A1JMC
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 | 1.43Å | |
| 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 | 1.45Å | |
| 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 | 1.42Å | |
| C9 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | O9 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | O10 | sing | 1.43Å | 1.44Å | |
| O10 | C13 | sing | 1.43Å | 1.40Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C14 | O11 | sing | 1.43Å | 1.45Å | |
| O11 | C15 | sing | 1.43Å | 1.40Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | O12 | sing | 1.43Å | 1.42Å | |
| C15 | O13 | sing | 1.43Å | 1.43Å | |
| O13 | C17 | sing | 1.43Å | 1.44Å | |
| C17 | C18 | sing | 1.53Å | 1.51Å | |
| C18 | O14 | sing | 1.43Å | 1.42Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C19 | O15 | sing | 1.43Å | 1.43Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | O16 | sing | 1.43Å | 1.43Å | |
| C13 | O17 | sing | 1.43Å | 1.43Å | |
| O17 | C21 | sing | 1.43Å | 1.44Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C22 | O18 | sing | 1.43Å | 1.42Å | |
| C21 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | O19 | sing | 1.43Å | 1.43Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C24 | O20 | sing | 1.43Å | 1.43Å | |
| C5 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | O21 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C26 | O22 | sing | 1.43Å | 1.44Å | |
| O22 | C27 | sing | 1.43Å | 1.40Å | |
| C27 | C28 | sing | 1.53Å | 1.53Å | |
| C28 | O23 | sing | 1.43Å | 1.45Å | |
| O23 | C29 | sing | 1.43Å | 1.40Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C30 | O24 | sing | 1.43Å | 1.45Å | |
| O24 | C31 | sing | 1.43Å | 1.40Å | |
| C31 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | O25 | sing | 1.43Å | 1.42Å | |
| C31 | O26 | sing | 1.43Å | 1.43Å | |
| O26 | C33 | sing | 1.43Å | 1.44Å | |
| C33 | C34 | sing | 1.53Å | 1.51Å | |
| C34 | O27 | sing | 1.43Å | 1.42Å | |
| C33 | C35 | sing | 1.53Å | 1.53Å | |
| C35 | O28 | sing | 1.43Å | 1.43Å | |
| C35 | C36 | sing | 1.53Å | 1.52Å | |
| C36 | O29 | sing | 1.43Å | 1.43Å | |
| C30 | C37 | sing | 1.53Å | 1.52Å | |
| C37 | C38 | sing | 1.53Å | 1.51Å | |
| 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 | 1.42Å | |
| C37 | O33 | sing | 1.43Å | 1.43Å | |
| C28 | 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 | 1.43Å | |
| O39 | C47 | sing | 1.43Å | 1.42Å | |
| C47 | O40 | sing | 1.43Å | 1.40Å | |
| O40 | C48 | sing | 1.43Å | 1.43Å | |
| 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 | 1.42Å | |
| C51 | O43 | sing | 1.43Å | 1.40Å | |
| O43 | P1 | sing | 1.61Å | 1.60Å | |
| P1 | O44 | sing | 1.61Å | 1.60Å | |
| O44 | P2 | sing | 1.61Å | 1.60Å | |
| P2 | O45 | sing | 1.61Å | 1.48Å | |
| P2 | O46 | sing | 1.61Å | 1.59Å | |
| 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 | 1.52Å | |
| C56 | C57 | sing | 1.53Å | 1.53Å | |
| C57 | C58 | sing | 1.51Å | 1.50Å | |
| C58 | C59 | doub | 1.31Å | 1.33Å | |
| C59 | C60 | sing | 1.51Å | 1.51Å | |
| C60 | C61 | sing | 1.53Å | 1.54Å | |
| C61 | C62 | sing | 1.51Å | 1.50Å | |
| C62 | C63 | doub | 1.31Å | 1.33Å | |
| 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 | 1.51Å | |
| 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 | 1.46Å | 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 | 1.52Å | |
| 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 | C26 | sing | 1.53Å | 1.53Å | |
| C8 | C12 | sing | 1.53Å | 1.53Å | |
| C14 | C24 | sing | 1.53Å | 1.52Å | |
| C16 | C20 | sing | 1.53Å | 1.52Å | |
| C27 | O34 | sing | 1.43Å | 1.43Å | |
| C29 | O30 | sing | 1.43Å | 1.43Å | |
| C32 | C36 | sing | 1.53Å | 1.52Å | |
| C77 | C80 | sing | 1.53Å | 1.53Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| 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 | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C20 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H33 | sing | 1.09Å | 1.10Å | |
| O6 | H12 | sing | 0.97Å | 0.95Å | |
| O9 | H18 | sing | 0.97Å | 0.95Å | |
| O12 | H24 | sing | 0.97Å | 0.95Å | |
| O14 | H28 | sing | 0.97Å | 0.95Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C23 | H37 | sing | 1.09Å | 1.10Å | |
| C24 | H39 | sing | 1.09Å | 1.10Å | |
| C25 | H41 | sing | 1.09Å | 1.10Å | |
| C26 | H43 | sing | 1.09Å | 1.10Å | |
| C27 | H44 | sing | 1.09Å | 1.10Å | |
| C28 | H45 | sing | 1.09Å | 1.10Å | |
| C29 | H46 | sing | 1.09Å | 1.10Å | |
| C30 | H47 | sing | 1.09Å | 1.10Å | |
| C31 | H48 | sing | 1.09Å | 1.10Å | |
| C32 | H49 | sing | 1.09Å | 1.10Å | |
| C33 | H51 | sing | 1.09Å | 1.10Å | |
| C34 | H52 | sing | 1.09Å | 1.10Å | |
| C34 | H53 | sing | 1.09Å | 1.10Å | |
| C35 | H55 | 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 | |
| N1 | H130 | sing | 0.97Å | 1.00Å | |
| N2 | H137 | sing | 0.97Å | 1.00Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| O15 | H30 | sing | 0.97Å | 0.95Å | |
| O16 | H32 | sing | 0.97Å | 0.95Å | |
| O18 | H36 | 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 | |
| O25 | H50 | sing | 0.97Å | 0.95Å | |
| O27 | H54 | sing | 0.97Å | 0.95Å | |
| O28 | H56 | sing | 0.97Å | 0.95Å | |
| O29 | H58 | sing | 0.97Å | 0.95Å | |
| O3 | H6 | 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 | |
| O8 | H16 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 111.0° | 109.6° |
| O1 | C1 | C81 | 108.7° | 109.6° |
| O1 | C1 | H2 | 110.0° | 109.6° |
| C1 | O1 | H1 | 109.5° | 114.0° |
| C1 | C2 | O2 | 112.9° | 109.5° |
| C1 | C2 | C45 | 108.3° | 109.2° |
| C2 | C1 | C81 | 109.9° | 109.0° |
| C2 | C1 | H2 | 108.6° | 109.5° |
| C1 | C2 | H3 | 110.2° | 109.5° |
| C2 | O2 | C3 | 124.8° | 114.0° |
| O2 | C2 | C45 | 103.6° | 109.5° |
| O2 | C2 | H3 | 111.5° | 109.5° |
| O2 | C3 | C4 | 105.1° | 109.5° |
| O2 | C3 | O4 | 115.6° | 109.4° |
| O2 | C3 | H4 | 109.5° | 109.5° |
| C3 | C4 | O3 | 109.8° | 109.6° |
| C4 | C3 | O4 | 109.5° | 109.4° |
| C3 | C4 | C26 | 109.4° | 109.2° |
| C4 | C3 | H4 | 107.8° | 109.5° |
| C3 | C4 | H5 | 108.7° | 109.6° |
| O3 | C4 | C26 | 110.3° | 109.5° |
| O3 | C4 | H5 | 110.0° | 109.5° |
| C4 | O3 | H6 | 109.5° | 114.0° |
| C3 | O4 | C5 | 112.5° | 114.1° |
| O4 | C3 | H4 | 109.1° | 109.5° |
| O4 | C5 | C6 | 106.9° | 109.5° |
| O4 | C5 | C25 | 109.7° | 109.4° |
| O4 | C5 | H7 | 109.8° | 109.5° |
| C5 | C6 | O5 | 109.9° | 109.5° |
| C6 | C5 | C25 | 113.2° | 109.5° |
| C6 | C5 | H7 | 108.8° | 109.5° |
| C5 | C6 | H8 | 109.4° | 109.4° |
| C5 | C6 | H9 | 109.4° | 109.5° |
| C6 | O5 | C7 | 116.0° | 114.0° |
| O5 | C6 | H8 | 109.3° | 109.4° |
| O5 | C6 | H9 | 109.4° | 109.5° |
| O5 | C7 | C8 | 107.9° | 109.5° |
| O5 | C7 | O7 | 112.5° | 109.5° |
| O5 | C7 | H10 | 109.2° | 109.5° |
| C7 | C8 | O6 | 110.1° | 109.5° |
| C8 | C7 | O7 | 110.6° | 109.4° |
| C7 | C8 | C12 | 110.7° | 109.2° |
| C8 | C7 | H10 | 107.6° | 109.5° |
| C7 | C8 | H11 | 108.1° | 109.5° |
| O6 | C8 | C12 | 110.1° | 109.5° |
| O6 | C8 | H11 | 109.5° | 109.5° |
| C8 | O6 | H12 | 109.5° | 114.0° |
| C7 | O7 | C9 | 113.9° | 114.1° |
| O7 | C7 | H10 | 108.9° | 109.5° |
| O7 | C9 | C10 | 106.7° | 109.5° |
| O7 | C9 | C11 | 110.2° | 109.5° |
| O7 | C9 | H13 | 109.8° | 109.5° |
| C9 | C10 | O8 | 111.2° | 109.5° |
| C10 | C9 | C11 | 112.6° | 109.5° |
| C10 | C9 | H13 | 108.8° | 109.4° |
| C9 | C10 | H14 | 109.1° | 109.5° |
| C9 | C10 | H15 | 109.0° | 109.5° |
| O8 | C10 | H14 | 109.0° | 109.4° |
| O8 | C10 | H15 | 109.0° | 109.4° |
| C10 | O8 | H16 | 109.5° | 114.0° |
| C9 | C11 | O9 | 109.3° | 109.6° |
| C9 | C11 | C12 | 110.1° | 109.1° |
| C11 | C9 | H13 | 108.6° | 109.5° |
| C9 | C11 | H17 | 109.0° | 109.5° |
| O9 | C11 | C12 | 109.1° | 109.5° |
| O9 | C11 | H17 | 110.4° | 109.5° |
| C11 | O9 | H18 | 109.5° | 114.0° |
| C11 | C12 | O10 | 108.3° | 109.5° |
| C11 | C12 | C8 | 109.8° | 109.0° |
| C12 | C11 | H17 | 109.0° | 109.6° |
| C11 | C12 | H19 | 109.0° | 109.5° |
| C12 | O10 | C13 | 118.1° | 114.0° |
| O10 | C12 | C8 | 110.5° | 109.6° |
| O10 | C12 | H19 | 110.2° | 109.6° |
| O10 | C13 | C14 | 106.9° | 109.5° |
| O10 | C13 | O17 | 115.8° | 109.5° |
| O10 | C13 | H20 | 107.7° | 109.5° |
| C13 | C14 | O11 | 106.4° | 109.5° |
| C14 | C13 | O17 | 112.5° | 109.4° |
| C13 | C14 | C24 | 109.4° | 109.2° |
| C14 | C13 | H20 | 106.1° | 109.5° |
| C13 | C14 | H21 | 109.6° | 109.5° |
| C14 | O11 | C15 | 119.3° | 114.0° |
| O11 | C14 | C24 | 110.8° | 109.5° |
| O11 | C14 | H21 | 110.8° | 109.5° |
| O11 | C15 | C16 | 108.6° | 109.5° |
| O11 | C15 | O13 | 112.6° | 109.5° |
| O11 | C15 | H22 | 109.3° | 109.4° |
| C15 | C16 | O12 | 109.7° | 109.5° |
| C16 | C15 | O13 | 109.8° | 109.5° |
| C15 | C16 | C20 | 111.2° | 109.2° |
| C16 | C15 | H22 | 107.6° | 109.5° |
| C15 | C16 | H23 | 107.9° | 109.5° |
| O12 | C16 | C20 | 110.8° | 109.5° |
| O12 | C16 | H23 | 109.2° | 109.5° |
| C16 | O12 | H24 | 109.5° | 114.0° |
| C15 | O13 | C17 | 112.8° | 114.1° |
| O13 | C15 | H22 | 108.8° | 109.5° |
| O13 | C17 | C18 | 107.0° | 109.5° |
| O13 | C17 | C19 | 109.5° | 109.4° |
| O13 | C17 | H25 | 109.8° | 109.5° |
| C17 | C18 | O14 | 111.7° | 109.4° |
| C18 | C17 | C19 | 113.1° | 109.5° |
| C18 | C17 | H25 | 108.8° | 109.5° |
| C17 | C18 | H26 | 108.9° | 109.4° |
| C17 | C18 | H27 | 108.9° | 109.5° |
| O14 | C18 | H26 | 108.9° | 109.5° |
| O14 | C18 | H27 | 108.9° | 109.5° |
| C18 | O14 | H28 | 109.5° | 114.0° |
| C17 | C19 | O15 | 109.4° | 109.5° |
| C17 | C19 | C20 | 111.1° | 109.2° |
| C19 | C17 | H25 | 108.6° | 109.4° |
| C17 | C19 | H29 | 108.3° | 109.5° |
| O15 | C19 | C20 | 110.0° | 109.5° |
| O15 | C19 | H29 | 109.6° | 109.5° |
| C19 | O15 | H30 | 109.5° | 114.0° |
| C19 | C20 | O16 | 110.2° | 109.5° |
| C19 | C20 | C16 | 112.3° | 109.1° |
| C20 | C19 | H29 | 108.4° | 109.6° |
| C19 | C20 | H31 | 108.0° | 109.6° |
| O16 | C20 | C16 | 109.2° | 109.5° |
| O16 | C20 | H31 | 109.2° | 109.5° |
| C20 | O16 | H32 | 109.5° | 114.0° |
| C13 | O17 | C21 | 116.2° | 114.1° |
| O17 | C13 | H20 | 107.3° | 109.5° |
| O17 | C21 | C22 | 106.8° | 109.5° |
| O17 | C21 | C23 | 110.5° | 109.5° |
| O17 | C21 | H33 | 109.6° | 109.5° |
| C21 | C22 | O18 | 111.3° | 109.4° |
| C22 | C21 | C23 | 112.8° | 109.5° |
| C22 | C21 | H33 | 108.7° | 109.5° |
| C21 | C22 | H34 | 109.0° | 109.5° |
| C21 | C22 | H35 | 109.0° | 109.5° |
| O18 | C22 | H34 | 109.0° | 109.4° |
| O18 | C22 | H35 | 109.0° | 109.5° |
| C22 | O18 | H36 | 109.5° | 114.0° |
| C21 | C23 | O19 | 109.8° | 109.5° |
| C21 | C23 | C24 | 107.0° | 109.1° |
| C23 | C21 | H33 | 108.5° | 109.4° |
| C21 | C23 | H37 | 109.3° | 109.5° |
| O19 | C23 | C24 | 110.6° | 109.6° |
| O19 | C23 | H37 | 110.7° | 109.6° |
| C23 | O19 | H38 | 109.5° | 114.0° |
| C23 | C24 | O20 | 110.8° | 109.5° |
| C23 | C24 | C14 | 108.4° | 109.0° |
| C24 | C23 | H37 | 109.5° | 109.6° |
| C23 | C24 | H39 | 108.9° | 109.5° |
| O20 | C24 | C14 | 109.8° | 109.5° |
| O20 | C24 | H39 | 110.1° | 109.6° |
| C24 | O20 | H40 | 109.5° | 114.0° |
| C5 | C25 | O21 | 110.8° | 109.5° |
| C5 | C25 | C26 | 110.3° | 109.2° |
| C25 | C5 | H7 | 108.5° | 109.5° |
| C5 | C25 | H41 | 109.3° | 109.5° |
| O21 | C25 | C26 | 106.1° | 109.5° |
| O21 | C25 | H41 | 110.8° | 109.5° |
| C25 | O21 | H42 | 109.5° | 114.0° |
| C25 | C26 | O22 | 108.7° | 109.5° |
| C25 | C26 | C4 | 109.9° | 109.0° |
| C26 | C25 | H41 | 109.4° | 109.5° |
| C25 | C26 | H43 | 108.8° | 109.5° |
| C26 | O22 | C27 | 117.6° | 114.0° |
| O22 | C26 | C4 | 110.6° | 109.6° |
| O22 | C26 | H43 | 110.0° | 109.6° |
| O22 | C27 | C28 | 108.1° | 109.5° |
| O22 | C27 | O34 | 116.6° | 109.5° |
| O22 | C27 | H44 | 107.2° | 109.5° |
| C27 | C28 | O23 | 105.6° | 109.5° |
| C27 | C28 | C41 | 109.0° | 109.2° |
| C28 | C27 | O34 | 111.8° | 109.4° |
| C28 | C27 | H44 | 105.7° | 109.5° |
| C27 | C28 | H45 | 110.2° | 109.5° |
| C28 | O23 | C29 | 119.1° | 114.0° |
| O23 | C28 | C41 | 109.9° | 109.5° |
| O23 | C28 | H45 | 111.5° | 109.5° |
| O23 | C29 | C30 | 108.4° | 109.5° |
| O23 | C29 | O30 | 116.3° | 109.5° |
| O23 | C29 | H46 | 107.3° | 109.5° |
| C29 | C30 | O24 | 105.3° | 109.5° |
| C29 | C30 | C37 | 108.3° | 109.1° |
| C30 | C29 | O30 | 111.7° | 109.4° |
| C30 | C29 | H46 | 105.7° | 109.4° |
| C29 | C30 | H47 | 110.4° | 109.5° |
| C30 | O24 | C31 | 119.0° | 114.0° |
| O24 | C30 | C37 | 110.4° | 109.5° |
| O24 | C30 | H47 | 111.7° | 109.6° |
| O24 | C31 | C32 | 109.3° | 109.5° |
| O24 | C31 | O26 | 117.0° | 109.5° |
| O24 | C31 | H48 | 107.0° | 109.5° |
| C31 | C32 | O25 | 109.8° | 109.6° |
| C32 | C31 | O26 | 110.6° | 109.4° |
| C31 | C32 | C36 | 111.5° | 109.2° |
| C32 | C31 | H48 | 105.5° | 109.5° |
| C31 | C32 | H49 | 107.8° | 109.5° |
| O25 | C32 | C36 | 110.6° | 109.5° |
| O25 | C32 | H49 | 109.2° | 109.6° |
| C32 | O25 | H50 | 109.5° | 114.0° |
| C31 | O26 | C33 | 115.3° | 114.1° |
| O26 | C31 | H48 | 106.6° | 109.5° |
| O26 | C33 | C34 | 106.7° | 109.5° |
| O26 | C33 | C35 | 110.5° | 109.5° |
| O26 | C33 | H51 | 109.6° | 109.4° |
| C33 | C34 | O27 | 111.3° | 109.5° |
| C34 | C33 | C35 | 112.9° | 109.5° |
| C34 | C33 | H51 | 108.7° | 109.5° |
| C33 | C34 | H52 | 109.0° | 109.5° |
| C33 | C34 | H53 | 109.0° | 109.5° |
| O27 | C34 | H52 | 109.0° | 109.5° |
| O27 | C34 | H53 | 109.0° | 109.5° |
| C34 | O27 | H54 | 109.5° | 114.0° |
| C33 | C35 | O28 | 109.3° | 109.6° |
| C33 | C35 | C36 | 110.0° | 109.2° |
| C35 | C33 | H51 | 108.5° | 109.5° |
| C33 | C35 | H55 | 108.5° | 109.5° |
| O28 | C35 | C36 | 110.6° | 109.5° |
| O28 | C35 | H55 | 109.8° | 109.5° |
| C35 | O28 | H56 | 109.5° | 114.0° |
| C35 | C36 | O29 | 110.3° | 109.5° |
| C35 | C36 | C32 | 111.3° | 109.0° |
| C36 | C35 | H55 | 108.5° | 109.5° |
| C35 | C36 | H57 | 108.1° | 109.5° |
| O29 | C36 | C32 | 109.7° | 109.6° |
| O29 | C36 | H57 | 109.3° | 109.7° |
| C36 | O29 | H58 | 109.5° | 114.0° |
| C30 | C37 | C38 | 108.5° | 109.0° |
| C30 | C37 | O33 | 109.5° | 109.5° |
| C37 | C30 | H47 | 110.7° | 109.5° |
| C30 | C37 | H59 | 108.9° | 109.6° |
| C37 | C38 | C39 | 107.2° | 109.2° |
| C37 | C38 | O32 | 110.4° | 109.5° |
| C38 | C37 | O33 | 110.7° | 109.5° |
| C38 | C37 | H59 | 109.0° | 109.5° |
| C37 | C38 | H60 | 109.5° | 109.5° |
| C38 | C39 | O30 | 110.6° | 109.4° |
| C38 | C39 | C40 | 112.8° | 109.5° |
| C39 | C38 | O32 | 109.7° | 109.5° |
| C39 | C38 | H60 | 109.3° | 109.5° |
| C38 | C39 | H61 | 108.4° | 109.5° |
| O30 | C39 | C40 | 106.9° | 109.5° |
| C39 | O30 | C29 | 115.9° | 114.1° |
| O30 | C39 | H61 | 109.6° | 109.5° |
| C39 | C40 | O31 | 111.4° | 109.5° |
| C40 | C39 | H61 | 108.6° | 109.5° |
| C39 | C40 | H62 | 109.0° | 109.5° |
| C39 | C40 | H63 | 109.0° | 109.5° |
| O31 | C40 | H62 | 109.0° | 109.4° |
| O31 | C40 | H63 | 109.0° | 109.5° |
| C40 | O31 | H64 | 109.5° | 114.1° |
| O32 | C38 | H60 | 110.7° | 109.6° |
| C38 | O32 | H65 | 109.5° | 114.0° |
| O33 | C37 | H59 | 110.2° | 109.6° |
| C37 | O33 | H66 | 109.5° | 114.0° |
| C28 | C41 | C42 | 109.4° | 109.0° |
| C28 | C41 | O37 | 109.3° | 109.6° |
| C41 | C28 | H45 | 110.5° | 109.6° |
| C28 | C41 | H67 | 108.7° | 109.5° |
| C41 | C42 | C43 | 107.4° | 109.2° |
| C41 | C42 | O36 | 110.4° | 109.5° |
| C42 | C41 | O37 | 110.6° | 109.6° |
| C42 | C41 | H67 | 108.8° | 109.5° |
| C41 | C42 | H68 | 109.4° | 109.5° |
| C42 | C43 | O34 | 110.1° | 109.4° |
| C42 | C43 | C44 | 112.9° | 109.5° |
| C43 | C42 | O36 | 109.7° | 109.5° |
| C43 | C42 | H68 | 109.2° | 109.5° |
| C42 | C43 | H69 | 108.6° | 109.4° |
| O34 | C43 | C44 | 106.6° | 109.5° |
| C43 | O34 | C27 | 116.1° | 114.0° |
| O34 | C43 | H69 | 109.8° | 109.5° |
| C43 | C44 | O35 | 111.4° | 109.4° |
| C44 | C43 | H69 | 108.8° | 109.5° |
| C43 | C44 | H70 | 109.0° | 109.5° |
| C43 | C44 | H71 | 109.0° | 109.4° |
| O35 | C44 | H70 | 109.0° | 109.5° |
| O35 | C44 | H71 | 109.0° | 109.5° |
| C44 | O35 | H72 | 109.5° | 114.0° |
| O36 | C42 | H68 | 110.7° | 109.6° |
| C42 | O36 | H73 | 109.5° | 114.0° |
| O37 | C41 | H67 | 110.0° | 109.7° |
| C41 | O37 | H74 | 109.5° | 114.0° |
| C2 | C45 | C46 | 113.1° | 109.5° |
| C2 | C45 | O39 | 109.2° | 109.4° |
| C45 | C2 | H3 | 110.1° | 109.6° |
| C2 | C45 | H75 | 108.7° | 109.5° |
| C45 | C46 | O38 | 111.1° | 109.5° |
| C46 | C45 | O39 | 106.7° | 109.5° |
| C46 | C45 | H75 | 109.0° | 109.5° |
| C45 | C46 | H76 | 109.0° | 109.5° |
| C45 | C46 | H77 | 109.1° | 109.5° |
| O38 | C46 | H76 | 109.1° | 109.5° |
| O38 | C46 | H77 | 109.1° | 109.5° |
| C46 | O38 | H78 | 109.5° | 114.0° |
| C45 | O39 | C47 | 114.0° | 114.1° |
| O39 | C45 | H75 | 110.0° | 109.5° |
| O39 | C47 | O40 | 108.1° | 109.5° |
| O39 | C47 | C81 | 111.2° | 109.4° |
| O39 | C47 | H79 | 109.9° | 109.6° |
| C47 | O40 | C48 | 117.5° | 114.0° |
| O40 | C47 | C81 | 108.6° | 109.4° |
| O40 | C47 | H79 | 110.3° | 109.5° |
| O40 | C48 | C49 | 110.2° | 109.5° |
| O40 | C48 | C80 | 108.6° | 109.5° |
| O40 | C48 | H80 | 111.1° | 109.6° |
| C48 | C49 | C50 | 114.3° | 109.5° |
| C48 | C49 | O42 | 109.8° | 109.4° |
| C49 | C48 | C80 | 107.3° | 109.2° |
| C49 | C48 | H80 | 109.7° | 109.5° |
| C48 | C49 | H81 | 108.2° | 109.4° |
| C49 | C50 | O41 | 111.4° | 109.5° |
| C50 | C49 | O42 | 106.6° | 109.5° |
| C50 | C49 | H81 | 108.4° | 109.5° |
| C49 | C50 | H82 | 109.0° | 109.5° |
| 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 | 114.1° | 114.2° |
| O42 | C49 | H81 | 109.4° | 109.5° |
| O42 | C51 | O43 | 111.8° | 109.4° |
| O42 | C51 | C77 | 110.0° | 109.4° |
| O42 | C51 | H85 | 109.3° | 109.5° |
| C51 | O43 | P1 | 125.7° | 123.0° |
| O43 | C51 | C77 | 108.1° | 109.5° |
| O43 | C51 | H85 | 109.5° | 109.5° |
| O43 | P1 | O44 | 103.3° | 109.5° |
| O43 | P1 | O48 | 110.6° | 109.4° |
| O43 | P1 | O49 | 107.1° | 109.5° |
| P1 | O44 | P2 | 138.0° | 134.0° |
| O44 | P1 | O48 | 110.0° | 109.5° |
| O44 | P1 | O49 | 107.9° | 109.5° |
| O44 | P2 | O45 | 109.3° | 109.5° |
| O44 | P2 | O46 | 98.6° | 109.5° |
| O44 | P2 | O47 | 112.7° | 109.5° |
| O45 | P2 | O46 | 109.7° | 109.5° |
| O45 | P2 | O47 | 117.6° | 109.5° |
| P2 | O45 | H141 | 109.5° | 114.0° |
| P2 | O46 | C52 | 117.8° | 123.0° |
| O46 | P2 | O47 | 107.1° | 109.5° |
| O46 | C52 | C53 | 110.6° | 109.5° |
| O46 | C52 | H86 | 109.2° | 109.5° |
| O46 | C52 | H87 | 109.2° | 109.4° |
| C52 | C53 | C54 | 112.6° | 109.5° |
| C53 | C52 | H86 | 109.2° | 109.5° |
| C53 | C52 | H87 | 109.2° | 109.5° |
| C52 | C53 | H88 | 108.7° | 109.5° |
| C52 | C53 | H89 | 108.7° | 109.5° |
| C53 | C54 | C55 | 110.2° | 109.4° |
| C53 | C54 | C56 | 113.8° | 109.5° |
| C54 | C53 | H88 | 108.7° | 109.5° |
| C54 | C53 | H89 | 108.7° | 109.4° |
| C53 | C54 | H90 | 107.2° | 109.5° |
| C55 | C54 | C56 | 111.2° | 109.5° |
| C55 | C54 | H90 | 107.1° | 109.5° |
| C54 | C55 | H91 | 109.5° | 109.5° |
| C54 | C55 | H92 | 109.5° | 109.5° |
| C54 | C55 | H93 | 109.5° | 109.5° |
| C54 | C56 | C57 | 111.6° | 109.5° |
| C56 | C54 | H90 | 107.1° | 109.5° |
| C54 | C56 | H94 | 108.9° | 109.5° |
| C54 | C56 | H95 | 108.9° | 109.4° |
| C56 | C57 | C58 | 112.3° | 109.5° |
| C57 | C56 | H94 | 108.9° | 109.5° |
| C57 | C56 | H95 | 108.9° | 109.5° |
| C56 | C57 | H96 | 108.8° | 109.5° |
| C56 | C57 | H97 | 108.7° | 109.5° |
| C57 | C58 | C59 | 128.5° | 120.0° |
| C58 | C57 | H96 | 108.7° | 109.5° |
| C58 | C57 | H97 | 108.8° | 109.4° |
| C57 | C58 | H98 | 115.7° | 120.0° |
| C58 | C59 | C60 | 121.1° | 120.0° |
| C58 | C59 | C76 | 123.3° | 120.0° |
| C59 | C58 | H98 | 115.7° | 120.0° |
| C59 | C60 | C61 | 117.4° | 109.5° |
| C60 | C59 | C76 | 115.5° | 120.0° |
| C59 | C60 | H100 | 107.5° | 109.5° |
| C59 | C60 | H99 | 107.5° | 109.4° |
| C60 | C61 | C62 | 116.7° | 109.5° |
| C61 | C60 | H100 | 107.5° | 109.5° |
| C61 | C60 | H99 | 107.5° | 109.5° |
| C60 | C61 | H101 | 107.6° | 109.5° |
| C60 | C61 | H102 | 107.6° | 109.5° |
| C61 | C62 | C63 | 128.0° | 120.0° |
| C62 | C61 | H101 | 107.6° | 109.5° |
| C62 | C61 | H102 | 107.6° | 109.5° |
| C61 | C62 | H103 | 116.0° | 120.0° |
| C62 | C63 | C64 | 123.8° | 120.0° |
| C62 | C63 | C65 | 121.1° | 120.0° |
| C63 | C62 | H103 | 116.0° | 120.0° |
| C64 | C63 | C65 | 115.0° | 120.0° |
| C63 | C64 | H104 | 109.5° | 109.5° |
| C63 | C64 | H105 | 109.5° | 109.4° |
| C63 | C64 | H106 | 109.5° | 109.5° |
| C63 | C65 | C66 | 112.1° | 109.4° |
| C63 | C65 | H107 | 108.8° | 109.5° |
| C63 | C65 | H108 | 108.8° | 109.5° |
| C65 | C66 | C67 | 114.0° | 109.5° |
| C66 | C65 | H107 | 108.8° | 109.5° |
| C66 | C65 | H108 | 108.8° | 109.5° |
| C65 | C66 | H109 | 108.3° | 109.5° |
| C65 | C66 | H110 | 108.3° | 109.5° |
| C66 | C67 | C68 | 128.4° | 120.0° |
| C67 | C66 | H109 | 108.3° | 109.5° |
| C67 | C66 | H110 | 108.3° | 109.4° |
| C66 | C67 | H111 | 115.8° | 120.1° |
| C67 | C68 | C69 | 121.0° | 120.0° |
| C67 | C68 | C75 | 124.0° | 120.0° |
| C68 | C67 | H111 | 115.8° | 120.0° |
| C68 | C69 | C70 | 113.9° | 109.5° |
| C69 | C68 | C75 | 115.1° | 120.0° |
| C68 | C69 | H112 | 108.4° | 109.4° |
| C68 | C69 | H113 | 108.3° | 109.5° |
| C69 | C70 | C71 | 113.2° | 109.5° |
| C70 | C69 | H112 | 108.3° | 109.4° |
| C70 | C69 | H113 | 108.3° | 109.5° |
| C69 | C70 | H114 | 108.5° | 109.4° |
| C69 | C70 | H115 | 108.5° | 109.4° |
| C70 | C71 | C72 | 128.5° | 120.0° |
| C71 | C70 | H114 | 108.5° | 109.5° |
| C71 | C70 | H115 | 108.5° | 109.5° |
| C70 | C71 | H116 | 115.8° | 120.1° |
| C71 | C72 | C73 | 122.4° | 120.0° |
| C71 | C72 | C74 | 123.0° | 120.0° |
| C72 | C71 | H116 | 115.7° | 120.0° |
| C73 | C72 | C74 | 114.7° | 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 | 109.4° | 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° | 109.5° |
| C59 | C76 | H128 | 109.5° | 109.5° |
| O48 | P1 | O49 | 117.0° | 109.5° |
| P1 | O48 | H142 | 109.5° | 114.0° |
| C51 | C77 | N1 | 110.8° | 109.5° |
| C51 | C77 | C80 | 108.8° | 109.2° |
| C77 | C51 | H85 | 107.9° | 109.5° |
| C51 | C77 | H129 | 108.3° | 109.5° |
| C77 | N1 | C78 | 122.8° | 120.0° |
| N1 | C77 | C80 | 111.3° | 109.5° |
| N1 | C77 | H129 | 109.2° | 109.5° |
| C77 | N1 | H130 | 118.6° | 120.0° |
| N1 | C78 | C79 | 116.3° | 120.0° |
| N1 | C78 | O50 | 122.0° | 120.0° |
| C78 | N1 | H130 | 118.6° | 120.0° |
| C79 | C78 | O50 | 121.7° | 120.0° |
| C78 | C79 | H131 | 109.5° | 109.5° |
| C78 | C79 | H132 | 109.5° | 109.4° |
| C78 | C79 | H133 | 109.4° | 109.5° |
| C48 | C80 | O51 | 109.8° | 109.5° |
| C48 | C80 | C77 | 109.2° | 109.0° |
| C80 | C48 | H80 | 109.9° | 109.6° |
| C48 | C80 | H134 | 109.2° | 109.6° |
| O51 | C80 | C77 | 108.9° | 109.5° |
| O51 | C80 | H134 | 110.6° | 109.6° |
| C80 | O51 | H135 | 109.5° | 114.0° |
| C47 | C81 | N2 | 110.0° | 109.5° |
| C47 | C81 | C1 | 107.8° | 109.2° |
| C81 | C47 | H79 | 108.7° | 109.5° |
| C47 | C81 | H136 | 108.9° | 109.6° |
| C81 | N2 | C82 | 122.8° | 120.0° |
| N2 | C81 | C1 | 111.7° | 109.5° |
| N2 | C81 | H136 | 109.7° | 109.5° |
| C81 | N2 | H137 | 118.6° | 120.0° |
| N2 | C82 | C83 | 116.3° | 120.0° |
| N2 | C82 | O52 | 122.0° | 120.0° |
| C82 | N2 | H137 | 118.6° | 120.0° |
| C83 | C82 | O52 | 121.7° | 120.0° |
| C82 | C83 | H138 | 109.5° | 109.5° |
| C82 | C83 | H139 | 109.4° | 109.5° |
| C82 | C83 | H140 | 109.5° | 109.4° |
| C81 | C1 | H2 | 108.6° | 109.5° |
| C1 | C81 | H136 | 108.7° | 109.5° |
| C26 | C4 | H5 | 108.6° | 109.5° |
| C4 | C26 | H43 | 108.8° | 109.5° |
| C12 | C8 | H11 | 108.2° | 109.6° |
| C8 | C12 | H19 | 109.0° | 109.6° |
| C24 | C14 | H21 | 109.9° | 109.6° |
| C14 | C24 | H39 | 108.9° | 109.6° |
| C20 | C16 | H23 | 107.9° | 109.6° |
| C16 | C20 | H31 | 108.0° | 109.5° |
| O34 | C27 | H44 | 106.9° | 109.5° |
| O30 | C29 | H46 | 106.9° | 109.5° |
| C36 | C32 | H49 | 107.9° | 109.5° |
| C32 | C36 | H57 | 108.1° | 109.6° |
| C80 | C77 | H129 | 108.3° | 109.6° |
| C77 | C80 | H134 | 109.2° | 109.6° |
| H8 | C6 | H9 | 109.5° | 109.5° |
| H14 | C10 | H15 | 109.5° | 109.4° |
| H26 | C18 | H27 | 109.5° | 109.5° |
| H34 | C22 | H35 | 109.4° | 109.5° |
| H52 | C34 | H53 | 109.5° | 109.5° |
| H62 | C40 | H63 | 109.5° | 109.4° |
| H70 | C44 | H71 | 109.5° | 109.5° |
| H76 | C46 | H77 | 109.5° | 109.4° |
| H82 | C50 | H83 | 109.4° | 109.5° |
| H86 | C52 | H87 | 109.5° | 109.4° |
| H88 | C53 | H89 | 109.5° | 109.4° |
| H91 | C55 | H92 | 109.5° | 109.4° |
| H91 | C55 | H93 | 109.5° | 109.5° |
| H92 | C55 | H93 | 109.4° | 109.5° |
| H94 | C56 | H95 | 109.5° | 109.4° |
| H96 | C57 | H97 | 109.5° | 109.5° |
| H100 | C60 | H99 | 109.5° | 109.5° |
| H101 | C61 | H102 | 109.5° | 109.4° |
| H104 | C64 | H105 | 109.4° | 109.4° |
| H104 | C64 | H106 | 109.5° | 109.5° |
| H105 | C64 | H106 | 109.5° | 109.5° |
| H107 | C65 | H108 | 109.5° | 109.5° |
| H109 | C66 | H110 | 109.5° | 109.4° |
| H112 | C69 | H113 | 109.5° | 109.5° |
| H114 | C70 | H115 | 109.5° | 109.5° |
| H117 | C73 | H118 | 109.5° | 109.4° |
| H117 | C73 | H119 | 109.5° | 109.5° |
| H118 | C73 | H119 | 109.5° | 109.5° |
| H120 | C74 | H121 | 109.5° | 109.5° |
| H120 | C74 | H122 | 109.5° | 109.5° |
| H121 | C74 | H122 | 109.5° | 109.5° |
| H123 | C75 | H124 | 109.4° | 109.5° |
| H123 | C75 | H125 | 109.5° | 109.4° |
| H124 | C75 | H125 | 109.5° | 109.5° |
| H126 | C76 | H127 | 109.5° | 109.4° |
| H126 | C76 | H128 | 109.5° | 109.4° |
| H127 | C76 | H128 | 109.4° | 109.5° |
| H131 | C79 | H132 | 109.5° | 109.5° |
| H131 | C79 | H133 | 109.5° | 109.5° |
| H132 | C79 | H133 | 109.5° | 109.4° |
| H138 | C83 | H139 | 109.5° | 109.4° |
| H138 | C83 | H140 | 109.5° | 109.5° |
| H139 | C83 | H140 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | C81 | 120.3° | 119.9° |
| O1 | C1 | C2 | H2 | 121.1° | 120.3° |
| O1 | C1 | C2 | O2 | 66.6° | 63.3° |
| O1 | C1 | C2 | C45 | 179.3° | 176.8° |
| O1 | C1 | C81 | C47 | 179.3° | 176.9° |
| O1 | C1 | C81 | N2 | 59.8° | 63.2° |
| O1 | C1 | C81 | H2 | 119.6° | 120.3° |
| O1 | C1 | C2 | H3 | 58.8° | 56.9° |
| O1 | C1 | C81 | H136 | 61.4° | 56.9° |
| C1 | C2 | O2 | C45 | 116.9° | 119.7° |
| C1 | C2 | O2 | H3 | 124.7° | 120.1° |
| C1 | C2 | O2 | C3 | 80.3° | 136.5° |
| C1 | C2 | C45 | H3 | 120.5° | 120.0° |
| C1 | C2 | C45 | C46 | 176.8° | 177.6° |
| C1 | C2 | C45 | O39 | 58.1° | 57.6° |
| C2 | C1 | C81 | C47 | 57.6° | 56.9° |
| C2 | C1 | C81 | N2 | 178.5° | 176.9° |
| C2 | C1 | C81 | H2 | 118.7° | 119.8° |
| C1 | C2 | C45 | H75 | 62.0° | 62.4° |
| C2 | C1 | C81 | H136 | 60.3° | 63.0° |
| C2 | C1 | O1 | H1 | 180.0° | 180.0° |
| C2 | O2 | C3 | C4 | 170.6° | 170.8° |
| C2 | O2 | C3 | O4 | 68.6° | 69.3° |
| O2 | C2 | C45 | H3 | 119.4° | 120.2° |
| O2 | C2 | C45 | C46 | 63.1° | 62.5° |
| O2 | C2 | C45 | O39 | 178.2° | 177.5° |
| O2 | C2 | C1 | C81 | 173.1° | 176.8° |
| O2 | C2 | C1 | H2 | 54.4° | 57.1° |
| C2 | O2 | C3 | H4 | 55.0° | 50.7° |
| O2 | C2 | C45 | H75 | 58.1° | 57.5° |
| O2 | C3 | C4 | O4 | 124.8° | 119.9° |
| O2 | C3 | C4 | H4 | 116.7° | 120.0° |
| O2 | C3 | C4 | O3 | 62.7° | 57.7° |
| O2 | C3 | O4 | H4 | 123.9° | 120.0° |
| O2 | C3 | O4 | C5 | 177.9° | 178.8° |
| C3 | O2 | C2 | C45 | 162.9° | 103.8° |
| O2 | C3 | C4 | C26 | 176.1° | 177.6° |
| C3 | O2 | C2 | H3 | 44.4° | 16.4° |
| O2 | C3 | C4 | H5 | 57.7° | 62.5° |
| C3 | C4 | O3 | C26 | 120.7° | 119.7° |
| C3 | C4 | O3 | H5 | 119.6° | 120.2° |
| C4 | C3 | O4 | H4 | 117.7° | 120.1° |
| C4 | C3 | O4 | C5 | 63.7° | 61.2° |
| C3 | C4 | C26 | C25 | 54.8° | 57.0° |
| C3 | C4 | C26 | O22 | 174.9° | 176.9° |
| C3 | C4 | C26 | H5 | 118.5° | 120.0° |
| C3 | C4 | C26 | H43 | 64.2° | 62.9° |
| C3 | C4 | O3 | H6 | 180.0° | 60.0° |
| O3 | C4 | C3 | O4 | 62.1° | 62.2° |
| O3 | C4 | C26 | C25 | 66.1° | 63.0° |
| O3 | C4 | C26 | O22 | 54.0° | 56.9° |
| O3 | C4 | C26 | H5 | 120.6° | 120.1° |
| O3 | C4 | C3 | H4 | 179.4° | 177.7° |
| O3 | C4 | C26 | H43 | 174.9° | 177.2° |
| C3 | O4 | C5 | C6 | 175.3° | 178.9° |
| C3 | O4 | C5 | C25 | 61.6° | 61.2° |
| O4 | C3 | C4 | C26 | 59.1° | 57.7° |
| O4 | C3 | C4 | H5 | 177.6° | 177.6° |
| C3 | O4 | C5 | H7 | 57.5° | 58.8° |
| O4 | C5 | C6 | C25 | 120.9° | 119.9° |
| O4 | C5 | C6 | H7 | 118.5° | 120.1° |
| O4 | C5 | C6 | O5 | 160.3° | 62.8° |
| O4 | C5 | C25 | H7 | 119.9° | 120.0° |
| O4 | C5 | C25 | O21 | 172.6° | 177.5° |
| O4 | C5 | C25 | C26 | 55.4° | 57.6° |
| C5 | O4 | C3 | H4 | 54.0° | 58.8° |
| O4 | C5 | C6 | H8 | 79.6° | 57.1° |
| O4 | C5 | C6 | H9 | 40.3° | 177.1° |
| O4 | C5 | C25 | H41 | 64.9° | 62.3° |
| C5 | C6 | O5 | H8 | 120.1° | 120.0° |
| C5 | C6 | O5 | H9 | 120.1° | 120.0° |
| C5 | C6 | O5 | C7 | 109.6° | 172.8° |
| C6 | C5 | C25 | H7 | 120.8° | 120.0° |
| C6 | C5 | C25 | O21 | 68.1° | 62.5° |
| C6 | C5 | C25 | C26 | 174.7° | 177.6° |
| C5 | C6 | H8 | H9 | 119.8° | 120.0° |
| C6 | C5 | C25 | H41 | 54.4° | 57.7° |
| C6 | O5 | C7 | C8 | 177.6° | 166.6° |
| C6 | O5 | C7 | O7 | 60.2° | 73.5° |
| O5 | C6 | C5 | C25 | 78.8° | 57.1° |
| O5 | C6 | C5 | H7 | 41.9° | 177.1° |
| O5 | C6 | H8 | H9 | 119.8° | 120.0° |
| C6 | O5 | C7 | H10 | 60.9° | 46.5° |
| O5 | C7 | C8 | O7 | 123.4° | 120.0° |
| O5 | C7 | C8 | H10 | 117.8° | 120.0° |
| O5 | C7 | C8 | O6 | 169.3° | 177.7° |
| O5 | C7 | O7 | H10 | 121.2° | 120.0° |
| O5 | C7 | O7 | C9 | 61.9° | 58.8° |
| O5 | C7 | C8 | C12 | 68.7° | 62.4° |
| C7 | O5 | C6 | H8 | 10.5° | 67.3° |
| C7 | O5 | C6 | H9 | 130.3° | 52.7° |
| O5 | C7 | C8 | H11 | 49.7° | 57.6° |
| C7 | C8 | O6 | C12 | 122.4° | 119.7° |
| C7 | C8 | O6 | H11 | 118.8° | 120.1° |
| C8 | C7 | O7 | H10 | 118.0° | 120.0° |
| C8 | C7 | O7 | C9 | 58.8° | 61.2° |
| C7 | C8 | C12 | C11 | 53.4° | 57.0° |
| C7 | C8 | C12 | O10 | 172.9° | 176.9° |
| C7 | C8 | C12 | H11 | 118.3° | 119.9° |
| C7 | C8 | C12 | H19 | 65.9° | 62.9° |
| C7 | C8 | O6 | H12 | 180.0° | 60.0° |
| O6 | C8 | C7 | O7 | 67.3° | 62.3° |
| O6 | C8 | C12 | C11 | 68.6° | 63.0° |
| O6 | C8 | C12 | O10 | 50.9° | 56.9° |
| O6 | C8 | C12 | H11 | 119.7° | 120.2° |
| O6 | C8 | C7 | H10 | 51.5° | 57.7° |
| O6 | C8 | C12 | H19 | 172.1° | 177.2° |
| C7 | O7 | C9 | C10 | 177.4° | 178.8° |
| C7 | O7 | C9 | C11 | 60.0° | 61.2° |
| O7 | C7 | C8 | C12 | 54.7° | 57.6° |
| O7 | C7 | C8 | H11 | 173.1° | 177.6° |
| C7 | O7 | C9 | H13 | 59.6° | 58.9° |
| O7 | C9 | C10 | C11 | 121.0° | 120.0° |
| O7 | C9 | C10 | H13 | 118.5° | 120.0° |
| O7 | C9 | C10 | O8 | 59.2° | 65.0° |
| O7 | C9 | C11 | H13 | 120.4° | 120.0° |
| O7 | C9 | C11 | O9 | 176.5° | 177.5° |
| O7 | C9 | C11 | C12 | 56.7° | 57.6° |
| C9 | O7 | C7 | H10 | 176.9° | 178.8° |
| O7 | C9 | C10 | H14 | 179.4° | 175.0° |
| O7 | C9 | C10 | H15 | 61.1° | 55.0° |
| O7 | C9 | C11 | H17 | 62.8° | 62.4° |
| C9 | C10 | O8 | H14 | 120.3° | 120.1° |
| C9 | C10 | O8 | H15 | 120.3° | 120.0° |
| C10 | C9 | C11 | H13 | 120.6° | 120.0° |
| C10 | C9 | C11 | O9 | 64.5° | 62.5° |
| C10 | C9 | C11 | C12 | 175.7° | 177.6° |
| C9 | C10 | H14 | H15 | 119.2° | 120.0° |
| C10 | C9 | C11 | H17 | 56.2° | 57.6° |
| C9 | C10 | O8 | H16 | 180.0° | 180.0° |
| O8 | C10 | C9 | C11 | 179.8° | 175.0° |
| O8 | C10 | C9 | H13 | 59.2° | 55.0° |
| O8 | C10 | H14 | H15 | 119.2° | 119.9° |
| C9 | C11 | O9 | C12 | 120.4° | 119.7° |
| C9 | C11 | O9 | H17 | 119.9° | 120.1° |
| C9 | C11 | C12 | H17 | 119.5° | 119.9° |
| C9 | C11 | C12 | O10 | 175.2° | 176.8° |
| C9 | C11 | C12 | C8 | 54.4° | 56.9° |
| C11 | C9 | C10 | H14 | 59.5° | 55.0° |
| C11 | C9 | C10 | H15 | 60.0° | 65.0° |
| C9 | C11 | C12 | H19 | 64.9° | 63.0° |
| C9 | C11 | O9 | H18 | 180.0° | 59.9° |
| O9 | C11 | C12 | H17 | 120.6° | 120.2° |
| O9 | C11 | C12 | O10 | 65.0° | 63.2° |
| O9 | C11 | C12 | C8 | 174.3° | 176.9° |
| O9 | C11 | C9 | H13 | 56.1° | 57.5° |
| O9 | C11 | C12 | H19 | 54.9° | 57.0° |
| C11 | C12 | O10 | C8 | 120.4° | 119.6° |
| C11 | C12 | O10 | H19 | 119.2° | 120.1° |
| C11 | C12 | O10 | C13 | 151.0° | 157.4° |
| C11 | C12 | C8 | H19 | 119.3° | 119.8° |
| C11 | C12 | C8 | H11 | 171.8° | 176.9° |
| C12 | C11 | C9 | H13 | 63.7° | 62.5° |
| C12 | C11 | O9 | H18 | 59.7° | 179.6° |
| C12 | O10 | C13 | C14 | 171.7° | 163.6° |
| C12 | O10 | C13 | O17 | 62.0° | 76.5° |
| O10 | C12 | C8 | H19 | 121.2° | 120.3° |
| O10 | C12 | C8 | H11 | 68.8° | 63.2° |
| O10 | C12 | C11 | H17 | 55.6° | 57.0° |
| C12 | O10 | C13 | H20 | 58.0° | 43.5° |
| O10 | C13 | C14 | O17 | 128.3° | 120.0° |
| O10 | C13 | C14 | H20 | 114.7° | 120.1° |
| O10 | C13 | C14 | O11 | 162.7° | 177.7° |
| O10 | C13 | O17 | H20 | 120.3° | 120.0° |
| O10 | C13 | O17 | C21 | 74.5° | 58.9° |
| C13 | O10 | C12 | C8 | 88.6° | 83.0° |
| O10 | C13 | C14 | C24 | 77.6° | 62.4° |
| C13 | O10 | C12 | H19 | 31.8° | 37.3° |
| O10 | C13 | C14 | H21 | 42.9° | 57.6° |
| C13 | C14 | O11 | C24 | 118.8° | 119.7° |
| C13 | C14 | O11 | H21 | 119.0° | 120.1° |
| C13 | C14 | O11 | C15 | 63.0° | 83.0° |
| C14 | C13 | O17 | H20 | 116.3° | 119.9° |
| C14 | C13 | O17 | C21 | 49.0° | 61.1° |
| C13 | C14 | C24 | C23 | 59.5° | 57.0° |
| C13 | C14 | C24 | O20 | 179.4° | 176.9° |
| C13 | C14 | C24 | H21 | 120.3° | 119.9° |
| C13 | C14 | C24 | H39 | 58.8° | 62.9° |
| C14 | O11 | C15 | C16 | 147.5° | 163.6° |
| C14 | O11 | C15 | O13 | 90.7° | 76.5° |
| O11 | C14 | C13 | O17 | 69.0° | 62.3° |
| O11 | C14 | C24 | C23 | 57.4° | 62.9° |
| O11 | C14 | C24 | O20 | 63.7° | 56.9° |
| O11 | C14 | C24 | H21 | 122.7° | 120.1° |
| O11 | C14 | C13 | H20 | 48.0° | 57.6° |
| C14 | O11 | C15 | H22 | 30.4° | 43.6° |
| O11 | C14 | C24 | H39 | 175.7° | 177.2° |
| O11 | C15 | C16 | O13 | 123.5° | 120.0° |
| O11 | C15 | C16 | H22 | 118.2° | 120.0° |
| O11 | C15 | C16 | O12 | 167.9° | 177.7° |
| O11 | C15 | O13 | H22 | 121.3° | 120.0° |
| O11 | C15 | O13 | C17 | 57.7° | 58.8° |
| C15 | O11 | C14 | C24 | 178.2° | 157.3° |
| O11 | C15 | C16 | C20 | 69.1° | 62.4° |
| C15 | O11 | C14 | H21 | 56.0° | 37.1° |
| O11 | C15 | C16 | H23 | 49.1° | 57.6° |
| C15 | C16 | O12 | C20 | 123.2° | 119.7° |
| C15 | C16 | O12 | H23 | 118.1° | 120.1° |
| C16 | C15 | O13 | H22 | 117.5° | 120.1° |
| C16 | C15 | O13 | C17 | 63.5° | 61.1° |
| C15 | C16 | C20 | C19 | 48.2° | 56.9° |
| C15 | C16 | C20 | O16 | 170.7° | 176.8° |
| C15 | C16 | C20 | H23 | 118.2° | 120.0° |
| C15 | C16 | C20 | H31 | 70.7° | 63.0° |
| C15 | C16 | O12 | H24 | 180.0° | 59.9° |
| O12 | C16 | C15 | O13 | 68.5° | 62.3° |
| O12 | C16 | C20 | C19 | 74.2° | 62.9° |
| O12 | C16 | C20 | O16 | 48.4° | 57.0° |
| O12 | C16 | C20 | H23 | 119.5° | 120.1° |
| O12 | C16 | C15 | H22 | 49.7° | 57.7° |
| O12 | C16 | C20 | H31 | 167.0° | 177.1° |
| C15 | O13 | C17 | C18 | 173.8° | 178.9° |
| C15 | O13 | C17 | C19 | 63.3° | 61.1° |
| O13 | C15 | C16 | C20 | 54.4° | 57.6° |
| O13 | C15 | C16 | H23 | 172.6° | 177.6° |
| C15 | O13 | C17 | H25 | 55.8° | 58.8° |
| O13 | C17 | C18 | C19 | 120.6° | 119.9° |
| O13 | C17 | C18 | H25 | 118.6° | 120.1° |
| O13 | C17 | C18 | O14 | 61.1° | 65.1° |
| O13 | C17 | C19 | H25 | 119.9° | 119.9° |
| O13 | C17 | C19 | O15 | 175.7° | 177.5° |
| O13 | C17 | C19 | C20 | 54.1° | 57.6° |
| C17 | O13 | C15 | H22 | 179.1° | 178.8° |
| O13 | C17 | C18 | H26 | 59.3° | 174.9° |
| O13 | C17 | C18 | H27 | 178.6° | 54.9° |
| O13 | C17 | C19 | H29 | 64.8° | 62.4° |
| C17 | C18 | O14 | H26 | 120.3° | 119.9° |
| C17 | C18 | O14 | H27 | 120.3° | 120.0° |
| C18 | C17 | C19 | H25 | 120.9° | 120.1° |
| C18 | C17 | C19 | O15 | 65.1° | 62.5° |
| C18 | C17 | C19 | C20 | 173.3° | 177.6° |
| C17 | C18 | H26 | H27 | 119.0° | 120.0° |
| C18 | C17 | C19 | H29 | 54.4° | 57.6° |
| C17 | C18 | O14 | H28 | 180.0° | 180.0° |
| O14 | C18 | C17 | C19 | 59.5° | 175.0° |
| O14 | C18 | C17 | H25 | 179.7° | 55.0° |
| O14 | C18 | H26 | H27 | 119.0° | 120.1° |
| C17 | C19 | O15 | C20 | 122.4° | 119.7° |
| C17 | C19 | O15 | H29 | 118.6° | 120.1° |
| C17 | C19 | C20 | H29 | 118.8° | 120.0° |
| C17 | C19 | C20 | O16 | 170.2° | 176.9° |
| C17 | C19 | C20 | C16 | 48.2° | 57.0° |
| C19 | C17 | C18 | H26 | 179.9° | 55.0° |
| C19 | C17 | C18 | H27 | 60.8° | 65.0° |
| C17 | C19 | C20 | H31 | 70.7° | 62.9° |
| C17 | C19 | O15 | H30 | 180.0° | 180.0° |
| O15 | C19 | C20 | H29 | 119.8° | 120.1° |
| O15 | C19 | C20 | O16 | 68.5° | 63.2° |
| O15 | C19 | C20 | C16 | 169.5° | 176.9° |
| O15 | C19 | C17 | H25 | 55.8° | 57.5° |
| O15 | C19 | C20 | H31 | 50.6° | 57.0° |
| C19 | C20 | O16 | C16 | 123.8° | 119.6° |
| C19 | C20 | O16 | H31 | 118.4° | 120.2° |
| C19 | C20 | C16 | H31 | 118.9° | 119.9° |
| C19 | C20 | C16 | H23 | 166.4° | 176.9° |
| C20 | C19 | C17 | H25 | 65.8° | 62.4° |
| C20 | C19 | O15 | H30 | 57.7° | 60.3° |
| C19 | C20 | O16 | H32 | 180.0° | 179.5° |
| O16 | C20 | C16 | H31 | 118.6° | 120.2° |
| O16 | C20 | C16 | H23 | 71.1° | 63.2° |
| O16 | C20 | C19 | H29 | 51.3° | 56.9° |
| C13 | O17 | C21 | C22 | 177.0° | 178.9° |
| C13 | O17 | C21 | C23 | 54.1° | 61.1° |
| O17 | C13 | C14 | C24 | 50.6° | 57.6° |
| O17 | C13 | C14 | H21 | 171.1° | 177.6° |
| C13 | O17 | C21 | H33 | 65.4° | 58.9° |
| O17 | C21 | C22 | C23 | 121.5° | 120.0° |
| O17 | C21 | C22 | H33 | 118.2° | 120.1° |
| O17 | C21 | C22 | O18 | 60.9° | 65.1° |
| O17 | C21 | C23 | H33 | 120.2° | 120.1° |
| O17 | C21 | C23 | O19 | 179.7° | 177.5° |
| O17 | C21 | C23 | C24 | 60.3° | 57.6° |
| C21 | O17 | C13 | H20 | 165.3° | 178.9° |
| O17 | C21 | C22 | H34 | 59.4° | 175.0° |
| O17 | C21 | C22 | H35 | 178.8° | 55.0° |
| O17 | C21 | C23 | H37 | 58.0° | 62.3° |
| C21 | C22 | O18 | H34 | 120.3° | 120.0° |
| C21 | C22 | O18 | H35 | 120.3° | 120.0° |
| C22 | C21 | C23 | H33 | 120.4° | 120.0° |
| C22 | C21 | C23 | O19 | 60.3° | 62.5° |
| C22 | C21 | C23 | C24 | 179.7° | 177.6° |
| C21 | C22 | H34 | H35 | 119.1° | 120.0° |
| C22 | C21 | C23 | H37 | 61.3° | 57.7° |
| C21 | C22 | O18 | H36 | 180.0° | 180.0° |
| O18 | C22 | C21 | C23 | 60.6° | 174.9° |
| O18 | C22 | C21 | H33 | 179.1° | 55.0° |
| O18 | C22 | H34 | H35 | 119.2° | 120.0° |
| C21 | C23 | O19 | C24 | 117.8° | 119.7° |
| C21 | C23 | O19 | H37 | 120.7° | 120.1° |
| C21 | C23 | C24 | H37 | 118.3° | 119.9° |
| C21 | C23 | C24 | O20 | 175.2° | 176.8° |
| C21 | C23 | C24 | C14 | 64.3° | 57.0° |
| C23 | C21 | C22 | H34 | 179.1° | 55.0° |
| C23 | C21 | C22 | H35 | 59.7° | 65.0° |
| C21 | C23 | C24 | H39 | 54.0° | 62.9° |
| C21 | C23 | O19 | H38 | 180.0° | 60.0° |
| O19 | C23 | C24 | H37 | 122.2° | 120.2° |
| O19 | C23 | C24 | O20 | 55.7° | 63.3° |
| O19 | C23 | C24 | C14 | 176.2° | 176.9° |
| O19 | C23 | C21 | H33 | 60.1° | 57.5° |
| O19 | C23 | C24 | H39 | 65.5° | 57.0° |
| C23 | C24 | O20 | C14 | 119.6° | 119.6° |
| C23 | C24 | O20 | H39 | 120.5° | 120.2° |
| C23 | C24 | C14 | H39 | 118.3° | 119.9° |
| C23 | C24 | C14 | H21 | 179.8° | 176.9° |
| C24 | C23 | C21 | H33 | 59.8° | 62.5° |
| C24 | C23 | O19 | H38 | 62.2° | 179.7° |
| C23 | C24 | O20 | H40 | 180.0° | 60.4° |
| O20 | C24 | C14 | H39 | 120.6° | 120.3° |
| O20 | C24 | C14 | H21 | 59.0° | 63.2° |
| O20 | C24 | C23 | H37 | 66.5° | 57.0° |
| C5 | C25 | O21 | C26 | 119.8° | 119.7° |
| C5 | C25 | O21 | H41 | 121.6° | 120.1° |
| C5 | C25 | C26 | H41 | 120.3° | 119.9° |
| C5 | C25 | C26 | O22 | 174.5° | 176.9° |
| C5 | C25 | C26 | C4 | 53.2° | 56.9° |
| C25 | C5 | C6 | H8 | 41.2° | 177.0° |
| C25 | C5 | C6 | H9 | 161.1° | 63.0° |
| C5 | C25 | C26 | H43 | 65.8° | 62.9° |
| C5 | C25 | O21 | H42 | 180.0° | 60.0° |
| O21 | C25 | C26 | H41 | 119.6° | 120.2° |
| O21 | C25 | C26 | O22 | 65.4° | 63.2° |
| O21 | C25 | C26 | C4 | 173.3° | 176.9° |
| O21 | C25 | C5 | H7 | 52.7° | 57.5° |
| O21 | C25 | C26 | H43 | 54.3° | 57.0° |
| C25 | C26 | O22 | C4 | 120.8° | 119.6° |
| C25 | C26 | O22 | H43 | 119.0° | 120.2° |
| C25 | C26 | O22 | C27 | 159.4° | 150.5° |
| C25 | C26 | C4 | H43 | 119.0° | 119.9° |
| C25 | C26 | C4 | H5 | 173.2° | 176.9° |
| C26 | C25 | C5 | H7 | 64.5° | 62.4° |
| C26 | C25 | O21 | H42 | 60.2° | 179.7° |
| C26 | O22 | C27 | C28 | 169.5° | 170.0° |
| O22 | C26 | C4 | H43 | 120.9° | 120.3° |
| C26 | O22 | C27 | O34 | 63.6° | 70.0° |
| O22 | C26 | C4 | H5 | 66.7° | 63.2° |
| O22 | C26 | C25 | H41 | 54.2° | 56.9° |
| C26 | O22 | C27 | H44 | 56.0° | 50.0° |
| O22 | C27 | C28 | O34 | 129.6° | 120.0° |
| O22 | C27 | C28 | H44 | 114.5° | 120.0° |
| O22 | C27 | C28 | O23 | 164.4° | 177.7° |
| O22 | C27 | C28 | C41 | 77.6° | 62.4° |
| O22 | C27 | O34 | C43 | 72.9° | 58.9° |
| C27 | O22 | C26 | C4 | 79.7° | 90.0° |
| O22 | C27 | O34 | H44 | 119.8° | 120.0° |
| C27 | O22 | C26 | H43 | 40.5° | 30.3° |
| O22 | C27 | C28 | H45 | 43.9° | 57.6° |
| C27 | C28 | O23 | C41 | 117.5° | 119.7° |
| C27 | C28 | O23 | H45 | 119.7° | 120.1° |
| C27 | C28 | O23 | C29 | 80.9° | 90.0° |
| C27 | C28 | C41 | H45 | 121.2° | 119.9° |
| C27 | C28 | C41 | C42 | 58.7° | 57.0° |
| C28 | C27 | O34 | C43 | 52.1° | 61.2° |
| C27 | C28 | C41 | O37 | 180.0° | 176.8° |
| C28 | C27 | O34 | H44 | 115.2° | 120.0° |
| C27 | C28 | C41 | H67 | 59.9° | 62.8° |
| C28 | O23 | C29 | C30 | 165.4° | 170.0° |
| O23 | C28 | C41 | H45 | 123.4° | 120.2° |
| O23 | C28 | C41 | C42 | 56.6° | 62.9° |
| O23 | C28 | C41 | O37 | 64.7° | 56.9° |
| O23 | C28 | C27 | O34 | 66.1° | 62.3° |
| C28 | O23 | C29 | O30 | 67.8° | 70.1° |
| O23 | C28 | C27 | H44 | 49.8° | 57.7° |
| C28 | O23 | C29 | H46 | 51.7° | 50.0° |
| O23 | C28 | C41 | H67 | 175.3° | 177.3° |
| O23 | C29 | C30 | O30 | 129.4° | 120.0° |
| O23 | C29 | C30 | H46 | 114.7° | 120.0° |
| O23 | C29 | C30 | O24 | 166.5° | 177.8° |
| O23 | C29 | C30 | C37 | 75.4° | 62.3° |
| O23 | C29 | O30 | C39 | 73.3° | 58.8° |
| C29 | O23 | C28 | C41 | 161.6° | 150.3° |
| O23 | C29 | O30 | H46 | 119.7° | 120.1° |
| C29 | O23 | C28 | H45 | 38.8° | 30.1° |
| O23 | C29 | C30 | H47 | 45.9° | 57.6° |
| C29 | C30 | O24 | C37 | 116.6° | 119.7° |
| C29 | C30 | O24 | H47 | 119.8° | 120.2° |
| C29 | C30 | O24 | C31 | 88.7° | 90.0° |
| C29 | C30 | C37 | H47 | 121.2° | 119.9° |
| C29 | C30 | C37 | C38 | 61.3° | 57.0° |
| C30 | C29 | O30 | C39 | 51.8° | 61.2° |
| C29 | C30 | C37 | O33 | 177.8° | 176.8° |
| C30 | C29 | O30 | H46 | 115.2° | 119.9° |
| C29 | C30 | C37 | H59 | 57.2° | 62.9° |
| C30 | O24 | C31 | C32 | 170.0° | 170.0° |
| C30 | O24 | C31 | O26 | 63.4° | 70.0° |
| O24 | C30 | C37 | H47 | 124.1° | 120.2° |
| O24 | C30 | C37 | C38 | 53.4° | 62.9° |
| O24 | C30 | C37 | O33 | 67.5° | 56.9° |
| O24 | C30 | C29 | O30 | 64.1° | 62.3° |
| O24 | C30 | C29 | H46 | 51.8° | 57.7° |
| C30 | O24 | C31 | H48 | 56.1° | 50.0° |
| O24 | C30 | C37 | H59 | 171.9° | 177.2° |
| O24 | C31 | C32 | O26 | 130.2° | 120.0° |
| O24 | C31 | C32 | H48 | 114.8° | 120.0° |
| O24 | C31 | C32 | O25 | 158.9° | 177.7° |
| O24 | C31 | O26 | H48 | 119.7° | 120.0° |
| O24 | C31 | O26 | C33 | 69.3° | 58.9° |
| C31 | O24 | C30 | C37 | 154.6° | 150.3° |
| O24 | C31 | C32 | C36 | 78.2° | 62.3° |
| C31 | O24 | C30 | H47 | 31.1° | 30.1° |
| O24 | C31 | C32 | H49 | 40.0° | 57.5° |
| C31 | C32 | O25 | C36 | 123.4° | 119.7° |
| C31 | C32 | O25 | H49 | 118.0° | 120.2° |
| C32 | C31 | O26 | H48 | 114.3° | 120.0° |
| C32 | C31 | O26 | C33 | 56.7° | 61.1° |
| C31 | C32 | C36 | C35 | 51.9° | 57.0° |
| C31 | C32 | C36 | O29 | 174.3° | 176.9° |
| C31 | C32 | C36 | H49 | 118.2° | 119.9° |
| C31 | C32 | C36 | H57 | 66.6° | 62.8° |
| C31 | C32 | O25 | H50 | 180.0° | 60.0° |
| O25 | C32 | C31 | O26 | 70.9° | 62.3° |
| O25 | C32 | C36 | C35 | 70.6° | 63.0° |
| O25 | C32 | C36 | O29 | 51.9° | 56.9° |
| O25 | C32 | C36 | H49 | 119.3° | 120.2° |
| O25 | C32 | C31 | H48 | 44.0° | 57.7° |
| O25 | C32 | C36 | H57 | 170.9° | 177.3° |
| C31 | O26 | C33 | C34 | 178.3° | 178.9° |
| C31 | O26 | C33 | C35 | 58.7° | 61.1° |
| O26 | C31 | C32 | C36 | 52.0° | 57.6° |
| O26 | C31 | C32 | H49 | 170.3° | 177.5° |
| C31 | O26 | C33 | H51 | 60.8° | 58.8° |
| O26 | C33 | C34 | C35 | 121.5° | 120.0° |
| O26 | C33 | C34 | H51 | 118.1° | 120.0° |
| O26 | C33 | C34 | O27 | 59.2° | 65.0° |
| O26 | C33 | C35 | H51 | 120.1° | 120.0° |
| O26 | C33 | C35 | O28 | 176.6° | 177.5° |
| O26 | C33 | C35 | C36 | 54.9° | 57.6° |
| C33 | O26 | C31 | H48 | 171.0° | 178.9° |
| O26 | C33 | C34 | H52 | 179.5° | 175.0° |
| O26 | C33 | C34 | H53 | 61.1° | 55.0° |
| O26 | C33 | C35 | H55 | 63.7° | 62.3° |
| C33 | C34 | O27 | H52 | 120.3° | 120.0° |
| C33 | C34 | O27 | H53 | 120.3° | 120.0° |
| C34 | C33 | C35 | H51 | 120.5° | 120.0° |
| C34 | C33 | C35 | O28 | 64.0° | 62.5° |
| C34 | C33 | C35 | C36 | 174.4° | 177.6° |
| C33 | C34 | H52 | H53 | 119.2° | 120.0° |
| C34 | C33 | C35 | H55 | 55.8° | 57.7° |
| C33 | C34 | O27 | H54 | 180.0° | 180.0° |
| O27 | C34 | C33 | C35 | 179.2° | 175.0° |
| O27 | C34 | C33 | H51 | 58.9° | 55.0° |
| O27 | C34 | H52 | H53 | 119.2° | 120.0° |
| C33 | C35 | O28 | C36 | 121.3° | 119.7° |
| C33 | C35 | O28 | H55 | 118.9° | 120.2° |
| C33 | C35 | C36 | H55 | 118.6° | 119.9° |
| C33 | C35 | C36 | O29 | 175.1° | 176.8° |
| C33 | C35 | C36 | C32 | 53.1° | 57.0° |
| C35 | C33 | C34 | H52 | 59.0° | 55.0° |
| C35 | C33 | C34 | H53 | 60.5° | 65.0° |
| C33 | C35 | C36 | H57 | 65.5° | 62.9° |
| C33 | C35 | O28 | H56 | 180.0° | 180.0° |
| O28 | C35 | C36 | H55 | 120.6° | 120.1° |
| O28 | C35 | C36 | O29 | 64.1° | 63.2° |
| O28 | C35 | C36 | C32 | 173.9° | 176.9° |
| O28 | C35 | C33 | H51 | 56.5° | 57.5° |
| O28 | C35 | C36 | H57 | 55.4° | 57.1° |
| C35 | C36 | O29 | C32 | 123.0° | 119.5° |
| C35 | C36 | O29 | H57 | 118.7° | 120.2° |
| C35 | C36 | C32 | H57 | 118.5° | 119.8° |
| C35 | C36 | C32 | H49 | 170.1° | 176.9° |
| C36 | C35 | C33 | H51 | 65.2° | 62.4° |
| C36 | C35 | O28 | H56 | 58.7° | 60.3° |
| C35 | C36 | O29 | H58 | 180.0° | 179.6° |
| O29 | C36 | C32 | H57 | 119.1° | 120.3° |
| O29 | C36 | C32 | H49 | 67.5° | 63.3° |
| O29 | C36 | C35 | H55 | 56.5° | 56.9° |
| C30 | C37 | C38 | O33 | 120.2° | 119.8° |
| C30 | C37 | C38 | H59 | 118.5° | 119.9° |
| C30 | C37 | C38 | C39 | 63.8° | 57.0° |
| C30 | C37 | C38 | O32 | 176.8° | 176.9° |
| C30 | C37 | O33 | H59 | 119.8° | 120.3° |
| C37 | C30 | C29 | O30 | 53.9° | 57.6° |
| C37 | C30 | C29 | H46 | 169.8° | 177.6° |
| C30 | C37 | C38 | H60 | 54.7° | 62.9° |
| C30 | C37 | O33 | H66 | 180.0° | 180.0° |
| C37 | C38 | C39 | O32 | 119.9° | 119.9° |
| C37 | C38 | C39 | H60 | 118.5° | 119.9° |
| C37 | C38 | C39 | O30 | 58.7° | 57.6° |
| C37 | C38 | C39 | C40 | 178.2° | 177.6° |
| C37 | C38 | O32 | H60 | 121.4° | 120.2° |
| C38 | C37 | O33 | H59 | 120.6° | 120.2° |
| C38 | C37 | C30 | H47 | 177.5° | 176.9° |
| C37 | C38 | C39 | H61 | 61.5° | 62.4° |
| C37 | C38 | O32 | H65 | 180.0° | 180.0° |
| C38 | C37 | O33 | H66 | 60.4° | 60.5° |
| C38 | C39 | O30 | C40 | 123.1° | 120.0° |
| C38 | C39 | O30 | H61 | 119.4° | 120.0° |
| C38 | C39 | C40 | H61 | 120.2° | 120.1° |
| C38 | C39 | C40 | O31 | 178.5° | 175.0° |
| C39 | C38 | O32 | H60 | 120.7° | 120.1° |
| C39 | C38 | C37 | O33 | 176.1° | 176.8° |
| C38 | C39 | O30 | C29 | 54.3° | 61.2° |
| C39 | C38 | C37 | H59 | 54.7° | 62.9° |
| C38 | C39 | C40 | H62 | 58.2° | 55.0° |
| C38 | C39 | C40 | H63 | 61.2° | 65.0° |
| C39 | C38 | O32 | H65 | 62.1° | 60.4° |
| O30 | C39 | C40 | H61 | 118.1° | 120.0° |
| O30 | C39 | C40 | O31 | 59.8° | 65.1° |
| O30 | C39 | C38 | O32 | 178.5° | 177.5° |
| C39 | O30 | C29 | H46 | 167.0° | 178.9° |
| O30 | C39 | C38 | H60 | 59.9° | 62.3° |
| O30 | C39 | C40 | H62 | 179.9° | 174.9° |
| O30 | C39 | C40 | H63 | 60.4° | 54.9° |
| C39 | C40 | O31 | H62 | 120.3° | 120.0° |
| C39 | C40 | O31 | H63 | 120.3° | 120.1° |
| C40 | C39 | C38 | O32 | 61.9° | 62.5° |
| C40 | C39 | O30 | C29 | 177.4° | 178.9° |
| C40 | C39 | C38 | H60 | 59.7° | 57.7° |
| C39 | C40 | H62 | H63 | 119.2° | 120.1° |
| C39 | C40 | O31 | H64 | 180.0° | 180.0° |
| O31 | C40 | C39 | H61 | 58.3° | 54.9° |
| O31 | C40 | H62 | H63 | 119.1° | 119.9° |
| O32 | C38 | C37 | O33 | 56.6° | 63.3° |
| O32 | C38 | C37 | H59 | 64.7° | 57.0° |
| O32 | C38 | C39 | H61 | 58.4° | 57.6° |
| O33 | C37 | C30 | H47 | 56.6° | 63.3° |
| O33 | C37 | C38 | H60 | 65.5° | 56.9° |
| C28 | C41 | C42 | O37 | 120.4° | 119.9° |
| C28 | C41 | C42 | H67 | 118.7° | 119.8° |
| C28 | C41 | C42 | C43 | 62.4° | 56.9° |
| C28 | C41 | C42 | O36 | 178.1° | 176.8° |
| C28 | C41 | O37 | H67 | 119.3° | 120.2° |
| C41 | C28 | C27 | O34 | 52.0° | 57.6° |
| C41 | C28 | C27 | H44 | 167.9° | 177.6° |
| C28 | C41 | C42 | H68 | 56.1° | 63.0° |
| C28 | C41 | O37 | H74 | 180.0° | 180.0° |
| C41 | C42 | C43 | O36 | 120.0° | 119.9° |
| C41 | C42 | C43 | H68 | 118.6° | 119.9° |
| C41 | C42 | C43 | O34 | 59.0° | 57.6° |
| C41 | C42 | C43 | C44 | 178.1° | 177.6° |
| C41 | C42 | O36 | H68 | 121.3° | 120.2° |
| C42 | C41 | O37 | H67 | 120.2° | 120.2° |
| C42 | C41 | C28 | H45 | 180.0° | 176.9° |
| C41 | C42 | C43 | H69 | 61.2° | 62.4° |
| C41 | C42 | O36 | H73 | 180.0° | 179.9° |
| C42 | C41 | O37 | H74 | 59.4° | 60.4° |
| C42 | C43 | O34 | C44 | 122.8° | 120.0° |
| C42 | C43 | O34 | H69 | 119.5° | 120.0° |
| C42 | C43 | C44 | H69 | 120.6° | 120.0° |
| C42 | C43 | C44 | O35 | 179.6° | 175.0° |
| C43 | C42 | O36 | H68 | 120.6° | 120.1° |
| C43 | C42 | C41 | O37 | 177.2° | 176.8° |
| C42 | C43 | O34 | C27 | 55.8° | 61.1° |
| C43 | C42 | C41 | H67 | 56.3° | 62.8° |
| C42 | C43 | C44 | H70 | 59.3° | 55.0° |
| C42 | C43 | C44 | H71 | 60.1° | 65.0° |
| C43 | C42 | O36 | H73 | 61.9° | 60.4° |
| O34 | C43 | C44 | H69 | 118.3° | 120.1° |
| O34 | C43 | C44 | O35 | 59.3° | 65.1° |
| O34 | C43 | C42 | O36 | 179.0° | 177.5° |
| C43 | O34 | C27 | H44 | 167.3° | 178.9° |
| O34 | C43 | C42 | H68 | 59.5° | 62.3° |
| O34 | C43 | C44 | H70 | 179.6° | 175.0° |
| O34 | C43 | C44 | H71 | 60.9° | 54.9° |
| C43 | C44 | O35 | H70 | 120.3° | 120.0° |
| C43 | C44 | O35 | H71 | 120.3° | 120.0° |
| C44 | C43 | C42 | O36 | 61.9° | 62.5° |
| C44 | C43 | O34 | C27 | 178.6° | 178.9° |
| C44 | C43 | C42 | H68 | 59.5° | 57.7° |
| C43 | C44 | H70 | H71 | 119.2° | 120.0° |
| C43 | C44 | O35 | H72 | 180.0° | 180.0° |
| O35 | C44 | C43 | H69 | 59.0° | 55.0° |
| O35 | C44 | H70 | H71 | 119.1° | 120.1° |
| O36 | C42 | C41 | O37 | 57.7° | 63.3° |
| O36 | C42 | C41 | H67 | 63.2° | 57.1° |
| O36 | C42 | C43 | H69 | 58.8° | 57.5° |
| O37 | C41 | C28 | H45 | 58.8° | 63.2° |
| O37 | C41 | C42 | H68 | 64.3° | 56.9° |
| C2 | C45 | C46 | O39 | 120.2° | 119.9° |
| C2 | C45 | C46 | H75 | 121.1° | 120.0° |
| C2 | C45 | C46 | O38 | 179.5° | 174.2° |
| C2 | C45 | O39 | H75 | 119.3° | 120.0° |
| C2 | C45 | O39 | C47 | 59.9° | 61.2° |
| C45 | C2 | C1 | C81 | 59.0° | 56.9° |
| C45 | C2 | C1 | H2 | 59.7° | 62.8° |
| C2 | C45 | C46 | H76 | 60.2° | 54.2° |
| C2 | C45 | C46 | H77 | 59.3° | 65.8° |
| C45 | C46 | O38 | H76 | 120.2° | 120.0° |
| C45 | C46 | O38 | H77 | 120.3° | 120.0° |
| C46 | C45 | O39 | H75 | 118.1° | 120.1° |
| C46 | C45 | O39 | C47 | 177.5° | 178.8° |
| C46 | C45 | C2 | H3 | 56.3° | 57.6° |
| C45 | C46 | H76 | H77 | 119.3° | 120.0° |
| C45 | C46 | O38 | H78 | 180.0° | 180.0° |
| O38 | C46 | C45 | O39 | 59.4° | 65.9° |
| O38 | C46 | C45 | H75 | 59.4° | 54.2° |
| O38 | C46 | H76 | H77 | 119.3° | 120.0° |
| C45 | O39 | C47 | O40 | 179.0° | 178.9° |
| C45 | O39 | C47 | C81 | 59.9° | 61.2° |
| O39 | C45 | C2 | H3 | 62.4° | 62.3° |
| O39 | C45 | C46 | H76 | 179.6° | 174.1° |
| O39 | C45 | C46 | H77 | 60.9° | 54.1° |
| C45 | O39 | C47 | H79 | 60.5° | 58.8° |
| O39 | C47 | O40 | C81 | 120.8° | 119.9° |
| O39 | C47 | O40 | H79 | 120.2° | 120.1° |
| O39 | C47 | O40 | C48 | 71.5° | 68.4° |
| O39 | C47 | C81 | H79 | 121.1° | 120.1° |
| O39 | C47 | C81 | N2 | 178.6° | 177.6° |
| O39 | C47 | C81 | C1 | 56.6° | 57.6° |
| C47 | O39 | C45 | H75 | 59.4° | 58.8° |
| O39 | C47 | C81 | H136 | 61.1° | 62.2° |
| C47 | O40 | C48 | C49 | 108.8° | 103.9° |
| C47 | O40 | C48 | C80 | 133.9° | 136.4° |
| O40 | C47 | C81 | H79 | 120.0° | 120.0° |
| O40 | C47 | C81 | N2 | 62.6° | 62.5° |
| O40 | C47 | C81 | C1 | 175.5° | 177.6° |
| C47 | O40 | C48 | H80 | 13.0° | 16.2° |
| O40 | C47 | C81 | H136 | 57.7° | 57.7° |
| O40 | C48 | C49 | C80 | 118.0° | 119.9° |
| O40 | C48 | C49 | H80 | 122.7° | 120.1° |
| O40 | C48 | C49 | C50 | 63.2° | 62.5° |
| O40 | C48 | C49 | O42 | 177.1° | 177.5° |
| O40 | C48 | C80 | H80 | 121.7° | 120.2° |
| O40 | C48 | C80 | O51 | 61.9° | 63.3° |
| C48 | O40 | C47 | C81 | 167.7° | 171.7° |
| O40 | C48 | C80 | C77 | 178.8° | 176.9° |
| C48 | O40 | C47 | H79 | 48.7° | 51.8° |
| O40 | C48 | C49 | H81 | 57.8° | 57.5° |
| O40 | C48 | C80 | H134 | 59.5° | 57.0° |
| C48 | C49 | C50 | O42 | 121.5° | 120.0° |
| C48 | C49 | C50 | H81 | 120.8° | 120.0° |
| C48 | C49 | C50 | O41 | 60.5° | 174.1° |
| C48 | C49 | O42 | H81 | 118.6° | 119.9° |
| C48 | C49 | O42 | C51 | 60.7° | 61.1° |
| C49 | C48 | C80 | H80 | 119.2° | 119.9° |
| C49 | C48 | C80 | O51 | 179.0° | 176.8° |
| C49 | C48 | C80 | C77 | 59.7° | 57.0° |
| C48 | C49 | C50 | H82 | 179.2° | 54.1° |
| C48 | C49 | C50 | H83 | 59.9° | 65.8° |
| C49 | C48 | C80 | H134 | 59.6° | 62.9° |
| C49 | C50 | O41 | H82 | 120.3° | 120.0° |
| C49 | C50 | O41 | H83 | 120.3° | 120.0° |
| C50 | C49 | O42 | H81 | 117.0° | 120.0° |
| C50 | C49 | O42 | C51 | 175.0° | 178.9° |
| C50 | C49 | C48 | C80 | 178.8° | 177.6° |
| C50 | C49 | C48 | H80 | 59.5° | 57.7° |
| C49 | C50 | H82 | H83 | 119.1° | 120.0° |
| C49 | C50 | O41 | H84 | 180.0° | 180.0° |
| O41 | C50 | C49 | O42 | 61.0° | 65.9° |
| O41 | C50 | C49 | H81 | 178.7° | 54.1° |
| O41 | C50 | H82 | H83 | 119.2° | 120.0° |
| C49 | O42 | C51 | O43 | 61.2° | 58.9° |
| C49 | O42 | C51 | C77 | 59.0° | 61.1° |
| O42 | C49 | C48 | C80 | 59.1° | 57.6° |
| O42 | C49 | C48 | H80 | 60.2° | 62.4° |
| O42 | C49 | C50 | H82 | 59.3° | 174.1° |
| O42 | C49 | C50 | H83 | 178.6° | 54.2° |
| C49 | O42 | C51 | H85 | 177.3° | 178.9° |
| O42 | C51 | O43 | C77 | 121.3° | 119.9° |
| O42 | C51 | O43 | H85 | 121.4° | 120.1° |
| O42 | C51 | O43 | P1 | 72.0° | 90.1° |
| O42 | C51 | C77 | H85 | 119.2° | 120.1° |
| O42 | C51 | C77 | N1 | 179.5° | 177.5° |
| O42 | C51 | C77 | C80 | 56.8° | 57.6° |
| C51 | O42 | C49 | H81 | 58.0° | 58.9° |
| O42 | C51 | C77 | H129 | 60.8° | 62.5° |
| C51 | O43 | P1 | O44 | 64.6° | 175.0° |
| C51 | O43 | P1 | O48 | 53.0° | 65.0° |
| C51 | O43 | P1 | O49 | 178.4° | 55.0° |
| O43 | C51 | C77 | H85 | 118.4° | 120.1° |
| O43 | C51 | C77 | N1 | 57.1° | 57.6° |
| O43 | C51 | C77 | C80 | 65.6° | 62.3° |
| O43 | C51 | C77 | H129 | 176.8° | 177.6° |
| O43 | P1 | O44 | O48 | 118.1° | 120.0° |
| O43 | P1 | O44 | O49 | 113.2° | 120.0° |
| O43 | P1 | O44 | P2 | 78.2° | 165.0° |
| O43 | P1 | O48 | O49 | 123.0° | 120.0° |
| P1 | O43 | C51 | C77 | 166.7° | 150.0° |
| P1 | O43 | C51 | H85 | 49.4° | 30.0° |
| O43 | P1 | O48 | H142 | 123.0° | 60.0° |
| P1 | O44 | P2 | O45 | 78.5° | 75.0° |
| P1 | O44 | P2 | O46 | 167.0° | 165.0° |
| P1 | O44 | P2 | O47 | 54.3° | 45.0° |
| O44 | P1 | O48 | O49 | 123.6° | 120.0° |
| O44 | P1 | O48 | H142 | 123.5° | 60.0° |
| O44 | P2 | O45 | O46 | 107.1° | 120.0° |
| O44 | P2 | O45 | O47 | 130.2° | 120.0° |
| O44 | P2 | O46 | O47 | 117.1° | 120.0° |
| O44 | P2 | O46 | C52 | 60.7° | 175.0° |
| P2 | O44 | P1 | O48 | 39.9° | 75.0° |
| P2 | O44 | P1 | O49 | 168.6° | 45.0° |
| O44 | P2 | O45 | H141 | 130.3° | 60.0° |
| O45 | P2 | O46 | O47 | 128.7° | 120.0° |
| O45 | P2 | O46 | C52 | 174.9° | 65.1° |
| P2 | O46 | C52 | C53 | 167.1° | 180.0° |
| P2 | O46 | C52 | H86 | 47.0° | 59.9° |
| P2 | O46 | C52 | H87 | 72.7° | 60.0° |
| O46 | P2 | O45 | H141 | 122.6° | 60.0° |
| O46 | C52 | C53 | H86 | 120.2° | 120.1° |
| O46 | C52 | C53 | H87 | 120.2° | 120.0° |
| O46 | C52 | C53 | C54 | 52.8° | 180.0° |
| C52 | O46 | P2 | O47 | 56.4° | 54.9° |
| O46 | C52 | H86 | H87 | 119.5° | 119.9° |
| O46 | C52 | C53 | H88 | 173.2° | 60.0° |
| O46 | C52 | C53 | H89 | 67.7° | 60.0° |
| C52 | C53 | C54 | H88 | 120.5° | 120.0° |
| C52 | C53 | C54 | H89 | 120.5° | 120.0° |
| C52 | C53 | C54 | C55 | 53.3° | 65.0° |
| C52 | C53 | C54 | C56 | 178.9° | 175.0° |
| C53 | C52 | H86 | H87 | 119.4° | 120.0° |
| C52 | C53 | H88 | H89 | 118.5° | 120.0° |
| C52 | C53 | C54 | H90 | 62.9° | 55.0° |
| C53 | C54 | C55 | C56 | 127.1° | 120.0° |
| C53 | C54 | C55 | H90 | 116.2° | 120.0° |
| C53 | C54 | C56 | H90 | 118.2° | 120.0° |
| C53 | C54 | C56 | C57 | 178.9° | 175.0° |
| C54 | C53 | C52 | H86 | 67.4° | 60.0° |
| C54 | C53 | C52 | H87 | 173.0° | 60.0° |
| C54 | C53 | H88 | H89 | 118.6° | 119.9° |
| 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 | 60.8° | 64.9° |
| C53 | C54 | C56 | H95 | 58.6° | 55.0° |
| C55 | C54 | C56 | H90 | 116.7° | 120.0° |
| C55 | C54 | C56 | C57 | 56.0° | 65.1° |
| C55 | C54 | C53 | H88 | 67.2° | 55.0° |
| C55 | C54 | C53 | H89 | 173.7° | 175.0° |
| C54 | C55 | H91 | H92 | 120.0° | 120.0° |
| C54 | C55 | H91 | H93 | 120.0° | 120.0° |
| C54 | C55 | H92 | H93 | 120.0° | 120.0° |
| C55 | C54 | C56 | H94 | 64.3° | 55.0° |
| C55 | C54 | C56 | H95 | 176.3° | 175.0° |
| C54 | C56 | C57 | H94 | 120.3° | 120.1° |
| C54 | C56 | C57 | H95 | 120.3° | 119.9° |
| C54 | C56 | C57 | C58 | 165.9° | 180.0° |
| C56 | C54 | C53 | H88 | 58.4° | 64.9° |
| C56 | C54 | C53 | H89 | 60.6° | 55.0° |
| C56 | C54 | C55 | H91 | 52.9° | 60.0° |
| C56 | C54 | C55 | H92 | 172.9° | 60.0° |
| C56 | C54 | C55 | H93 | 67.1° | 180.0° |
| C54 | C56 | H94 | H95 | 119.0° | 119.9° |
| C54 | C56 | C57 | H96 | 73.7° | 60.0° |
| C54 | C56 | C57 | H97 | 45.5° | 60.1° |
| C56 | C57 | C58 | H96 | 120.4° | 120.0° |
| C56 | C57 | C58 | H97 | 120.4° | 120.0° |
| C56 | C57 | C58 | C59 | 125.9° | 119.6° |
| C57 | C56 | C54 | H90 | 60.7° | 55.0° |
| C57 | C56 | H94 | H95 | 119.0° | 120.0° |
| C56 | C57 | H96 | H97 | 118.7° | 120.0° |
| C56 | C57 | C58 | H98 | 54.1° | 60.4° |
| C57 | C58 | C59 | H98 | 180.0° | 180.0° |
| C57 | C58 | C59 | C60 | 0.6° | 6.5° |
| C57 | C58 | C59 | C76 | 178.1° | 173.5° |
| C58 | C57 | C56 | H94 | 45.6° | 59.9° |
| C58 | C57 | C56 | H95 | 73.8° | 60.1° |
| C58 | C57 | H96 | H97 | 118.7° | 120.0° |
| C58 | C59 | C60 | C76 | 178.8° | 180.0° |
| C58 | C59 | C60 | C61 | 175.4° | 93.7° |
| C59 | C58 | C57 | H96 | 5.5° | 0.5° |
| C59 | C58 | C57 | H97 | 113.7° | 120.5° |
| C58 | C59 | C60 | H100 | 63.5° | 146.3° |
| C58 | C59 | C60 | H99 | 54.2° | 26.3° |
| C58 | C59 | C76 | H126 | 180.0° | 90.0° |
| C58 | C59 | C76 | H127 | 60.0° | 150.0° |
| C58 | C59 | C76 | H128 | 60.0° | 29.9° |
| C59 | C60 | C61 | H100 | 121.1° | 120.0° |
| C59 | C60 | C61 | H99 | 121.1° | 120.0° |
| C59 | C60 | C61 | C62 | 80.1° | 180.0° |
| C60 | C59 | C58 | H98 | 179.4° | 173.5° |
| C59 | C60 | H100 | H99 | 116.4° | 120.0° |
| C59 | C60 | C61 | H101 | 158.9° | 60.0° |
| C59 | C60 | C61 | H102 | 41.0° | 59.9° |
| C60 | C59 | C76 | H126 | 1.2° | 90.0° |
| C60 | C59 | C76 | H127 | 118.8° | 30.0° |
| C60 | C59 | C76 | H128 | 121.2° | 150.0° |
| C60 | C61 | C62 | H101 | 121.1° | 120.0° |
| C60 | C61 | C62 | H102 | 121.0° | 120.0° |
| C60 | C61 | C62 | C63 | 126.6° | 123.9° |
| C61 | C60 | C59 | C76 | 3.4° | 86.3° |
| C61 | C60 | H100 | H99 | 116.4° | 120.0° |
| C60 | C61 | H101 | H102 | 116.7° | 120.0° |
| C60 | C61 | C62 | H103 | 53.4° | 56.1° |
| C61 | C62 | C63 | H103 | 180.0° | 180.0° |
| C61 | C62 | C63 | C64 | 0.9° | 0.2° |
| C61 | C62 | C63 | C65 | 178.1° | 179.9° |
| C62 | C61 | C60 | H100 | 41.1° | 60.0° |
| C62 | C61 | C60 | H99 | 158.8° | 60.0° |
| C62 | C61 | H101 | H102 | 116.7° | 120.0° |
| C62 | C63 | C64 | C65 | 179.1° | 180.0° |
| C62 | C63 | C65 | C66 | 54.1° | 95.0° |
| C63 | C62 | C61 | H101 | 5.6° | 116.1° |
| C63 | C62 | C61 | H102 | 112.3° | 3.8° |
| C62 | C63 | C64 | H104 | 180.0° | 87.0° |
| C62 | C63 | C64 | H105 | 60.0° | 153.0° |
| C62 | C63 | C64 | H106 | 60.0° | 33.0° |
| C62 | C63 | C65 | H107 | 66.3° | 145.0° |
| C62 | C63 | C65 | H108 | 174.5° | 25.0° |
| C64 | C63 | C65 | C66 | 125.0° | 85.0° |
| C64 | C63 | C62 | H103 | 179.1° | 179.8° |
| C63 | C64 | H104 | H105 | 120.0° | 119.9° |
| C63 | C64 | H104 | H106 | 120.0° | 120.0° |
| C63 | C64 | H105 | H106 | 120.0° | 120.0° |
| C64 | C63 | C65 | H107 | 114.6° | 35.0° |
| C64 | C63 | C65 | H108 | 4.6° | 155.0° |
| C63 | C65 | C66 | H107 | 120.4° | 120.0° |
| C63 | C65 | C66 | H108 | 120.4° | 120.0° |
| C63 | C65 | C66 | C67 | 155.1° | 180.0° |
| C65 | C63 | C62 | H103 | 1.9° | 0.1° |
| C65 | C63 | C64 | H104 | 1.0° | 92.9° |
| C65 | C63 | C64 | H105 | 120.9° | 27.0° |
| C65 | C63 | C64 | H106 | 119.1° | 147.1° |
| C63 | C65 | H107 | H108 | 118.8° | 120.0° |
| C63 | C65 | C66 | H109 | 34.5° | 60.0° |
| C63 | C65 | C66 | H110 | 84.2° | 60.0° |
| C65 | C66 | C67 | H109 | 120.6° | 120.1° |
| C65 | C66 | C67 | H110 | 120.7° | 120.0° |
| C65 | C66 | C67 | C68 | 113.1° | 122.9° |
| C66 | C65 | H107 | H108 | 118.8° | 120.0° |
| C65 | C66 | H109 | H110 | 118.0° | 120.1° |
| C65 | C66 | C67 | H111 | 66.9° | 57.0° |
| C66 | C67 | C68 | H111 | 180.0° | 180.0° |
| C66 | C67 | C68 | C69 | 177.5° | 173.9° |
| C66 | C67 | C68 | C75 | 1.8° | 6.1° |
| C67 | C66 | C65 | H107 | 84.4° | 60.0° |
| C67 | C66 | C65 | H108 | 34.8° | 60.0° |
| C67 | C66 | H109 | H110 | 117.9° | 119.9° |
| C67 | C68 | C69 | C75 | 179.3° | 179.9° |
| C67 | C68 | C69 | C70 | 1.9° | 95.0° |
| C68 | C67 | C66 | H109 | 126.2° | 2.9° |
| C68 | C67 | C66 | H110 | 7.5° | 117.1° |
| C67 | C68 | C69 | H112 | 122.6° | 145.0° |
| C67 | C68 | C69 | H113 | 118.8° | 25.0° |
| C67 | C68 | C75 | H123 | 180.0° | 84.9° |
| C67 | C68 | C75 | H124 | 60.0° | 155.1° |
| C67 | C68 | C75 | H125 | 60.0° | 35.1° |
| C68 | C69 | C70 | H112 | 120.7° | 120.0° |
| C68 | C69 | C70 | H113 | 120.6° | 120.0° |
| C68 | C69 | C70 | C71 | 107.2° | 180.0° |
| C69 | C68 | C67 | H111 | 2.5° | 6.1° |
| C68 | C69 | H112 | H113 | 118.0° | 120.0° |
| C68 | C69 | C70 | H114 | 13.3° | 60.0° |
| C68 | C69 | C70 | H115 | 132.2° | 60.0° |
| C69 | C68 | C75 | H123 | 0.7° | 95.2° |
| C69 | C68 | C75 | H124 | 119.3° | 24.8° |
| C69 | C68 | C75 | H125 | 120.7° | 144.9° |
| C69 | C70 | C71 | H114 | 120.6° | 120.0° |
| C69 | C70 | C71 | H115 | 120.5° | 120.0° |
| C69 | C70 | C71 | C72 | 118.4° | 119.1° |
| C70 | C69 | C68 | C75 | 177.4° | 85.0° |
| C70 | C69 | H112 | H113 | 118.0° | 120.0° |
| C69 | C70 | H114 | H115 | 118.3° | 120.0° |
| C69 | C70 | C71 | H116 | 61.6° | 60.9° |
| C70 | C71 | C72 | H116 | 180.0° | 179.9° |
| C70 | C71 | C72 | C73 | 179.3° | 8.2° |
| C70 | C71 | C72 | C74 | 0.8° | 171.8° |
| C71 | C70 | C69 | H112 | 132.1° | 60.0° |
| C71 | C70 | C69 | H113 | 13.4° | 60.0° |
| C71 | C70 | H114 | H115 | 118.3° | 120.1° |
| C71 | C72 | C73 | C74 | 180.0° | 180.0° |
| C72 | C71 | C70 | H114 | 2.2° | 0.9° |
| C72 | C71 | C70 | H115 | 121.0° | 121.0° |
| C71 | C72 | C73 | H117 | 180.0° | 6.0° |
| C71 | C72 | C73 | H118 | 60.0° | 114.0° |
| C71 | C72 | C73 | H119 | 60.0° | 126.0° |
| 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 | 0.7° | 171.8° |
| 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 | 0.1° | 90.0° |
| C73 | C72 | C74 | H121 | 119.9° | 30.0° |
| C73 | C72 | C74 | H122 | 120.1° | 150.0° |
| C74 | C72 | C71 | H116 | 179.2° | 8.2° |
| C74 | C72 | C73 | H117 | 0.1° | 174.0° |
| C74 | C72 | C73 | H118 | 120.1° | 66.0° |
| C74 | C72 | C73 | H119 | 120.0° | 54.0° |
| C72 | C74 | H120 | H121 | 120.0° | 120.0° |
| C72 | C74 | H120 | H122 | 120.0° | 120.0° |
| C72 | C74 | H121 | H122 | 120.0° | 120.0° |
| C75 | C68 | C67 | H111 | 178.2° | 173.8° |
| C75 | C68 | C69 | H112 | 56.8° | 35.0° |
| C75 | C68 | C69 | H113 | 61.9° | 155.0° |
| C68 | C75 | H123 | H124 | 120.0° | 120.0° |
| C68 | C75 | H123 | H125 | 120.0° | 120.0° |
| C68 | C75 | H124 | H125 | 120.0° | 120.0° |
| C76 | C59 | C58 | H98 | 1.9° | 6.6° |
| C76 | C59 | C60 | H100 | 117.7° | 33.7° |
| C76 | C59 | C60 | H99 | 124.6° | 153.8° |
| C59 | C76 | H126 | H127 | 120.0° | 120.1° |
| 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 | 121.2° | 119.7° |
| C51 | C77 | N1 | H129 | 119.2° | 120.1° |
| C51 | C77 | N1 | C78 | 117.5° | 84.9° |
| C51 | C77 | C80 | C48 | 58.8° | 57.0° |
| C51 | C77 | C80 | O51 | 178.7° | 176.8° |
| C51 | C77 | C80 | H129 | 117.5° | 119.9° |
| C51 | C77 | C80 | H134 | 60.5° | 62.9° |
| C51 | C77 | N1 | H130 | 62.5° | 95.0° |
| C77 | N1 | C78 | H130 | 180.0° | 180.0° |
| C77 | N1 | C78 | C79 | 0.2° | 180.0° |
| C77 | N1 | C78 | O50 | 179.7° | 0.0° |
| N1 | C77 | C80 | C48 | 178.8° | 176.9° |
| N1 | C77 | C80 | O51 | 58.9° | 63.3° |
| N1 | C77 | C80 | H129 | 120.1° | 120.2° |
| N1 | C77 | C51 | H85 | 61.3° | 62.5° |
| N1 | C77 | C80 | H134 | 61.9° | 57.0° |
| N1 | C78 | C79 | O50 | 179.9° | 179.9° |
| C78 | N1 | C77 | C80 | 121.3° | 155.4° |
| C78 | N1 | C77 | H129 | 1.8° | 35.1° |
| N1 | C78 | C79 | H131 | 179.9° | 89.9° |
| N1 | C78 | C79 | H132 | 59.9° | 30.0° |
| N1 | C78 | C79 | H133 | 60.1° | 150.0° |
| C78 | C79 | H131 | H132 | 120.0° | 120.0° |
| C78 | C79 | H131 | H133 | 120.0° | 120.1° |
| C78 | C79 | H132 | H133 | 120.0° | 120.0° |
| C79 | C78 | N1 | H130 | 179.8° | 0.1° |
| O50 | C78 | C79 | H131 | 0.0° | 90.0° |
| O50 | C78 | C79 | H132 | 120.0° | 150.0° |
| O50 | C78 | C79 | H133 | 120.0° | 30.1° |
| O50 | C78 | N1 | H130 | 0.3° | 180.0° |
| C48 | C80 | O51 | C77 | 119.5° | 119.5° |
| C48 | C80 | O51 | H134 | 120.5° | 120.2° |
| C48 | C80 | C77 | H134 | 119.3° | 119.9° |
| C80 | C48 | C49 | H81 | 60.3° | 62.4° |
| C48 | C80 | C77 | H129 | 58.7° | 62.9° |
| C48 | C80 | O51 | H135 | 180.0° | 175.3° |
| O51 | C80 | C77 | H134 | 120.8° | 120.3° |
| O51 | C80 | C48 | H80 | 59.8° | 56.9° |
| O51 | C80 | C77 | H129 | 61.2° | 56.9° |
| C47 | C81 | N2 | C1 | 119.6° | 119.7° |
| C47 | C81 | N2 | H136 | 119.8° | 120.2° |
| C47 | C81 | N2 | C82 | 108.8° | 85.3° |
| C47 | C81 | C1 | H136 | 117.9° | 119.9° |
| C47 | C81 | C1 | H2 | 61.1° | 62.9° |
| C47 | C81 | N2 | H137 | 71.1° | 94.7° |
| C81 | N2 | C82 | H137 | 180.0° | 180.0° |
| C81 | N2 | C82 | C83 | 0.9° | 180.0° |
| C81 | N2 | C82 | O52 | 178.7° | 0.0° |
| N2 | C81 | C1 | H136 | 121.2° | 120.1° |
| N2 | C81 | C1 | H2 | 59.8° | 57.1° |
| N2 | C81 | C47 | H79 | 57.5° | 57.5° |
| N2 | C82 | C83 | O52 | 179.6° | 180.0° |
| C82 | N2 | C81 | C1 | 131.5° | 155.0° |
| C82 | N2 | C81 | H136 | 10.9° | 34.9° |
| N2 | C82 | C83 | H138 | 179.6° | 179.9° |
| N2 | C82 | C83 | H139 | 59.6° | 60.0° |
| N2 | C82 | C83 | H140 | 60.3° | 60.0° |
| C82 | C83 | H138 | H139 | 120.0° | 120.0° |
| C82 | C83 | H138 | H140 | 120.0° | 120.0° |
| C82 | C83 | H139 | H140 | 120.0° | 120.0° |
| C83 | C82 | N2 | H137 | 179.1° | 0.0° |
| O52 | C82 | C83 | H138 | 0.0° | 0.0° |
| O52 | C82 | C83 | H139 | 120.0° | 120.0° |
| O52 | C82 | C83 | H140 | 120.0° | 120.1° |
| O52 | C82 | N2 | H137 | 1.3° | 180.0° |
| C81 | C1 | C2 | H3 | 61.5° | 63.0° |
| C1 | C81 | C47 | H79 | 64.5° | 62.4° |
| C1 | C81 | N2 | H137 | 48.5° | 25.0° |
| C81 | C1 | O1 | H1 | 59.0° | 60.4° |
| C26 | C4 | C3 | H4 | 59.4° | 62.4° |
| C4 | C26 | C25 | H41 | 67.1° | 63.0° |
| C26 | C4 | O3 | H6 | 59.3° | 179.7° |
| C12 | C8 | C7 | H10 | 173.5° | 177.6° |
| C8 | C12 | C11 | H17 | 65.1° | 62.9° |
| C12 | C8 | O6 | H12 | 57.6° | 179.7° |
| C24 | C14 | C13 | H20 | 167.7° | 177.5° |
| C14 | C24 | C23 | H37 | 54.0° | 62.9° |
| C14 | C24 | O20 | H40 | 60.4° | 180.0° |
| C20 | C16 | C15 | H22 | 172.7° | 177.6° |
| C16 | C20 | C19 | H29 | 70.6° | 63.0° |
| C20 | C16 | O12 | H24 | 56.8° | 179.6° |
| C16 | C20 | O16 | H32 | 56.2° | 59.9° |
| O34 | C27 | C28 | H45 | 173.4° | 177.6° |
| C27 | O34 | C43 | H69 | 63.8° | 58.8° |
| O30 | C29 | C30 | H47 | 175.3° | 177.5° |
| C29 | O30 | C39 | H61 | 65.1° | 58.8° |
| C36 | C32 | C31 | H48 | 167.0° | 177.6° |
| C32 | C36 | C35 | H55 | 65.5° | 63.0° |
| C36 | C32 | O25 | H50 | 56.5° | 179.7° |
| C32 | C36 | O29 | H58 | 57.0° | 60.0° |
| C77 | C80 | C48 | H80 | 59.5° | 62.9° |
| C80 | C77 | C51 | H85 | 176.0° | 177.6° |
| C80 | C77 | N1 | H130 | 58.6° | 24.7° |
| C77 | C80 | O51 | H135 | 60.5° | 55.8° |
| H2 | C1 | C2 | H3 | 179.9° | 177.2° |
| H2 | C1 | C81 | H136 | 179.0° | 177.2° |
| H2 | C1 | O1 | H1 | 59.8° | 59.7° |
| H3 | C2 | C45 | H75 | 177.5° | 177.7° |
| H4 | C3 | C4 | H5 | 59.1° | 57.6° |
| H5 | C4 | C26 | H43 | 54.2° | 57.1° |
| H5 | C4 | O3 | H6 | 60.4° | 60.2° |
| H7 | C5 | C6 | H8 | 161.9° | 63.0° |
| H7 | C5 | C6 | H9 | 78.2° | 57.0° |
| H7 | C5 | C25 | H41 | 175.2° | 177.7° |
| H10 | C7 | C8 | H11 | 68.1° | 62.5° |
| H11 | C8 | C12 | H19 | 52.5° | 57.1° |
| H11 | C8 | O6 | H12 | 61.2° | 60.1° |
| H13 | C9 | C10 | H14 | 61.0° | 65.0° |
| H13 | C9 | C10 | H15 | 179.5° | 175.0° |
| H13 | C9 | C11 | H17 | 176.8° | 177.6° |
| H14 | C10 | O8 | H16 | 59.7° | 59.9° |
| H15 | C10 | O8 | H16 | 59.7° | 60.0° |
| H17 | C11 | C12 | H19 | 175.6° | 177.2° |
| H17 | C11 | O9 | H18 | 60.1° | 60.1° |
| H20 | C13 | C14 | H21 | 71.8° | 62.5° |
| H21 | C14 | C24 | H39 | 61.5° | 57.1° |
| H22 | C15 | C16 | H23 | 69.1° | 62.4° |
| H23 | C16 | C20 | H31 | 47.5° | 57.0° |
| H23 | C16 | O12 | H24 | 62.0° | 60.2° |
| H25 | C17 | C18 | H26 | 59.3° | 65.0° |
| H25 | C17 | C18 | H27 | 60.0° | 175.0° |
| H25 | C17 | C19 | H29 | 175.3° | 177.7° |
| H26 | C18 | O14 | H28 | 59.7° | 60.1° |
| H27 | C18 | O14 | H28 | 59.7° | 59.9° |
| H29 | C19 | C20 | H31 | 170.5° | 177.1° |
| H29 | C19 | O15 | H30 | 61.4° | 59.9° |
| H31 | C20 | O16 | H32 | 61.6° | 60.2° |
| H33 | C21 | C22 | H34 | 58.8° | 64.9° |
| H33 | C21 | C22 | H35 | 60.6° | 175.0° |
| H33 | C21 | C23 | H37 | 178.2° | 177.6° |
| H34 | C22 | O18 | H36 | 59.7° | 60.1° |
| H35 | C22 | O18 | H36 | 59.7° | 60.0° |
| H37 | C23 | C24 | H39 | 172.3° | 177.2° |
| H37 | C23 | O19 | H38 | 59.3° | 60.1° |
| H39 | C24 | O20 | H40 | 59.5° | 59.8° |
| H41 | C25 | C26 | H43 | 173.9° | 177.2° |
| H41 | C25 | O21 | H42 | 58.4° | 60.1° |
| H44 | C27 | C28 | H45 | 70.7° | 62.4° |
| H45 | C28 | C41 | H67 | 61.3° | 57.1° |
| H46 | C29 | C30 | H47 | 68.9° | 62.5° |
| H47 | C30 | C37 | H59 | 64.0° | 57.0° |
| H48 | C31 | C32 | H49 | 74.8° | 62.5° |
| H49 | C32 | C36 | H57 | 51.6° | 57.1° |
| H49 | C32 | O25 | H50 | 62.0° | 60.1° |
| H51 | C33 | C34 | H52 | 61.4° | 65.0° |
| H51 | C33 | C34 | H53 | 179.2° | 175.0° |
| H51 | C33 | C35 | H55 | 176.2° | 177.7° |
| H52 | C34 | O27 | H54 | 59.7° | 60.0° |
| H53 | C34 | O27 | H54 | 59.7° | 60.1° |
| H55 | C35 | C36 | H57 | 176.0° | 177.2° |
| H55 | C35 | O28 | H56 | 61.1° | 59.8° |
| H57 | C36 | O29 | H58 | 61.3° | 60.2° |
| H59 | C37 | C38 | H60 | 173.2° | 177.2° |
| H59 | C37 | O33 | H66 | 60.2° | 59.7° |
| H60 | C38 | C39 | H61 | 180.0° | 177.7° |
| H60 | C38 | O32 | H65 | 58.6° | 59.8° |
| H61 | C39 | C40 | H62 | 62.0° | 65.0° |
| H61 | C39 | C40 | H63 | 178.6° | 175.0° |
| H62 | C40 | O31 | H64 | 59.7° | 60.0° |
| H63 | C40 | O31 | H64 | 59.7° | 59.9° |
| H67 | C41 | C42 | H68 | 174.8° | 177.3° |
| H67 | C41 | O37 | H74 | 60.7° | 59.8° |
| H68 | C42 | C43 | H69 | 179.8° | 177.7° |
| H68 | C42 | O36 | H73 | 58.7° | 59.8° |
| H69 | C43 | C44 | H70 | 61.3° | 65.0° |
| H69 | C43 | C44 | H71 | 179.3° | 175.0° |
| H70 | C44 | O35 | H72 | 59.8° | 60.0° |
| H71 | C44 | O35 | H72 | 59.7° | 60.0° |
| H75 | C45 | C46 | H76 | 60.9° | 65.9° |
| H75 | C45 | C46 | H77 | 179.6° | 174.2° |
| H76 | C46 | O38 | H78 | 59.8° | 60.0° |
| H77 | C46 | O38 | H78 | 59.8° | 60.0° |
| H79 | C47 | C81 | H136 | 177.7° | 177.7° |
| H80 | C48 | C49 | H81 | 179.6° | 177.7° |
| H80 | C48 | C80 | H134 | 178.8° | 177.2° |
| H81 | C49 | C50 | H82 | 58.4° | 65.9° |
| H81 | C49 | C50 | H83 | 61.0° | 174.1° |
| H82 | C50 | O41 | H84 | 59.7° | 60.0° |
| H83 | C50 | O41 | H84 | 59.7° | 59.9° |
| H85 | C51 | C77 | H129 | 58.5° | 57.6° |
| H86 | C52 | C53 | H88 | 53.1° | 60.0° |
| H86 | C52 | C53 | H89 | 172.1° | 180.0° |
| H87 | C52 | C53 | H88 | 66.6° | 180.0° |
| H87 | C52 | C53 | H89 | 52.5° | 60.0° |
| H88 | C53 | C54 | H90 | 176.6° | 175.0° |
| H89 | C53 | C54 | H90 | 57.6° | 65.0° |
| H90 | C54 | C55 | H91 | 63.8° | 180.0° |
| H90 | C54 | C55 | H92 | 56.2° | 60.0° |
| H90 | C54 | C55 | H93 | 176.2° | 60.0° |
| H90 | C54 | C56 | H94 | 179.0° | 175.1° |
| H90 | C54 | C56 | H95 | 59.7° | 65.0° |
| H91 | C55 | H92 | H93 | 120.0° | 120.0° |
| H94 | C56 | C57 | H96 | 166.0° | 179.9° |
| H94 | C56 | C57 | H97 | 74.8° | 60.0° |
| H95 | C56 | C57 | H96 | 46.7° | 59.9° |
| H95 | C56 | C57 | H97 | 165.8° | 180.0° |
| H96 | C57 | C58 | H98 | 174.6° | 179.6° |
| H97 | C57 | C58 | H98 | 66.3° | 59.6° |
| H100 | C60 | C61 | H101 | 80.0° | 180.0° |
| H100 | C60 | C61 | H102 | 162.1° | 60.0° |
| H99 | C60 | C61 | H101 | 37.7° | 60.0° |
| H99 | C60 | C61 | H102 | 80.2° | 179.9° |
| H101 | C61 | C62 | H103 | 174.4° | 63.9° |
| H102 | C61 | C62 | H103 | 67.7° | 176.2° |
| H104 | C64 | H105 | H106 | 120.0° | 120.0° |
| H107 | C65 | C66 | H109 | 154.9° | 180.0° |
| H107 | C65 | C66 | H110 | 36.2° | 60.0° |
| H108 | C65 | C66 | H109 | 85.9° | 60.0° |
| H108 | C65 | C66 | H110 | 155.4° | 180.0° |
| H109 | C66 | C67 | H111 | 53.8° | 177.1° |
| H110 | C66 | C67 | H111 | 172.5° | 63.0° |
| H112 | C69 | C70 | H114 | 107.3° | 180.0° |
| H112 | C69 | C70 | H115 | 11.5° | 60.0° |
| H113 | C69 | C70 | H114 | 134.0° | 60.0° |
| H113 | C69 | C70 | H115 | 107.2° | 180.0° |
| H114 | C70 | C71 | H116 | 177.8° | 179.2° |
| H115 | C70 | C71 | H116 | 58.9° | 59.1° |
| 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° | 119.9° |
| H129 | C77 | C80 | H134 | 178.0° | 177.2° |
| H129 | C77 | N1 | H130 | 178.2° | 144.9° |
| H131 | C79 | H132 | H133 | 120.0° | 120.0° |
| H134 | C80 | O51 | H135 | 59.5° | 64.4° |
| H136 | C81 | N2 | H137 | 169.1° | 145.1° |
| H138 | C83 | H139 | H140 | 120.0° | 120.0° |
