 | 116.6° | 120.0° |
| C53 | C54 | C55 | H91 | 180.0° | 60.0° |
| C53 | C54 | C55 | H92 | 60.0° | 180.0° |
| C53 | C54 | C55 | H93 | 60.0° | 60.0° |
| C53 | C54 | C56 | H94 | 67.3° | 65.0° |
| C53 | C54 | C56 | H95 | 51.2° | 55.0° |
| C55 | C54 | C56 | H90 | 117.1° | 120.0° |
| C55 | C54 | C56 | C57 | 63.4° | 65.0° |
| C55 | C54 | C53 | H88 | 63.4° | 55.0° |
| C55 | C54 | C53 | H89 | 178.8° | 175.0° |
| C54 | C55 | H91 | H92 | 120.0° | 120.0° |
| C54 | C55 | H91 | H93 | 120.0° | 120.0° |
| C54 | C55 | H92 | H93 | 120.0° | 119.9° |
| C55 | C54 | C56 | H94 | 57.3° | 55.0° |
| C55 | C54 | C56 | H95 | 175.8° | 175.0° |
| C54 | C56 | C57 | H94 | 120.7° | 120.0° |
| C54 | C56 | C57 | H95 | 120.8° | 120.0° |
| C54 | C56 | C57 | C58 | 161.0° | 180.0° |
| C56 | C54 | C53 | H88 | 61.7° | 65.0° |
| C56 | C54 | C53 | H89 | 56.1° | 55.0° |
| C56 | C54 | C55 | H91 | 54.0° | 60.0° |
| C56 | C54 | C55 | H92 | 174.0° | 60.0° |
| C56 | C54 | C55 | H93 | 66.1° | 180.0° |
| C54 | C56 | H94 | H95 | 117.6° | 120.0° |
| C54 | C56 | C57 | H96 | 78.6° | 60.0° |
| C54 | C56 | C57 | H97 | 40.6° | 60.0° |
| C56 | C57 | C58 | H96 | 120.4° | 120.0° |
| C56 | C57 | C58 | H97 | 120.4° | 119.9° |
| C56 | C57 | C58 | C59 | 122.2° | 119.5° |
| C57 | C56 | C54 | H90 | 53.7° | 54.9° |
| C57 | C56 | H94 | H95 | 117.7° | 120.0° |
| C56 | C57 | H96 | H97 | 118.7° | 120.0° |
| C56 | C57 | C58 | H98 | 57.8° | 60.4° |
| C57 | C58 | C59 | H98 | 180.0° | 179.9° |
| C57 | C58 | C59 | C60 | 0.2° | 6.2° |
| C57 | C58 | C59 | C76 | 179.7° | 173.8° |
| C58 | C57 | C56 | H94 | 40.3° | 60.0° |
| C58 | C57 | C56 | H95 | 78.2° | 60.1° |
| C58 | C57 | H96 | H97 | 118.7° | 120.0° |
| C58 | C59 | C60 | C76 | 179.5° | 180.0° |
| C58 | C59 | C60 | C61 | 64.2° | 93.2° |
| C59 | C58 | C57 | H96 | 1.8° | 0.5° |
| C59 | C58 | C57 | H97 | 117.4° | 120.6° |
| C58 | C59 | C60 | H100 | 174.6° | 146.8° |
| C58 | C59 | C60 | H99 | 57.1° | 26.8° |
| C58 | C59 | C76 | H126 | 180.0° | 90.0° |
| C58 | C59 | C76 | H127 | 60.0° | 150.0° |
| C58 | C59 | C76 | H128 | 60.0° | 30.0° |
| C59 | C60 | C61 | H100 | 121.2° | 119.9° |
| C59 | C60 | C61 | H99 | 121.2° | 120.0° |
| C59 | C60 | C61 | C62 | 150.7° | 180.0° |
| C60 | C59 | C58 | H98 | 179.8° | 173.7° |
| C59 | C60 | H100 | H99 | 116.1° | 120.0° |
| C59 | C60 | C61 | H101 | 88.4° | 60.0° |
| C59 | C60 | C61 | H102 | 29.8° | 60.0° |
| C60 | C59 | C76 | H126 | 0.5° | 89.9° |
| C60 | C59 | C76 | H127 | 120.5° | 30.0° |
| C60 | C59 | C76 | H128 | 119.5° | 150.0° |
| C60 | C61 | C62 | H101 | 120.9° | 120.0° |
| C60 | C61 | C62 | H102 | 120.9° | 120.0° |
| C60 | C61 | C62 | C63 | 62.6° | 124.0° |
| C61 | C60 | C59 | C76 | 116.3° | 86.8° |
| C61 | C60 | H100 | H99 | 116.1° | 120.0° |
| C60 | C61 | H101 | H102 | 117.2° | 120.0° |
| C60 | C61 | C62 | H103 | 117.4° | 56.0° |
| C61 | C62 | C63 | H103 | 180.0° | 180.0° |
| C61 | C62 | C63 | C64 | 0.6° | 0.5° |
| C61 | C62 | C63 | C65 | 179.1° | 179.5° |
| C62 | C61 | C60 | H100 | 29.5° | 60.0° |
| C62 | C61 | C60 | H99 | 88.1° | 60.0° |
| C62 | C61 | H101 | H102 | 117.2° | 120.0° |
| C62 | C63 | C64 | C65 | 179.7° | 180.0° |
| C62 | C63 | C65 | C66 | 120.9° | 95.0° |
| C63 | C62 | C61 | H101 | 58.3° | 116.0° |
| C63 | C62 | C61 | H102 | 176.5° | 3.9° |
| C62 | C63 | C64 | H104 | 180.0° | 84.6° |
| C62 | C63 | C64 | H105 | 60.0° | 155.4° |
| C62 | C63 | C64 | H106 | 60.0° | 35.4° |
| C62 | C63 | C65 | H107 | 0.0° | 145.0° |
| C62 | C63 | C65 | H108 | 118.3° | 25.0° |
| C64 | C63 | C65 | C66 | 58.9° | 85.0° |
| C64 | C63 | C62 | H103 | 179.4° | 179.5° |
| C63 | C64 | H104 | H105 | 120.0° | 120.0° |
| C63 | C64 | H104 | H106 | 120.0° | 119.9° |
| C63 | C64 | H105 | H106 | 120.0° | 119.9° |
| C64 | C63 | C65 | H107 | 179.7° | 35.0° |
| C64 | C63 | C65 | H108 | 62.0° | 155.0° |
| C63 | C65 | C66 | H107 | 120.9° | 120.0° |
| C63 | C65 | C66 | H108 | 120.8° | 120.0° |
| C63 | C65 | C66 | C67 | 158.3° | 180.0° |
| C65 | C63 | C62 | H103 | 0.9° | 0.5° |
| C65 | C63 | C64 | H104 | 0.3° | 95.4° |
| C65 | C63 | C64 | H105 | 120.3° | 24.6° |
| C65 | C63 | C64 | H106 | 119.7° | 144.6° |
| C63 | C65 | H107 | H108 | 117.3° | 120.0° |
| C63 | C65 | C66 | H109 | 81.2° | 60.1° |
| C63 | C65 | C66 | H110 | 37.9° | 60.0° |
| C65 | C66 | C67 | H109 | 120.4° | 119.9° |
| C65 | C66 | C67 | H110 | 120.4° | 120.0° |
| C65 | C66 | C67 | C68 | 107.9° | 124.0° |
| C66 | C65 | H107 | H108 | 117.3° | 120.0° |
| C65 | C66 | H109 | H110 | 118.7° | 120.0° |
| C65 | C66 | C67 | H111 | 72.0° | 56.0° |
| C66 | C67 | C68 | H111 | 180.0° | 180.0° |
| C66 | C67 | C68 | C69 | 179.8° | 174.1° |
| C66 | C67 | C68 | C75 | 0.7° | 6.0° |
| C67 | C66 | C65 | H107 | 37.5° | 60.0° |
| C67 | C66 | C65 | H108 | 80.8° | 60.0° |
| C67 | C66 | H109 | H110 | 118.8° | 120.0° |
| C67 | C68 | C69 | C75 | 179.2° | 180.0° |
| C67 | C68 | C69 | C70 | 129.5° | 95.0° |
| C68 | C67 | C66 | H109 | 12.5° | 4.0° |
| C68 | C67 | C66 | H110 | 131.7° | 116.0° |
| C67 | C68 | C69 | H112 | 8.6° | 145.0° |
| C67 | C68 | C69 | H113 | 109.7° | 25.0° |
| C67 | C68 | C75 | H123 | 180.0° | 84.6° |
| C67 | C68 | C75 | H124 | 60.0° | 155.4° |
| C67 | C68 | C75 | H125 | 60.0° | 35.4° |
| C68 | C69 | C70 | H112 | 120.9° | 120.0° |
| C68 | C69 | C70 | H113 | 120.9° | 120.0° |
| C68 | C69 | C70 | C71 | 60.1° | 180.0° |
| C69 | C68 | C67 | H111 | 0.1° | 6.0° |
| C68 | C69 | H112 | H113 | 117.2° | 120.0° |
| C68 | C69 | C70 | H114 | 179.2° | 60.0° |
| C68 | C69 | C70 | H115 | 60.6° | 60.0° |
| C69 | C68 | C75 | H123 | 0.8° | 95.5° |
| C69 | C68 | C75 | H124 | 119.2° | 24.5° |
| C69 | C68 | C75 | H125 | 120.8° | 144.6° |
| C69 | C70 | C71 | H114 | 120.7° | 120.0° |
| C69 | C70 | C71 | H115 | 120.7° | 120.0° |
| C69 | C70 | C71 | C72 | 177.7° | 119.7° |
| C70 | C69 | C68 | C75 | 51.3° | 85.0° |
| C70 | C69 | H112 | H113 | 117.2° | 120.0° |
| C69 | C70 | H114 | H115 | 117.8° | 120.0° |
| C69 | C70 | C71 | H116 | 2.3° | 60.3° |
| C70 | C71 | C72 | H116 | 180.0° | 180.0° |
| C70 | C71 | C72 | C73 | 179.6° | 7.5° |
| C70 | C71 | C72 | C74 | 0.4° | 172.5° |
| C71 | C70 | C69 | H112 | 60.8° | 60.0° |
| C71 | C70 | C69 | H113 | 179.1° | 60.0° |
| C71 | C70 | H114 | H115 | 117.8° | 120.0° |
| C71 | C72 | C73 | C74 | 180.0° | 180.0° |
| C72 | C71 | C70 | H114 | 57.0° | 0.2° |
| C72 | C71 | C70 | H115 | 61.6° | 120.3° |
| C71 | C72 | C73 | H117 | 180.0° | 5.1° |
| C71 | C72 | C73 | H118 | 60.0° | 114.9° |
| C71 | C72 | C73 | H119 | 60.0° | 125.1° |
| C71 | C72 | C74 | H120 | 180.0° | 90.0° |
| C71 | C72 | C74 | H121 | 60.0° | 150.0° |
| C71 | C72 | C74 | H122 | 60.0° | 30.0° |
| C73 | C72 | C71 | H116 | 0.4° | 172.5° |
| C72 | C73 | H117 | H118 | 120.0° | 120.0° |
| C72 | C73 | H117 | H119 | 120.0° | 120.0° |
| C72 | C73 | H118 | H119 | 120.0° | 120.0° |
| C73 | C72 | C74 | H120 | 0.0° | 90.0° |
| C73 | C72 | C74 | H121 | 120.0° | 30.0° |
| C73 | C72 | C74 | H122 | 120.0° | 150.0° |
| C74 | C72 | C71 | H116 | 179.6° | 7.5° |
| C74 | C72 | C73 | H117 | 0.0° | 175.0° |
| C74 | C72 | C73 | H118 | 120.0° | 65.0° |
| C74 | C72 | C73 | H119 | 120.0° | 54.9° |
| C72 | C74 | H120 | H121 | 120.0° | 120.0° |
| C72 | C74 | H120 | H122 | 120.0° | 120.1° |
| C72 | C74 | H121 | H122 | 120.0° | 120.1° |
| C75 | C68 | C67 | H111 | 179.3° | 174.0° |
| C75 | C68 | C69 | H112 | 172.2° | 35.1° |
| C75 | C68 | C69 | H113 | 69.6° | 155.1° |
| C68 | C75 | H123 | H124 | 120.0° | 120.0° |
| C68 | C75 | H123 | H125 | 120.0° | 120.0° |
| C68 | C75 | H124 | H125 | 120.0° | 120.1° |
| C76 | C59 | C58 | H98 | 0.3° | 6.2° |
| C76 | C59 | C60 | H100 | 4.9° | 33.2° |
| C76 | C59 | C60 | H99 | 122.5° | 153.2° |
| C59 | C76 | H126 | H127 | 120.0° | 119.9° |
| C59 | C76 | H126 | H128 | 120.0° | 120.0° |
| C59 | C76 | H127 | H128 | 120.0° | 120.0° |
| O47 | P2 | O45 | H141 | 0.0° | 180.0° |
| O49 | P1 | O48 | H142 | 0.0° | 180.0° |
| C51 | C77 | N1 | C80 | 124.2° | 119.7° |
| C51 | C77 | N1 | H129 | 117.8° | 120.1° |
| C51 | C77 | N1 | C78 | 117.4° | 85.0° |
| C51 | C77 | C80 | C48 | 51.9° | 57.0° |
| C51 | C77 | C80 | O51 | 173.9° | 176.8° |
| C51 | C77 | C80 | H129 | 117.0° | 120.0° |
| C51 | C77 | N1 | H130 | 62.6° | 95.3° |
| C51 | C77 | C80 | H134 | 66.9° | 62.8° |
| C77 | N1 | C78 | H130 | 180.0° | 179.7° |
| C77 | N1 | C78 | C79 | 179.8° | 179.8° |
| C77 | N1 | C78 | O50 | 0.2° | 0.3° |
| N1 | C77 | C80 | C48 | 176.5° | 176.9° |
| N1 | C77 | C80 | O51 | 61.6° | 63.3° |
| N1 | C77 | C80 | H129 | 118.5° | 120.1° |
| N1 | C77 | C51 | H85 | 56.2° | 62.5° |
| N1 | C77 | C80 | H134 | 57.6° | 57.1° |
| N1 | C78 | C79 | O50 | 180.0° | 179.9° |
| C78 | N1 | C77 | C80 | 118.4° | 155.3° |
| C78 | N1 | C77 | H129 | 0.4° | 35.1° |
| N1 | C78 | C79 | H131 | 180.0° | 89.9° |
| N1 | C78 | C79 | H132 | 60.0° | 150.0° |
| N1 | C78 | C79 | H133 | 60.0° | 30.0° |
| C79 | C78 | N1 | H130 | 0.2° | 0.1° |
| C78 | C79 | H131 | H132 | 120.0° | 120.0° |
| C78 | C79 | H131 | H133 | 120.0° | 120.0° |
| C78 | C79 | H132 | H133 | 120.0° | 119.9° |
| O50 | C78 | N1 | H130 | 179.8° | 180.0° |
| O50 | C78 | C79 | H131 | 0.0° | 90.0° |
| O50 | C78 | C79 | H132 | 120.0° | 30.1° |
| O50 | C78 | C79 | H133 | 120.0° | 150.1° |
| C48 | C80 | O51 | C77 | 121.8° | 119.5° |
| C48 | C80 | O51 | H134 | 120.0° | 120.2° |
| C48 | C80 | C77 | H134 | 118.8° | 119.8° |
| C80 | C48 | C49 | H81 | 64.7° | 62.3° |
| C48 | C80 | C77 | H129 | 65.0° | 63.0° |
| C48 | C80 | O51 | H135 | 180.0° | 175.4° |
| O51 | C80 | C77 | H134 | 119.2° | 120.3° |
| O51 | C80 | C48 | H80 | 51.8° | 56.9° |
| O51 | C80 | C77 | H129 | 57.0° | 56.8° |
| C47 | C81 | N2 | C1 | 121.0° | 119.7° |
| C47 | C81 | N2 | H136 | 119.7° | 120.2° |
| C47 | C81 | N2 | C82 | 121.6° | 85.3° |
| C47 | C81 | C1 | H136 | 117.7° | 119.9° |
| C47 | C81 | C1 | H2 | 60.1° | 62.8° |
| C47 | C81 | N2 | H137 | 58.4° | 94.7° |
| C81 | N2 | C82 | H137 | 180.0° | 180.0° |
| C81 | N2 | C82 | C83 | 179.5° | 180.0° |
| C81 | N2 | C82 | O52 | 0.3° | 0.0° |
| N2 | C81 | C1 | H136 | 119.8° | 120.2° |
| N2 | C81 | C1 | H2 | 62.4° | 57.1° |
| N2 | C81 | C47 | H79 | 57.6° | 57.5° |
| N2 | C82 | C83 | O52 | 179.8° | 180.0° |
| C82 | N2 | C81 | C1 | 117.4° | 155.0° |
| C82 | N2 | C81 | H136 | 1.9° | 34.9° |
| N2 | C82 | C83 | H138 | 179.8° | 90.0° |
| N2 | C82 | C83 | H139 | 59.8° | 150.0° |
| N2 | C82 | C83 | H140 | 60.2° | 29.9° |
| C83 | C82 | N2 | H137 | 0.5° | 0.0° |
| C82 | C83 | H138 | H139 | 120.0° | 120.0° |
| C82 | C83 | H138 | H140 | 120.0° | 120.0° |
| C82 | C83 | H139 | H140 | 120.0° | 120.1° |
| O52 | C82 | N2 | H137 | 179.7° | 180.0° |
| O52 | C82 | C83 | H138 | 0.0° | 90.0° |
| O52 | C82 | C83 | H139 | 120.0° | 30.0° |
| O52 | C82 | C83 | H140 | 120.0° | 150.0° |
| C81 | C1 | C2 | H3 | 58.2° | 63.0° |
| C81 | C1 | O1 | H1 | 58.5° | 60.5° |
| C1 | C81 | N2 | H137 | 62.6° | 25.0° |
| C1 | C81 | C47 | H79 | 64.5° | 62.4° |
| C32 | C4 | C3 | H4 | 59.0° | 62.4° |
| C4 | C32 | C31 | H51 | 67.7° | 62.9° |
| C32 | C4 | O3 | H6 | 59.6° | 180.0° |
| C18 | C8 | C7 | H10 | 179.8° | 177.6° |
| C8 | C18 | C17 | H27 | 63.8° | 63.0° |
| C18 | C8 | O6 | H12 | 60.3° | 179.7° |
| C12 | C16 | C15 | H23 | 64.8° | 62.9° |
| C16 | C12 | C11 | H16 | 173.6° | 177.6° |
| C12 | C16 | O13 | H26 | 57.6° | 60.4° |
| C16 | C12 | O9 | H18 | 57.8° | 179.7° |
| C20 | C30 | C29 | H47 | 55.4° | 63.0° |
| C30 | C20 | C19 | H30 | 172.3° | 177.6° |
| C20 | C30 | O25 | H50 | 60.8° | 180.0° |
| C26 | C22 | C21 | H32 | 178.6° | 177.6° |
| C22 | C26 | C25 | H39 | 67.7° | 62.9° |
| C26 | C22 | O17 | H34 | 58.8° | 179.7° |
| C22 | C26 | O21 | H42 | 57.8° | 60.0° |
| O34 | C33 | C34 | H55 | 177.3° | 177.6° |
| C33 | O34 | C43 | H69 | 65.6° | 58.8° |
| O30 | C35 | C36 | H57 | 175.1° | 177.6° |
| C35 | O30 | C39 | H61 | 56.9° | 58.8° |
| C80 | C77 | N1 | H130 | 61.6° | 24.4° |
| C77 | C80 | C48 | H80 | 68.5° | 62.9° |
| C80 | C77 | C51 | H85 | 179.1° | 177.6° |
| C77 | C80 | O51 | H135 | 58.2° | 55.9° |
| H130 | N1 | C77 | H129 | 179.6° | 144.6° |
| H5 | C4 | C3 | H4 | 59.4° | 57.6° |
| H5 | C4 | C32 | H53 | 49.8° | 57.0° |
| H5 | C4 | O3 | H6 | 60.1° | 59.9° |
| H7 | C5 | C6 | H8 | 71.0° | 66.6° |
| H7 | C5 | C6 | H9 | 49.3° | 53.4° |
| H7 | C5 | C31 | H51 | 176.0° | 177.7° |
| H10 | C7 | C8 | H11 | 62.1° | 62.4° |
| H11 | C8 | C18 | H29 | 57.8° | 57.1° |
| H11 | C8 | O6 | H12 | 59.9° | 60.1° |
| H14 | C10 | C9 | H13 | 59.9° | 65.0° |
| H15 | C10 | C9 | H13 | 59.9° | 175.0° |
| H19 | C13 | C15 | H23 | 177.2° | 177.7° |
| H19 | C13 | C14 | H20 | 61.7° | 65.0° |
| H19 | C13 | C14 | H21 | 178.9° | 174.9° |
| H23 | C15 | C16 | H25 | 176.6° | 177.1° |
| H23 | C15 | O12 | H24 | 60.6° | 60.0° |
| H27 | C17 | C18 | H29 | 177.0° | 177.1° |
| H27 | C17 | C9 | H13 | 173.7° | 177.6° |
| H27 | C17 | O14 | H28 | 61.1° | 59.8° |
| H31 | C20 | C19 | H30 | 65.2° | 62.5° |
| H31 | C20 | C30 | H49 | 59.5° | 57.1° |
| H32 | C21 | C22 | H33 | 63.3° | 62.5° |
| H33 | C22 | C26 | H41 | 54.6° | 57.0° |
| H33 | C22 | O17 | H34 | 60.8° | 60.1° |
| H36 | C24 | C23 | H35 | 65.8° | 65.0° |
| H36 | C24 | O19 | H38 | 59.9° | 60.0° |
| H37 | C24 | C23 | H35 | 174.3° | 175.0° |
| H37 | C24 | O19 | H38 | 59.9° | 60.0° |
| H41 | C26 | C25 | H39 | 173.7° | 177.1° |
| H41 | C26 | O21 | H42 | 61.0° | 60.3° |
| H44 | C28 | C27 | H43 | 180.0° | 65.0° |
| H44 | C28 | O23 | H46 | 59.7° | 60.0° |
| H45 | C28 | C27 | H43 | 60.5° | 174.9° |
| H45 | C28 | O23 | H46 | 59.8° | 60.0° |
| H2 | C1 | C2 | H3 | 176.5° | 177.1° |
| H2 | C1 | O1 | H1 | 58.9° | 59.8° |
| H2 | C1 | C81 | H136 | 177.7° | 177.2° |
| H3 | C2 | C45 | H75 | 178.4° | 177.6° |
| H54 | C33 | C34 | H55 | 56.9° | 62.4° |
| H53 | C32 | C31 | H51 | 171.2° | 177.2° |
| H51 | C31 | O26 | H52 | 61.2° | 60.1° |
| H39 | C25 | C23 | H35 | 172.9° | 177.7° |
| H39 | C25 | O20 | H40 | 61.3° | 60.2° |
| H56 | C35 | C36 | H57 | 64.6° | 62.5° |
| H43 | C27 | C29 | H47 | 173.0° | 177.6° |
| H47 | C29 | C30 | H49 | 174.0° | 177.1° |
| H47 | C29 | O24 | H48 | 59.3° | 60.1° |
| H25 | C16 | C12 | H17 | 52.5° | 57.0° |
| H25 | C16 | O13 | H26 | 61.0° | 59.8° |
| H16 | C11 | C12 | H17 | 68.2° | 62.4° |
| H17 | C12 | O9 | H18 | 61.5° | 60.1° |
| H137 | N2 | C81 | H136 | 178.1° | 145.1° |
| H55 | C34 | C41 | H67 | 67.1° | 57.1° |
| H20 | C14 | O11 | H22 | 59.7° | 60.0° |
| H21 | C14 | O11 | H22 | 59.7° | 60.0° |
| H49 | C30 | O25 | H50 | 59.3° | 59.7° |
| H57 | C36 | C37 | H59 | 60.5° | 57.0° |
| H57 | C36 | O29 | H58 | 60.2° | 60.1° |
| H59 | C37 | C38 | H60 | 173.5° | 177.3° |
| H59 | C37 | O33 | H66 | 60.2° | 60.2° |
| H60 | C38 | C39 | H61 | 175.7° | 177.8° |
| H60 | C38 | O32 | H65 | 58.0° | 60.2° |
| H61 | C39 | C40 | H62 | 62.8° | 65.0° |
| H61 | C39 | C40 | H63 | 177.3° | 174.9° |
| H62 | C40 | O31 | H64 | 59.9° | 60.1° |
| H63 | C40 | O31 | H64 | 60.0° | 60.0° |
| H67 | C41 | C42 | H68 | 175.6° | 177.2° |
| H67 | C41 | O37 | H74 | 60.4° | 59.8° |
| H68 | C42 | C43 | H69 | 175.3° | 177.7° |
| H68 | C42 | O36 | H73 | 59.8° | 59.9° |
| H69 | C43 | C44 | H70 | 61.8° | 65.0° |
| H69 | C43 | C44 | H71 | 178.7° | 175.0° |
| H70 | C44 | O35 | H72 | 59.7° | 60.0° |
| H71 | C44 | O35 | H72 | 59.8° | 59.9° |
| H75 | C45 | C46 | H76 | 177.9° | 65.3° |
| H75 | C45 | C46 | H77 | 58.4° | 174.6° |
| H76 | C46 | O38 | H78 | 59.8° | 59.9° |
| H77 | C46 | O38 | H78 | 59.8° | 60.1° |
| H79 | C47 | C81 | H136 | 177.8° | 177.7° |
| H80 | C48 | C49 | H81 | 176.9° | 177.7° |
| H80 | C48 | C80 | H134 | 172.7° | 177.2° |
| H81 | C49 | C50 | H82 | 59.9° | 66.9° |
| H81 | C49 | C50 | H83 | 59.6° | 173.0° |
| H82 | C50 | O41 | H84 | 59.7° | 60.0° |
| H83 | C50 | O41 | H84 | 59.7° | 60.0° |
| H85 | C51 | C77 | H129 | 62.1° | 57.6° |
| H86 | C52 | C53 | H88 | 178.7° | 60.1° |
| H86 | C52 | C53 | H89 | 63.5° | 180.0° |
| H87 | C52 | C53 | H88 | 58.6° | 179.9° |
| H87 | C52 | C53 | H89 | 176.5° | 60.0° |
| H88 | C53 | C54 | H90 | 179.9° | 175.0° |
| H89 | C53 | C54 | H90 | 62.0° | 65.0° |
| H90 | C54 | C55 | H91 | 63.1° | 180.0° |
| H90 | C54 | C55 | H92 | 56.9° | 59.9° |
| H90 | C54 | C55 | H93 | 176.8° | 60.0° |
| H90 | C54 | C56 | H94 | 174.4° | 175.0° |
| H90 | C54 | C56 | H95 | 67.1° | 65.0° |
| H91 | C55 | H92 | H93 | 120.0° | 120.0° |
| H94 | C56 | C57 | H96 | 160.7° | 180.0° |
| H94 | C56 | C57 | H97 | 80.1° | 60.0° |
| H95 | C56 | C57 | H96 | 42.2° | 60.0° |
| H95 | C56 | C57 | H97 | 161.4° | 180.0° |
| H96 | C57 | C58 | H98 | 178.2° | 179.5° |
| H97 | C57 | C58 | H98 | 62.7° | 59.5° |
| H100 | C60 | C61 | H101 | 150.3° | 180.0° |
| H100 | C60 | C61 | H102 | 91.4° | 60.0° |
| H99 | C60 | C61 | H101 | 32.8° | 60.0° |
| H99 | C60 | C61 | H102 | 151.0° | 180.0° |
| H101 | C61 | C62 | H103 | 121.7° | 64.0° |
| H102 | C61 | C62 | H103 | 3.5° | 176.1° |
| H104 | C64 | H105 | H106 | 120.0° | 120.1° |
| H107 | C65 | C66 | H109 | 157.9° | 180.0° |
| H107 | C65 | C66 | H110 | 82.9° | 60.0° |
| H108 | C65 | C66 | H109 | 39.6° | 60.0° |
| H108 | C65 | C66 | H110 | 158.8° | 180.0° |
| H109 | C66 | C67 | H111 | 167.5° | 175.9° |
| H110 | C66 | C67 | H111 | 48.4° | 64.0° |
| H112 | C69 | C70 | H114 | 59.9° | 180.0° |
| H112 | C69 | C70 | H115 | 178.5° | 60.0° |
| H113 | C69 | C70 | H114 | 58.3° | 60.0° |
| H113 | C69 | C70 | H115 | 60.3° | 180.0° |
| H114 | C70 | C71 | H116 | 123.0° | 179.7° |
| H115 | C70 | C71 | H116 | 118.4° | 59.7° |
| H117 | C73 | H118 | H119 | 120.0° | 120.0° |
| H120 | C74 | H121 | H122 | 120.0° | 120.0° |
| H123 | C75 | H124 | H125 | 120.0° | 120.0° |
| H126 | C76 | H127 | H128 | 120.0° | 120.0° |
| H129 | C77 | C80 | H134 | 176.1° | 177.2° |
| H131 | C79 | H132 | H133 | 120.0° | 120.0° |
| H134 | C80 | O51 | H135 | 60.0° | 64.4° |
| H138 | C83 | H139 | H140 | 120.0° | 119.9° |
