PRD_002425
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.47Å | 1.48Å | |
| N1 | H1 | sing | 1.01Å | 1.00Å | |
| N1 | H2 | sing | 1.01Å | 1.00Å | |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | O1 | doub | 1.21Å | 1.23Å | |
| N2 | C3 | sing | 1.46Å | 1.45Å | |
| N2 | H5 | sing | 0.97Å | 1.00Å | |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| C3 | C5 | sing | 1.53Å | 1.53Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | O2 | doub | 1.21Å | 1.23Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | N3 | sing | 1.47Å | 1.48Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| N3 | H15 | sing | 1.01Å | 1.00Å | |
| N3 | H16 | sing | 1.01Å | 1.00Å | |
| N3 | H17 | sing | 1.01Å | 1.00Å | |
| N4 | C9 | sing | 1.47Å | 1.46Å | |
| N4 | C13 | sing | 1.47Å | 1.47Å | |
| C9 | C10 | sing | 1.51Å | 1.52Å | |
| C9 | C11 | sing | 1.54Å | 1.53Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | O3 | doub | 1.21Å | 1.23Å | |
| C11 | C12 | sing | 1.55Å | 1.52Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.55Å | 1.52Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å | |
| C13 | H24 | sing | 1.09Å | 1.10Å | |
| N5 | C14 | sing | 1.47Å | 1.45Å | |
| N5 | H25 | sing | 0.97Å | 1.00Å | |
| C14 | C15 | sing | 1.51Å | 1.52Å | |
| C14 | C16 | sing | 1.53Å | 1.53Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C15 | O4 | doub | 1.21Å | 1.23Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| C17 | H30 | sing | 1.09Å | 1.10Å | |
| C18 | N6 | sing | 1.46Å | 1.46Å | |
| C18 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| N6 | C19 | sing | 1.37Å | 1.33Å | |
| N6 | H33 | sing | 0.97Å | 1.00Å | |
| C19 | N7 | sing | 1.33Å | 1.32Å | |
| C19 | N8 | doub | 1.33Å | 1.32Å | |
| N7 | H34 | sing | 0.97Å | 1.00Å | |
| N7 | H35 | sing | 0.97Å | 1.00Å | |
| N8 | H36 | sing | 0.97Å | 1.00Å | |
| N8 | H37 | sing | 0.97Å | 1.00Å | |
| N9 | C20 | sing | 1.47Å | 1.46Å | |
| N9 | C24 | sing | 1.47Å | 1.47Å | |
| C20 | C21 | sing | 1.51Å | 1.53Å | |
| C20 | C22 | sing | 1.54Å | 1.54Å | |
| C20 | H38 | sing | 1.09Å | 1.10Å | |
| C21 | O5 | doub | 1.21Å | 1.23Å | |
| C22 | C23 | sing | 1.55Å | 1.51Å | |
| C22 | H39 | sing | 1.09Å | 1.10Å | |
| C22 | H40 | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.55Å | 1.52Å | |
| C23 | H41 | sing | 1.09Å | 1.10Å | |
| C23 | H42 | sing | 1.09Å | 1.10Å | |
| C24 | H43 | sing | 1.09Å | 1.10Å | |
| C24 | H44 | sing | 1.09Å | 1.10Å | |
| N10 | C25 | sing | 1.47Å | 1.45Å | |
| N10 | H45 | sing | 0.97Å | 1.00Å | |
| C25 | C26 | sing | 1.51Å | 1.52Å | |
| C25 | C27 | sing | 1.53Å | 1.53Å | |
| C25 | H46 | sing | 1.09Å | 1.10Å | |
| C26 | O6 | doub | 1.21Å | 1.23Å | |
| C27 | C28 | sing | 1.51Å | 1.51Å | |
| C27 | H47 | sing | 1.09Å | 1.10Å | |
| C27 | H48 | sing | 1.09Å | 1.10Å | |
| C28 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | H49 | sing | 1.08Å | 1.08Å | |
| C30 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | H50 | sing | 1.08Å | 1.08Å | |
| C31 | C33 | doub | 1.39Å | 1.38Å | Aromatic |
| C31 | H51 | sing | 1.08Å | 1.08Å | |
| C32 | C33 | sing | 1.39Å | 1.38Å | Aromatic |
| C32 | H52 | sing | 1.08Å | 1.08Å | |
| C33 | O7 | sing | 1.36Å | 1.37Å | |
| O7 | H53 | sing | 0.97Å | 0.95Å | |
| N11 | C34 | sing | 1.47Å | 1.45Å | |
| N11 | H54 | sing | 0.97Å | 1.00Å | |
| C34 | C35 | sing | 1.51Å | 1.53Å | |
| C34 | C36 | sing | 1.53Å | 1.50Å | |
| C34 | H55 | sing | 1.09Å | 1.10Å | |
| C35 | O8 | doub | 1.21Å | 1.23Å | |
| C36 | O9 | sing | 1.43Å | 1.42Å | |
| C36 | H56 | sing | 1.09Å | 1.10Å | |
| C36 | H57 | sing | 1.09Å | 1.10Å | |
| O9 | H58 | sing | 0.97Å | 0.95Å | |
| N12 | C37 | sing | 1.47Å | 1.46Å | |
| N12 | C41 | sing | 1.47Å | 1.47Å | |
| C37 | C38 | sing | 1.51Å | 1.53Å | |
| C37 | C39 | sing | 1.54Å | 1.53Å | |
| C37 | H59 | sing | 1.09Å | 1.10Å | |
| C38 | O10 | doub | 1.21Å | 1.23Å | |
| C39 | C40 | sing | 1.55Å | 1.52Å | |
| C39 | H60 | sing | 1.09Å | 1.10Å | |
| C39 | H61 | sing | 1.09Å | 1.10Å | |
| C40 | C41 | sing | 1.55Å | 1.51Å | |
| C40 | H62 | sing | 1.09Å | 1.10Å | |
| C40 | H63 | sing | 1.09Å | 1.10Å | |
| C41 | H64 | sing | 1.09Å | 1.10Å | |
| C41 | H65 | sing | 1.09Å | 1.10Å | |
| N13 | C42 | sing | 1.46Å | 1.45Å | |
| N13 | H66 | sing | 0.97Å | 1.00Å | |
| C42 | C43 | sing | 1.51Å | 1.53Å | |
| C42 | C44 | sing | 1.53Å | 1.54Å | |
| C42 | H67 | sing | 1.09Å | 1.10Å | |
| C43 | O11 | doub | 1.21Å | 1.23Å | |
| C44 | C45 | sing | 1.53Å | 1.52Å | |
| C44 | H68 | sing | 1.09Å | 1.10Å | |
| C44 | H69 | sing | 1.09Å | 1.10Å | |
| C45 | C46 | sing | 1.53Å | 1.52Å | |
| C45 | H70 | sing | 1.09Å | 1.10Å | |
| C45 | H71 | sing | 1.09Å | 1.10Å | |
| C46 | N14 | sing | 1.46Å | 1.46Å | |
| C46 | H72 | sing | 1.09Å | 1.10Å | |
| C46 | H73 | sing | 1.09Å | 1.10Å | |
| N14 | C47 | sing | 1.37Å | 1.33Å | |
| N14 | H74 | sing | 0.97Å | 1.00Å | |
| C47 | N15 | sing | 1.33Å | 1.32Å | |
| C47 | N16 | doub | 1.33Å | 1.32Å | |
| N15 | H75 | sing | 0.97Å | 1.00Å | |
| N15 | H76 | sing | 0.97Å | 1.00Å | |
| N16 | H77 | sing | 0.97Å | 1.00Å | |
| N16 | H78 | sing | 0.97Å | 1.00Å | |
| N17 | C48 | sing | 1.47Å | 1.46Å | |
| N17 | C52 | sing | 1.47Å | 1.47Å | |
| C48 | C49 | sing | 1.51Å | 1.53Å | |
| C48 | C50 | sing | 1.54Å | 1.53Å | |
| C48 | H79 | sing | 1.09Å | 1.10Å | |
| C49 | O12 | doub | 1.21Å | 1.23Å | |
| C50 | C51 | sing | 1.55Å | 1.51Å | |
| C50 | H80 | sing | 1.09Å | 1.10Å | |
| C50 | H81 | sing | 1.09Å | 1.10Å | |
| C51 | C52 | sing | 1.55Å | 1.51Å | |
| C51 | H82 | sing | 1.09Å | 1.10Å | |
| C51 | H83 | sing | 1.09Å | 1.10Å | |
| C52 | H84 | sing | 1.09Å | 1.10Å | |
| C52 | H85 | sing | 1.09Å | 1.10Å | |
| N18 | C53 | sing | 1.46Å | 1.45Å | |
| N18 | H86 | sing | 0.97Å | 1.00Å | |
| C53 | C54 | sing | 1.51Å | 1.49Å | |
| C53 | C55 | sing | 1.53Å | 1.52Å | |
| C53 | H87 | sing | 1.09Å | 1.10Å | |
| C54 | O13 | doub | 1.21Å | 1.21Å | |
| C55 | O14 | sing | 1.43Å | 1.42Å | |
| C55 | C56 | sing | 1.53Å | 1.50Å | |
| C55 | H88 | sing | 1.09Å | 1.10Å | |
| O14 | H89 | sing | 0.97Å | 0.95Å | |
| C56 | H90 | sing | 1.09Å | 1.10Å | |
| C56 | H91 | sing | 1.09Å | 1.10Å | |
| C56 | H92 | sing | 1.09Å | 1.10Å | |
| N19 | C57 | sing | 1.46Å | 1.46Å | |
| N19 | H93 | sing | 0.97Å | 1.00Å | |
| C57 | C58 | sing | 1.51Å | 1.53Å | |
| C57 | C59 | sing | 1.53Å | 1.50Å | |
| C57 | H94 | sing | 1.09Å | 1.10Å | |
| C58 | O15 | doub | 1.21Å | 1.22Å | |
| C59 | O16 | sing | 1.43Å | 1.41Å | |
| C59 | H95 | sing | 1.09Å | 1.10Å | |
| C59 | H96 | sing | 1.09Å | 1.10Å | |
| O16 | H97 | sing | 0.97Å | 0.95Å | |
| N20 | C60 | sing | 1.46Å | 1.46Å | |
| N20 | H98 | sing | 0.97Å | 1.00Å | |
| C60 | C61 | sing | 1.51Å | 1.52Å | |
| C60 | C62 | sing | 1.53Å | 1.52Å | |
| C60 | H99 | sing | 1.09Å | 1.10Å | |
| C61 | O17 | doub | 1.21Å | 1.21Å | |
| C62 | C63 | sing | 1.51Å | 1.49Å | |
| C62 | H100 | sing | 1.09Å | 1.10Å | |
| C62 | H101 | sing | 1.09Å | 1.10Å | |
| C63 | N21 | sing | 1.34Å | 1.38Å | Aromatic |
| C63 | C64 | doub | 1.35Å | 1.35Å | Aromatic |
| N21 | C65 | doub | 1.31Å | 1.32Å | Aromatic |
| N21 | H102 | sing | 0.97Å | 1.00Å | |
| C64 | N22 | sing | 1.37Å | 1.37Å | Aromatic |
| C64 | H103 | sing | 1.08Å | 1.08Å | |
| C65 | N22 | sing | 1.35Å | 1.32Å | Aromatic |
| C65 | H104 | sing | 1.08Å | 1.08Å | |
| N22 | H105 | sing | 0.97Å | 1.00Å | |
| N23 | C66 | sing | 1.47Å | 1.47Å | |
| N23 | C70 | sing | 1.47Å | 1.48Å | |
| C66 | C67 | sing | 1.51Å | 1.53Å | |
| C66 | C68 | sing | 1.54Å | 1.53Å | |
| C66 | H106 | sing | 1.09Å | 1.10Å | |
| C67 | O18 | doub | 1.21Å | 1.22Å | |
| C68 | C69 | sing | 1.55Å | 1.49Å | |
| C68 | H107 | sing | 1.09Å | 1.10Å | |
| C68 | H108 | sing | 1.09Å | 1.10Å | |
| C69 | C70 | sing | 1.55Å | 1.50Å | |
| C69 | H109 | sing | 1.09Å | 1.10Å | |
| C69 | H110 | sing | 1.09Å | 1.10Å | |
| C70 | H111 | sing | 1.09Å | 1.10Å | |
| C70 | H112 | sing | 1.09Å | 1.10Å | |
| N24 | C71 | sing | 1.47Å | 1.45Å | |
| N24 | H113 | sing | 0.97Å | 1.00Å | |
| C71 | C72 | sing | 1.51Å | 1.52Å | |
| C71 | C73 | sing | 1.53Å | 1.51Å | |
| C71 | H114 | sing | 1.09Å | 1.10Å | |
| C72 | O19 | doub | 1.21Å | 1.23Å | |
| C73 | C74 | sing | 1.53Å | 1.52Å | |
| C73 | H115 | sing | 1.09Å | 1.10Å | |
| C73 | H116 | sing | 1.09Å | 1.10Å | |
| C74 | C75 | sing | 1.53Å | 1.52Å | |
| C74 | H117 | sing | 1.09Å | 1.10Å | |
| C74 | H118 | sing | 1.09Å | 1.10Å | |
| C75 | N25 | sing | 1.46Å | 1.45Å | |
| C75 | H119 | sing | 1.09Å | 1.10Å | |
| C75 | H120 | sing | 1.09Å | 1.10Å | |
| N25 | C76 | sing | 1.37Å | 1.33Å | |
| N25 | H121 | sing | 0.97Å | 1.00Å | |
| C76 | N26 | sing | 1.33Å | 1.32Å | |
| C76 | N27 | doub | 1.33Å | 1.32Å | |
| N26 | H122 | sing | 0.97Å | 1.00Å | |
| N26 | H123 | sing | 0.97Å | 1.00Å | |
| N27 | H124 | sing | 0.97Å | 1.00Å | |
| N27 | H125 | sing | 0.97Å | 1.00Å | |
| N28 | C77 | sing | 1.47Å | 1.46Å | |
| N28 | C81 | sing | 1.47Å | 1.47Å | |
| C77 | C78 | sing | 1.51Å | 1.52Å | |
| C77 | C79 | sing | 1.54Å | 1.53Å | |
| C77 | H126 | sing | 1.09Å | 1.10Å | |
| C78 | O20 | doub | 1.21Å | 1.22Å | |
| C79 | C80 | sing | 1.55Å | 1.49Å | |
| C79 | H127 | sing | 1.09Å | 1.10Å | |
| C79 | H128 | sing | 1.09Å | 1.10Å | |
| C80 | C81 | sing | 1.55Å | 1.50Å | |
| C80 | H129 | sing | 1.09Å | 1.10Å | |
| C80 | H130 | sing | 1.09Å | 1.10Å | |
| C81 | H131 | sing | 1.09Å | 1.10Å | |
| C81 | H132 | sing | 1.09Å | 1.10Å | |
| N29 | C82 | sing | 1.47Å | 1.45Å | |
| N29 | H133 | sing | 0.97Å | 1.00Å | |
| C82 | C83 | sing | 1.51Å | 1.50Å | |
| C82 | C84 | sing | 1.53Å | 1.55Å | |
| C82 | H134 | sing | 1.09Å | 1.10Å | |
| C83 | O21 | doub | 1.21Å | 1.22Å | |
| C84 | C85 | sing | 1.53Å | 1.53Å | |
| C84 | C86 | sing | 1.53Å | 1.51Å | |
| C84 | H135 | sing | 1.09Å | 1.10Å | |
| C85 | C87 | sing | 1.53Å | 1.51Å | |
| C85 | H136 | sing | 1.09Å | 1.10Å | |
| C85 | H137 | sing | 1.09Å | 1.10Å | |
| C86 | H138 | sing | 1.09Å | 1.10Å | |
| C86 | H139 | sing | 1.09Å | 1.10Å | |
| C86 | H140 | sing | 1.09Å | 1.10Å | |
| C87 | H141 | sing | 1.09Å | 1.10Å | |
| C87 | H142 | sing | 1.09Å | 1.10Å | |
| C87 | H143 | sing | 1.09Å | 1.10Å | |
| N30 | C88 | sing | 1.47Å | 1.44Å | |
| N30 | H144 | sing | 0.97Å | 1.00Å | |
| C88 | C89 | sing | 1.51Å | 1.52Å | |
| C88 | C90 | sing | 1.53Å | 1.53Å | |
| C88 | H145 | sing | 1.09Å | 1.10Å | |
| C89 | O22 | doub | 1.21Å | 1.21Å | |
| C90 | C91 | sing | 1.53Å | 1.52Å | |
| C90 | H146 | sing | 1.09Å | 1.10Å | |
| C90 | H147 | sing | 1.09Å | 1.10Å | |
| C91 | C92 | sing | 1.53Å | 1.52Å | |
| C91 | H148 | sing | 1.09Å | 1.10Å | |
| C91 | H149 | sing | 1.09Å | 1.10Å | |
| C92 | N31 | sing | 1.47Å | 1.46Å | |
| C92 | H150 | sing | 1.09Å | 1.10Å | |
| C92 | H151 | sing | 1.09Å | 1.10Å | |
| N31 | C93 | sing | 1.37Å | 1.33Å | |
| N31 | H152 | sing | 0.97Å | 1.00Å | |
| C93 | N32 | sing | 1.33Å | 1.32Å | |
| C93 | N33 | doub | 1.33Å | 1.33Å | |
| N32 | H153 | sing | 0.97Å | 1.00Å | |
| N32 | H154 | sing | 0.97Å | 1.00Å | |
| N33 | H155 | sing | 0.97Å | 1.00Å | |
| N33 | H156 | sing | 0.97Å | 1.00Å | |
| N34 | C94 | sing | 1.47Å | 1.48Å | |
| N34 | H157 | sing | 0.97Å | 1.00Å | |
| C94 | C95 | sing | 1.51Å | 1.53Å | |
| C94 | C96 | sing | 1.53Å | 1.53Å | |
| C94 | H158 | sing | 1.09Å | 1.10Å | |
| C95 | O23 | doub | 1.21Å | 1.22Å | |
| C95 | O24 | sing | 1.34Å | 425.35Å | |
| C96 | C97 | sing | 1.53Å | 1.50Å | |
| C96 | C98 | sing | 1.53Å | 1.52Å | |
| C96 | H159 | sing | 1.09Å | 1.10Å | |
| C97 | H160 | sing | 1.09Å | 1.10Å | |
| C97 | H161 | sing | 1.09Å | 1.10Å | |
| C97 | H162 | sing | 1.09Å | 1.10Å | |
| C98 | H163 | sing | 1.09Å | 1.10Å | |
| C98 | H164 | sing | 1.09Å | 1.10Å | |
| C98 | H165 | sing | 1.09Å | 1.10Å | |
| O24 | H166 | sing | 0.97Å | 0.00Å | |
| C2 | N2 | sing | 1.35Å | 1.34Å | |
| C4 | N4 | sing | 1.35Å | 1.35Å | |
| C10 | N5 | sing | 1.35Å | 1.34Å | |
| C15 | N9 | sing | 1.35Å | 1.35Å | |
| C21 | N10 | sing | 1.35Å | 1.34Å | |
| C26 | N11 | sing | 1.35Å | 1.34Å | |
| C35 | N12 | sing | 1.35Å | 1.35Å | |
| C38 | N13 | sing | 1.35Å | 1.34Å | |
| C43 | N17 | sing | 1.35Å | 1.35Å | |
| C49 | N18 | sing | 1.35Å | 1.33Å | |
| C54 | N19 | sing | 1.35Å | 1.30Å | |
| C58 | N20 | sing | 1.35Å | 1.32Å | |
| C61 | N23 | sing | 1.35Å | 1.32Å | |
| C67 | N24 | sing | 1.35Å | 1.32Å | |
| C72 | N28 | sing | 1.35Å | 1.33Å | |
| C78 | N29 | sing | 1.35Å | 1.32Å | |
| C83 | N30 | sing | 1.35Å | 1.33Å | |
| C89 | N34 | sing | 1.35Å | 1.34Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | H1 | 109.5° | 111.0° |
| C1 | N1 | H2 | 109.5° | 111.0° |
| N1 | C1 | C2 | 111.6° | 109.5° |
| N1 | C1 | H3 | 108.9° | 109.4° |
| N1 | C1 | H4 | 108.9° | 109.5° |
| H1 | N1 | H2 | 109.5° | 111.0° |
| C2 | C1 | H3 | 108.9° | 109.5° |
| C2 | C1 | H4 | 108.9° | 109.5° |
| C1 | C2 | O1 | 120.8° | 120.0° |
| C1 | C2 | N2 | 115.8° | 120.0° |
| H3 | C1 | H4 | 109.5° | 109.5° |
| O1 | C2 | N2 | 123.4° | 120.0° |
| C3 | N2 | H5 | 119.0° | 120.0° |
| N2 | C3 | C4 | 109.0° | 109.5° |
| N2 | C3 | C5 | 111.1° | 109.5° |
| N2 | C3 | H6 | 109.6° | 109.5° |
| C3 | N2 | C2 | 122.0° | 120.0° |
| H5 | N2 | C2 | 119.0° | 120.0° |
| C4 | C3 | C5 | 109.8° | 109.5° |
| C4 | C3 | H6 | 108.7° | 109.5° |
| C3 | C4 | O2 | 120.4° | 119.9° |
| C3 | C4 | N4 | 118.7° | 120.0° |
| C5 | C3 | H6 | 108.6° | 109.4° |
| C3 | C5 | C6 | 115.4° | 109.5° |
| C3 | C5 | H7 | 108.0° | 109.5° |
| C3 | C5 | H8 | 108.0° | 109.5° |
| O2 | C4 | N4 | 120.9° | 120.0° |
| C6 | C5 | H7 | 108.0° | 109.5° |
| C6 | C5 | H8 | 108.0° | 109.4° |
| C5 | C6 | C7 | 113.2° | 109.5° |
| C5 | C6 | H9 | 108.5° | 109.5° |
| C5 | C6 | H10 | 108.5° | 109.4° |
| H7 | C5 | H8 | 109.5° | 109.4° |
| C7 | C6 | H9 | 108.5° | 109.5° |
| C7 | C6 | H10 | 108.5° | 109.5° |
| C6 | C7 | C8 | 113.3° | 109.5° |
| C6 | C7 | H11 | 108.5° | 109.5° |
| C6 | C7 | H12 | 108.5° | 109.5° |
| H9 | C6 | H10 | 109.5° | 109.4° |
| C8 | C7 | H11 | 108.5° | 109.5° |
| C8 | C7 | H12 | 108.5° | 109.5° |
| C7 | C8 | N3 | 112.3° | 109.5° |
| C7 | C8 | H13 | 108.8° | 109.5° |
| C7 | C8 | H14 | 108.8° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.4° |
| N3 | C8 | H13 | 108.7° | 109.5° |
| N3 | C8 | H14 | 108.7° | 109.4° |
| C8 | N3 | H15 | 109.5° | 109.5° |
| C8 | N3 | H16 | 109.5° | 109.5° |
| C8 | N3 | H17 | 109.5° | 109.5° |
| H13 | C8 | H14 | 109.5° | 109.5° |
| H15 | N3 | H16 | 109.5° | 109.5° |
| H15 | N3 | H17 | 109.5° | 109.4° |
| H16 | N3 | H17 | 109.5° | 109.5° |
| C9 | N4 | C13 | 112.6° | 108.7° |
| N4 | C9 | C10 | 110.1° | 109.9° |
| N4 | C9 | C11 | 102.9° | 107.3° |
| N4 | C9 | H18 | 111.5° | 109.9° |
| C9 | N4 | C4 | 121.4° | 125.6° |
| N4 | C13 | C12 | 103.0° | 104.7° |
| N4 | C13 | H23 | 111.0° | 110.4° |
| N4 | C13 | H24 | 111.0° | 110.4° |
| C13 | N4 | C4 | 125.9° | 125.6° |
| C10 | C9 | C11 | 111.1° | 109.9° |
| C10 | C9 | H18 | 110.6° | 109.9° |
| C9 | C10 | O3 | 119.9° | 120.0° |
| C9 | C10 | N5 | 116.5° | 120.0° |
| C11 | C9 | H18 | 110.5° | 110.0° |
| C9 | C11 | C12 | 103.4° | 102.9° |
| C9 | C11 | H19 | 110.9° | 110.7° |
| C9 | C11 | H20 | 111.0° | 110.7° |
| O3 | C10 | N5 | 123.5° | 120.1° |
| C12 | C11 | H19 | 110.9° | 110.7° |
| C12 | C11 | H20 | 111.0° | 110.7° |
| C11 | C12 | C13 | 104.2° | 101.5° |
| C11 | C12 | H21 | 110.8° | 111.0° |
| C11 | C12 | H22 | 110.8° | 111.0° |
| H19 | C11 | H20 | 109.5° | 110.8° |
| C13 | C12 | H21 | 110.8° | 111.2° |
| C13 | C12 | H22 | 110.8° | 110.9° |
| C12 | C13 | H23 | 111.1° | 110.5° |
| C12 | C13 | H24 | 111.1° | 110.3° |
| H21 | C12 | H22 | 109.4° | 110.9° |
| H23 | C13 | H24 | 109.5° | 110.4° |
| C14 | N5 | H25 | 119.4° | 120.0° |
| N5 | C14 | C15 | 108.3° | 109.5° |
| N5 | C14 | C16 | 111.2° | 109.5° |
| N5 | C14 | H26 | 109.6° | 109.4° |
| C14 | N5 | C10 | 121.1° | 120.0° |
| H25 | N5 | C10 | 119.4° | 120.1° |
| C15 | C14 | C16 | 110.5° | 109.5° |
| C15 | C14 | H26 | 108.6° | 109.5° |
| C14 | C15 | O4 | 120.1° | 120.0° |
| C14 | C15 | N9 | 118.9° | 120.0° |
| C16 | C14 | H26 | 108.6° | 109.4° |
| C14 | C16 | C17 | 114.2° | 109.5° |
| C14 | C16 | H27 | 108.3° | 109.5° |
| C14 | C16 | H28 | 108.3° | 109.4° |
| O4 | C15 | N9 | 121.0° | 120.0° |
| C17 | C16 | H27 | 108.2° | 109.5° |
| C17 | C16 | H28 | 108.2° | 109.5° |
| C16 | C17 | C18 | 112.8° | 109.5° |
| C16 | C17 | H29 | 108.6° | 109.5° |
| C16 | C17 | H30 | 108.6° | 109.5° |
| H27 | C16 | H28 | 109.5° | 109.4° |
| C18 | C17 | H29 | 108.7° | 109.5° |
| C18 | C17 | H30 | 108.6° | 109.4° |
| C17 | C18 | N6 | 112.8° | 109.5° |
| C17 | C18 | H31 | 108.6° | 109.5° |
| C17 | C18 | H32 | 108.6° | 109.5° |
| H29 | C17 | H30 | 109.5° | 109.5° |
| N6 | C18 | H31 | 108.6° | 109.5° |
| N6 | C18 | H32 | 108.6° | 109.4° |
| C18 | N6 | C19 | 124.8° | 120.0° |
| C18 | N6 | H33 | 117.6° | 120.0° |
| H31 | C18 | H32 | 109.5° | 109.5° |
| C19 | N6 | H33 | 117.6° | 120.0° |
| N6 | C19 | N7 | 119.9° | 120.0° |
| N6 | C19 | N8 | 120.3° | 120.0° |
| N7 | C19 | N8 | 119.8° | 120.0° |
| C19 | N7 | H34 | 120.0° | 120.0° |
| C19 | N7 | H35 | 120.0° | 120.0° |
| C19 | N8 | H36 | 120.0° | 120.1° |
| C19 | N8 | H37 | 120.0° | 120.0° |
| H34 | N7 | H35 | 120.0° | 120.0° |
| H36 | N8 | H37 | 120.0° | 120.0° |
| C20 | N9 | C24 | 112.7° | 108.7° |
| N9 | C20 | C21 | 112.2° | 109.9° |
| N9 | C20 | C22 | 102.8° | 107.2° |
| N9 | C20 | H38 | 110.7° | 109.9° |
| C20 | N9 | C15 | 121.7° | 125.6° |
| N9 | C24 | C23 | 103.4° | 104.7° |
| N9 | C24 | H43 | 110.9° | 110.4° |
| N9 | C24 | H44 | 111.0° | 110.4° |
| C24 | N9 | C15 | 125.7° | 125.6° |
| C21 | C20 | C22 | 111.4° | 109.9° |
| C21 | C20 | H38 | 109.8° | 109.9° |
| C20 | C21 | O5 | 120.7° | 120.0° |
| C20 | C21 | N10 | 115.9° | 120.0° |
| C22 | C20 | H38 | 109.7° | 110.0° |
| C20 | C22 | C23 | 103.7° | 103.0° |
| C20 | C22 | H39 | 110.9° | 110.7° |
| C20 | C22 | H40 | 110.9° | 110.7° |
| O5 | C21 | N10 | 123.4° | 120.0° |
| C23 | C22 | H39 | 110.9° | 110.7° |
| C23 | C22 | H40 | 110.9° | 110.7° |
| C22 | C23 | C24 | 104.8° | 101.5° |
| C22 | C23 | H41 | 110.6° | 111.0° |
| C22 | C23 | H42 | 110.6° | 111.1° |
| H39 | C22 | H40 | 109.5° | 110.8° |
| C24 | C23 | H41 | 110.6° | 111.1° |
| C24 | C23 | H42 | 110.6° | 110.9° |
| C23 | C24 | H43 | 111.0° | 110.5° |
| C23 | C24 | H44 | 111.0° | 110.4° |
| H41 | C23 | H42 | 109.5° | 110.9° |
| H43 | C24 | H44 | 109.5° | 110.3° |
| C25 | N10 | H45 | 119.0° | 120.0° |
| N10 | C25 | C26 | 109.8° | 109.5° |
| N10 | C25 | C27 | 110.3° | 109.5° |
| N10 | C25 | H46 | 109.6° | 109.5° |
| C25 | N10 | C21 | 122.0° | 120.0° |
| H45 | N10 | C21 | 119.0° | 120.0° |
| C26 | C25 | C27 | 110.0° | 109.5° |
| C26 | C25 | H46 | 108.6° | 109.5° |
| C25 | C26 | O6 | 120.1° | 120.0° |
| C25 | C26 | N11 | 116.2° | 120.0° |
| C27 | C25 | H46 | 108.5° | 109.5° |
| C25 | C27 | C28 | 113.8° | 109.5° |
| C25 | C27 | H47 | 108.3° | 109.5° |
| C25 | C27 | H48 | 108.4° | 109.5° |
| O6 | C26 | N11 | 123.7° | 120.0° |
| C28 | C27 | H47 | 108.4° | 109.5° |
| C28 | C27 | H48 | 108.4° | 109.4° |
| C27 | C28 | C29 | 120.9° | 119.9° |
| C27 | C28 | C30 | 121.1° | 119.9° |
| H47 | C27 | H48 | 109.5° | 109.5° |
| C29 | C28 | C30 | 118.0° | 120.1° |
| C28 | C29 | C31 | 121.5° | 120.0° |
| C28 | C29 | H49 | 119.3° | 120.0° |
| C28 | C30 | C32 | 121.3° | 120.0° |
| C28 | C30 | H50 | 119.4° | 120.0° |
| C31 | C29 | H49 | 119.3° | 120.0° |
| C29 | C31 | C33 | 119.8° | 119.9° |
| C29 | C31 | H51 | 120.1° | 120.1° |
| C32 | C30 | H50 | 119.3° | 120.0° |
| C30 | C32 | C33 | 119.8° | 119.9° |
| C30 | C32 | H52 | 120.1° | 120.0° |
| C33 | C31 | H51 | 120.1° | 120.0° |
| C31 | C33 | C32 | 119.6° | 119.9° |
| C31 | C33 | O7 | 119.4° | 120.1° |
| C33 | C32 | H52 | 120.1° | 120.1° |
| C32 | C33 | O7 | 121.0° | 120.0° |
| C33 | O7 | H53 | 109.5° | 114.0° |
| C34 | N11 | H54 | 119.1° | 120.0° |
| N11 | C34 | C35 | 109.1° | 109.5° |
| N11 | C34 | C36 | 111.0° | 109.5° |
| N11 | C34 | H55 | 109.0° | 109.5° |
| C34 | N11 | C26 | 121.7° | 120.0° |
| H54 | N11 | C26 | 119.1° | 120.0° |
| C35 | C34 | C36 | 111.1° | 109.5° |
| C35 | C34 | H55 | 108.1° | 109.5° |
| C34 | C35 | O8 | 120.5° | 120.0° |
| C34 | C35 | N12 | 119.3° | 120.0° |
| C36 | C34 | H55 | 108.4° | 109.5° |
| C34 | C36 | O9 | 110.7° | 109.5° |
| C34 | C36 | H56 | 109.2° | 109.4° |
| C34 | C36 | H57 | 109.2° | 109.5° |
| O8 | C35 | N12 | 120.2° | 120.0° |
| O9 | C36 | H56 | 109.2° | 109.5° |
| O9 | C36 | H57 | 109.2° | 109.5° |
| C36 | O9 | H58 | 109.5° | 114.0° |
| H56 | C36 | H57 | 109.4° | 109.5° |
| C37 | N12 | C41 | 112.9° | 108.7° |
| N12 | C37 | C38 | 111.3° | 109.9° |
| N12 | C37 | C39 | 103.5° | 107.2° |
| N12 | C37 | H59 | 110.7° | 109.9° |
| C37 | N12 | C35 | 121.0° | 125.6° |
| N12 | C41 | C40 | 102.5° | 104.7° |
| N12 | C41 | H64 | 111.2° | 110.4° |
| N12 | C41 | H65 | 111.2° | 110.3° |
| C41 | N12 | C35 | 126.2° | 125.7° |
| C38 | C37 | C39 | 111.7° | 109.9° |
| C38 | C37 | H59 | 109.8° | 109.9° |
| C37 | C38 | O10 | 120.3° | 120.0° |
| C37 | C38 | N13 | 115.9° | 120.0° |
| C39 | C37 | H59 | 109.7° | 110.0° |
| C37 | C39 | C40 | 104.0° | 103.0° |
| C37 | C39 | H60 | 110.8° | 110.7° |
| C37 | C39 | H61 | 110.8° | 110.7° |
| O10 | C38 | N13 | 123.8° | 120.0° |
| C40 | C39 | H60 | 110.8° | 110.7° |
| C40 | C39 | H61 | 110.8° | 110.7° |
| C39 | C40 | C41 | 104.7° | 101.5° |
| C39 | C40 | H62 | 110.6° | 111.0° |
| C39 | C40 | H63 | 110.6° | 111.0° |
| H60 | C39 | H61 | 109.5° | 110.8° |
| C41 | C40 | H62 | 110.6° | 111.2° |
| C41 | C40 | H63 | 110.6° | 110.9° |
| C40 | C41 | H64 | 111.2° | 110.5° |
| C40 | C41 | H65 | 111.2° | 110.3° |
| H62 | C40 | H63 | 109.5° | 110.9° |
| H64 | C41 | H65 | 109.4° | 110.4° |
| C42 | N13 | H66 | 118.6° | 120.0° |
| N13 | C42 | C43 | 108.0° | 109.5° |
| N13 | C42 | C44 | 109.8° | 109.4° |
| N13 | C42 | H67 | 109.4° | 109.5° |
| C42 | N13 | C38 | 122.9° | 120.0° |
| H66 | N13 | C38 | 118.5° | 120.0° |
| C43 | C42 | C44 | 112.8° | 109.5° |
| C43 | C42 | H67 | 108.4° | 109.5° |
| C42 | C43 | O11 | 120.3° | 120.0° |
| C42 | C43 | N17 | 119.6° | 120.0° |
| C44 | C42 | H67 | 108.4° | 109.4° |
| C42 | C44 | C45 | 114.2° | 109.5° |
| C42 | C44 | H68 | 108.3° | 109.5° |
| C42 | C44 | H69 | 108.3° | 109.5° |
| O11 | C43 | N17 | 120.1° | 120.0° |
| C45 | C44 | H68 | 108.3° | 109.4° |
| C45 | C44 | H69 | 108.3° | 109.5° |
| C44 | C45 | C46 | 113.5° | 109.5° |
| C44 | C45 | H70 | 108.5° | 109.5° |
| C44 | C45 | H71 | 108.5° | 109.5° |
| H68 | C44 | H69 | 109.5° | 109.4° |
| C46 | C45 | H70 | 108.4° | 109.4° |
| C46 | C45 | H71 | 108.4° | 109.4° |
| C45 | C46 | N14 | 111.7° | 109.5° |
| C45 | C46 | H72 | 108.9° | 109.4° |
| C45 | C46 | H73 | 108.9° | 109.5° |
| H70 | C45 | H71 | 109.5° | 109.5° |
| N14 | C46 | H72 | 108.9° | 109.4° |
| N14 | C46 | H73 | 108.9° | 109.5° |
| C46 | N14 | C47 | 124.9° | 120.0° |
| C46 | N14 | H74 | 117.5° | 120.0° |
| H72 | C46 | H73 | 109.5° | 109.5° |
| C47 | N14 | H74 | 117.5° | 120.0° |
| N14 | C47 | N15 | 120.3° | 120.0° |
| N14 | C47 | N16 | 119.8° | 120.0° |
| N15 | C47 | N16 | 119.9° | 120.0° |
| C47 | N15 | H75 | 120.0° | 120.0° |
| C47 | N15 | H76 | 120.0° | 120.0° |
| C47 | N16 | H77 | 120.0° | 120.0° |
| C47 | N16 | H78 | 120.0° | 120.0° |
| H75 | N15 | H76 | 120.0° | 120.0° |
| H77 | N16 | H78 | 120.0° | 120.0° |
| C48 | N17 | C52 | 112.4° | 108.7° |
| N17 | C48 | C49 | 112.7° | 109.9° |
| N17 | C48 | C50 | 104.1° | 107.3° |
| N17 | C48 | H79 | 111.0° | 109.9° |
| C48 | N17 | C43 | 121.6° | 125.7° |
| N17 | C52 | C51 | 102.9° | 104.7° |
| N17 | C52 | H84 | 111.0° | 110.4° |
| N17 | C52 | H85 | 111.1° | 110.4° |
| C52 | N17 | C43 | 125.9° | 125.6° |
| C49 | C48 | C50 | 108.7° | 109.9° |
| C49 | C48 | H79 | 110.1° | 109.9° |
| C48 | C49 | O12 | 120.0° | 120.0° |
| C48 | C49 | N18 | 115.1° | 120.0° |
| C50 | C48 | H79 | 110.0° | 110.0° |
| C48 | C50 | C51 | 104.6° | 103.0° |
| C48 | C50 | H80 | 110.7° | 110.8° |
| C48 | C50 | H81 | 110.7° | 110.8° |
| O12 | C49 | N18 | 124.5° | 119.9° |
| C51 | C50 | H80 | 110.6° | 110.7° |
| C51 | C50 | H81 | 110.7° | 110.7° |
| C50 | C51 | C52 | 105.4° | 101.5° |
| C50 | C51 | H82 | 110.5° | 111.0° |
| C50 | C51 | H83 | 110.5° | 111.0° |
| H80 | C50 | H81 | 109.5° | 110.8° |
| C52 | C51 | H82 | 110.5° | 111.2° |
| C52 | C51 | H83 | 110.5° | 110.9° |
| C51 | C52 | H84 | 111.1° | 110.5° |
| C51 | C52 | H85 | 111.1° | 110.3° |
| H82 | C51 | H83 | 109.4° | 110.9° |
| H84 | C52 | H85 | 109.5° | 110.5° |
| C53 | N18 | H86 | 119.1° | 120.0° |
| N18 | C53 | C54 | 111.3° | 109.5° |
| N18 | C53 | C55 | 109.8° | 109.5° |
| N18 | C53 | H87 | 110.6° | 109.4° |
| C53 | N18 | C49 | 121.8° | 120.1° |
| H86 | N18 | C49 | 119.1° | 119.9° |
| C54 | C53 | C55 | 105.4° | 109.5° |
| C54 | C53 | H87 | 110.0° | 109.4° |
| C53 | C54 | O13 | 120.7° | 120.0° |
| C53 | C54 | N19 | 116.7° | 120.0° |
| C55 | C53 | H87 | 109.5° | 109.5° |
| C53 | C55 | O14 | 107.8° | 109.5° |
| C53 | C55 | C56 | 110.5° | 109.5° |
| C53 | C55 | H88 | 109.3° | 109.5° |
| O13 | C54 | N19 | 122.6° | 120.0° |
| O14 | C55 | C56 | 108.6° | 109.5° |
| O14 | C55 | H88 | 110.9° | 109.4° |
| C55 | O14 | H89 | 109.5° | 114.0° |
| C56 | C55 | H88 | 109.7° | 109.5° |
| C55 | C56 | H90 | 109.5° | 109.5° |
| C55 | C56 | H91 | 109.5° | 109.5° |
| C55 | C56 | H92 | 109.4° | 109.4° |
| H90 | C56 | H91 | 109.5° | 109.5° |
| H90 | C56 | H92 | 109.5° | 109.5° |
| H91 | C56 | H92 | 109.5° | 109.5° |
| C57 | N19 | H93 | 118.6° | 120.0° |
| N19 | C57 | C58 | 117.0° | 109.5° |
| N19 | C57 | C59 | 107.0° | 109.5° |
| N19 | C57 | H94 | 107.3° | 109.5° |
| C57 | N19 | C54 | 122.7° | 120.0° |
| H93 | N19 | C54 | 118.6° | 120.0° |
| C58 | C57 | C59 | 111.8° | 109.4° |
| C58 | C57 | H94 | 106.5° | 109.5° |
| C57 | C58 | O15 | 119.4° | 120.0° |
| C57 | C58 | N20 | 117.7° | 120.0° |
| C59 | C57 | H94 | 106.8° | 109.4° |
| C57 | C59 | O16 | 107.3° | 109.4° |
| C57 | C59 | H95 | 110.0° | 109.5° |
| C57 | C59 | H96 | 110.0° | 109.4° |
| O15 | C58 | N20 | 122.1° | 119.9° |
| O16 | C59 | H95 | 110.0° | 109.5° |
| O16 | C59 | H96 | 110.0° | 109.5° |
| C59 | O16 | H97 | 109.5° | 114.0° |
| H95 | C59 | H96 | 109.4° | 109.5° |
| C60 | N20 | H98 | 119.2° | 120.0° |
| N20 | C60 | C61 | 111.1° | 109.5° |
| N20 | C60 | C62 | 109.6° | 109.5° |
| N20 | C60 | H99 | 109.6° | 109.5° |
| C60 | N20 | C58 | 121.6° | 120.1° |
| H98 | N20 | C58 | 119.2° | 120.0° |
| C61 | C60 | C62 | 108.9° | 109.5° |
| C61 | C60 | H99 | 108.8° | 109.5° |
| C60 | C61 | O17 | 120.2° | 120.0° |
| C60 | C61 | N23 | 117.6° | 120.0° |
| C62 | C60 | H99 | 108.8° | 109.4° |
| C60 | C62 | C63 | 113.2° | 109.5° |
| C60 | C62 | H100 | 108.5° | 109.4° |
| C60 | C62 | H101 | 108.5° | 109.5° |
| O17 | C61 | N23 | 122.2° | 120.0° |
| C63 | C62 | H100 | 108.5° | 109.5° |
| C63 | C62 | H101 | 108.5° | 109.5° |
| C62 | C63 | N21 | 122.8° | 126.0° |
| C62 | C63 | C64 | 131.0° | 126.0° |
| H100 | C62 | H101 | 109.4° | 109.5° |
| N21 | C63 | C64 | 106.2° | 108.0° |
| C63 | N21 | C65 | 109.3° | 109.2° |
| C63 | N21 | H102 | 125.3° | 125.4° |
| C63 | C64 | N22 | 107.1° | 106.8° |
| C63 | C64 | H103 | 126.4° | 126.6° |
| C65 | N21 | H102 | 125.3° | 125.4° |
| N21 | C65 | N22 | 108.4° | 108.7° |
| N21 | C65 | H104 | 125.8° | 125.6° |
| N22 | C64 | H103 | 126.5° | 126.6° |
| C64 | N22 | C65 | 109.0° | 107.2° |
| C64 | N22 | H105 | 125.5° | 126.4° |
| N22 | C65 | H104 | 125.8° | 125.7° |
| C65 | N22 | H105 | 125.5° | 126.4° |
| C66 | N23 | C70 | 111.6° | 108.7° |
| N23 | C66 | C67 | 113.5° | 109.8° |
| N23 | C66 | C68 | 102.6° | 107.3° |
| N23 | C66 | H106 | 110.8° | 109.9° |
| C66 | N23 | C61 | 121.0° | 125.6° |
| N23 | C70 | C69 | 103.8° | 104.7° |
| N23 | C70 | H111 | 110.9° | 110.4° |
| N23 | C70 | H112 | 110.9° | 110.4° |
| C70 | N23 | C61 | 125.9° | 125.7° |
| C67 | C66 | C68 | 109.9° | 109.9° |
| C67 | C66 | H106 | 109.9° | 109.9° |
| C66 | C67 | O18 | 118.3° | 120.1° |
| C66 | C67 | N24 | 118.9° | 120.0° |
| C68 | C66 | H106 | 109.9° | 110.0° |
| C66 | C68 | C69 | 104.4° | 103.0° |
| C66 | C68 | H107 | 110.7° | 110.7° |
| C66 | C68 | H108 | 110.7° | 110.7° |
| O18 | C67 | N24 | 122.8° | 120.0° |
| C69 | C68 | H107 | 110.7° | 110.7° |
| C69 | C68 | H108 | 110.7° | 110.7° |
| C68 | C69 | C70 | 107.8° | 101.5° |
| C68 | C69 | H109 | 109.9° | 111.0° |
| C68 | C69 | H110 | 109.9° | 111.0° |
| H107 | C68 | H108 | 109.5° | 110.8° |
| C70 | C69 | H109 | 109.9° | 111.1° |
| C70 | C69 | H110 | 109.9° | 110.9° |
| C69 | C70 | H111 | 110.9° | 110.4° |
| C69 | C70 | H112 | 110.9° | 110.3° |
| H109 | C69 | H110 | 109.5° | 110.9° |
| H111 | C70 | H112 | 109.5° | 110.5° |
| C71 | N24 | H113 | 119.9° | 120.0° |
| N24 | C71 | C72 | 106.9° | 109.5° |
| N24 | C71 | C73 | 110.5° | 109.5° |
| N24 | C71 | H114 | 110.4° | 109.5° |
| C71 | N24 | C67 | 120.1° | 120.0° |
| H113 | N24 | C67 | 119.9° | 120.1° |
| C72 | C71 | C73 | 109.8° | 109.5° |
| C72 | C71 | H114 | 109.5° | 109.5° |
| C71 | C72 | O19 | 119.7° | 120.0° |
| C71 | C72 | N28 | 117.8° | 120.0° |
| C73 | C71 | H114 | 109.6° | 109.5° |
| C71 | C73 | C74 | 113.9° | 109.5° |
| C71 | C73 | H115 | 108.3° | 109.5° |
| C71 | C73 | H116 | 108.3° | 109.5° |
| O19 | C72 | N28 | 122.5° | 120.0° |
| C74 | C73 | H115 | 108.3° | 109.5° |
| C74 | C73 | H116 | 108.4° | 109.5° |
| C73 | C74 | C75 | 110.3° | 109.5° |
| C73 | C74 | H117 | 109.3° | 109.5° |
| C73 | C74 | H118 | 109.3° | 109.5° |
| H115 | C73 | H116 | 109.5° | 109.5° |
| C75 | C74 | H117 | 109.3° | 109.5° |
| C75 | C74 | H118 | 109.3° | 109.5° |
| C74 | C75 | N25 | 109.8° | 109.5° |
| C74 | C75 | H119 | 109.4° | 109.5° |
| C74 | C75 | H120 | 109.4° | 109.5° |
| H117 | C74 | H118 | 109.5° | 109.5° |
| N25 | C75 | H119 | 109.4° | 109.5° |
| N25 | C75 | H120 | 109.4° | 109.5° |
| C75 | N25 | C76 | 125.8° | 120.0° |
| C75 | N25 | H121 | 117.1° | 120.0° |
| H119 | C75 | H120 | 109.5° | 109.5° |
| C76 | N25 | H121 | 117.1° | 120.0° |
| N25 | C76 | N26 | 119.1° | 120.0° |
| N25 | C76 | N27 | 121.6° | 120.0° |
| N26 | C76 | N27 | 119.3° | 120.0° |
| C76 | N26 | H122 | 120.0° | 119.9° |
| C76 | N26 | H123 | 120.0° | 120.0° |
| C76 | N27 | H124 | 120.0° | 119.9° |
| C76 | N27 | H125 | 120.0° | 120.0° |
| H122 | N26 | H123 | 120.0° | 120.1° |
| H124 | N27 | H125 | 120.0° | 120.1° |
| C77 | N28 | C81 | 112.3° | 108.7° |
| N28 | C77 | C78 | 110.6° | 109.9° |
| N28 | C77 | C79 | 103.4° | 107.3° |
| N28 | C77 | H126 | 111.2° | 109.9° |
| C77 | N28 | C72 | 115.1° | 125.7° |
| N28 | C81 | C80 | 102.9° | 104.7° |
| N28 | C81 | H131 | 111.1° | 110.3° |
| N28 | C81 | H132 | 111.1° | 110.4° |
| C81 | N28 | C72 | 132.0° | 125.6° |
| C78 | C77 | C79 | 111.0° | 109.9° |
| C78 | C77 | H126 | 110.3° | 109.8° |
| C77 | C78 | O20 | 118.6° | 120.0° |
| C77 | C78 | N29 | 118.0° | 120.0° |
| C79 | C77 | H126 | 110.1° | 110.0° |
| C77 | C79 | C80 | 105.1° | 102.9° |
| C77 | C79 | H127 | 110.6° | 110.7° |
| C77 | C79 | H128 | 110.6° | 110.7° |
| O20 | C78 | N29 | 123.4° | 120.0° |
| C80 | C79 | H127 | 110.6° | 110.7° |
| C80 | C79 | H128 | 110.6° | 110.7° |
| C79 | C80 | C81 | 105.3° | 101.5° |
| C79 | C80 | H129 | 110.5° | 111.1° |
| C79 | C80 | H130 | 110.5° | 111.1° |
| H127 | C79 | H128 | 109.5° | 110.8° |
| C81 | C80 | H129 | 110.5° | 111.1° |
| C81 | C80 | H130 | 110.5° | 110.9° |
| C80 | C81 | H131 | 111.1° | 110.4° |
| C80 | C81 | H132 | 111.1° | 110.4° |
| H129 | C80 | H130 | 109.4° | 110.8° |
| H131 | C81 | H132 | 109.5° | 110.5° |
| C82 | N29 | H133 | 119.7° | 120.0° |
| N29 | C82 | C83 | 108.2° | 109.4° |
| N29 | C82 | C84 | 110.8° | 109.4° |
| N29 | C82 | H134 | 110.6° | 109.4° |
| C82 | N29 | C78 | 120.7° | 120.0° |
| H133 | N29 | C78 | 119.6° | 120.0° |
| C83 | C82 | C84 | 108.2° | 109.5° |
| C83 | C82 | H134 | 109.9° | 109.5° |
| C82 | C83 | O21 | 120.0° | 120.0° |
| C82 | C83 | N30 | 116.3° | 120.0° |
| C84 | C82 | H134 | 109.2° | 109.5° |
| C82 | C84 | C85 | 110.5° | 109.4° |
| C82 | C84 | C86 | 111.2° | 109.5° |
| C82 | C84 | H135 | 108.1° | 109.5° |
| O21 | C83 | N30 | 123.7° | 120.0° |
| C85 | C84 | C86 | 110.1° | 109.5° |
| C85 | C84 | H135 | 108.3° | 109.4° |
| C84 | C85 | C87 | 113.5° | 109.5° |
| C84 | C85 | H136 | 108.5° | 109.5° |
| C84 | C85 | H137 | 108.5° | 109.4° |
| C86 | C84 | H135 | 108.5° | 109.5° |
| C84 | C86 | H138 | 109.5° | 109.5° |
| C84 | C86 | H139 | 109.5° | 109.5° |
| C84 | C86 | H140 | 109.5° | 109.4° |
| C87 | C85 | H136 | 108.5° | 109.5° |
| C87 | C85 | H137 | 108.5° | 109.5° |
| C85 | C87 | H141 | 109.5° | 109.5° |
| C85 | C87 | H142 | 109.5° | 109.5° |
| C85 | C87 | H143 | 109.5° | 109.5° |
| H136 | C85 | H137 | 109.5° | 109.5° |
| H138 | C86 | H139 | 109.4° | 109.5° |
| H138 | C86 | H140 | 109.5° | 109.5° |
| H139 | C86 | H140 | 109.4° | 109.5° |
| H141 | C87 | H142 | 109.4° | 109.5° |
| H141 | C87 | H143 | 109.5° | 109.5° |
| H142 | C87 | H143 | 109.5° | 109.4° |
| C88 | N30 | H144 | 119.4° | 120.0° |
| N30 | C88 | C89 | 107.2° | 109.5° |
| N30 | C88 | C90 | 108.5° | 109.5° |
| N30 | C88 | H145 | 109.3° | 109.4° |
| C88 | N30 | C83 | 121.2° | 120.0° |
| H144 | N30 | C83 | 119.4° | 120.0° |
| C89 | C88 | C90 | 115.1° | 109.5° |
| C89 | C88 | H145 | 108.3° | 109.5° |
| C88 | C89 | O22 | 119.3° | 120.0° |
| C88 | C89 | N34 | 118.3° | 120.0° |
| C90 | C88 | H145 | 108.3° | 109.5° |
| C88 | C90 | C91 | 112.5° | 109.4° |
| C88 | C90 | H146 | 108.7° | 109.4° |
| C88 | C90 | H147 | 108.7° | 109.5° |
| O22 | C89 | N34 | 122.4° | 120.0° |
| C91 | C90 | H146 | 108.7° | 109.5° |
| C91 | C90 | H147 | 108.7° | 109.5° |
| C90 | C91 | C92 | 112.2° | 109.4° |
| C90 | C91 | H148 | 108.8° | 109.5° |
| C90 | C91 | H149 | 108.8° | 109.5° |
| H146 | C90 | H147 | 109.4° | 109.5° |
| C92 | C91 | H148 | 108.8° | 109.4° |
| C92 | C91 | H149 | 108.8° | 109.5° |
| C91 | C92 | N31 | 111.6° | 109.4° |
| C91 | C92 | H150 | 108.9° | 109.5° |
| C91 | C92 | H151 | 108.9° | 109.5° |
| H148 | C91 | H149 | 109.5° | 109.5° |
| N31 | C92 | H150 | 109.0° | 109.5° |
| N31 | C92 | H151 | 108.9° | 109.5° |
| C92 | N31 | C93 | 124.9° | 120.0° |
| C92 | N31 | H152 | 117.6° | 120.0° |
| H150 | C92 | H151 | 109.5° | 109.5° |
| C93 | N31 | H152 | 117.6° | 120.0° |
| N31 | C93 | N32 | 119.8° | 120.0° |
| N31 | C93 | N33 | 121.3° | 120.0° |
| N32 | C93 | N33 | 118.9° | 120.0° |
| C93 | N32 | H153 | 120.0° | 120.0° |
| C93 | N32 | H154 | 120.0° | 120.0° |
| C93 | N33 | H155 | 120.0° | 120.0° |
| C93 | N33 | H156 | 120.0° | 120.0° |
| H153 | N32 | H154 | 120.0° | 120.0° |
| H155 | N33 | H156 | 120.0° | 120.0° |
| C94 | N34 | H157 | 118.8° | 120.0° |
| N34 | C94 | C95 | 111.2° | 109.5° |
| N34 | C94 | C96 | 114.1° | 109.4° |
| N34 | C94 | H158 | 109.1° | 109.5° |
| C94 | N34 | C89 | 122.4° | 120.0° |
| H157 | N34 | C89 | 118.8° | 120.0° |
| C95 | C94 | C96 | 105.3° | 109.5° |
| C95 | C94 | H158 | 108.5° | 109.5° |
| C94 | C95 | O23 | 121.0° | 120.0° |
| C94 | C95 | O24 | 97.2° | 120.0° |
| C96 | C94 | H158 | 108.5° | 109.5° |
| C94 | C96 | C97 | 111.5° | 109.4° |
| C94 | C96 | C98 | 110.4° | 109.5° |
| C94 | C96 | H159 | 108.1° | 109.5° |
| O23 | C95 | O24 | 58.9° | 120.0° |
| C95 | O24 | H166 | 90.0° | 117.0° |
| C97 | C96 | C98 | 110.1° | 109.5° |
| C97 | C96 | H159 | 108.4° | 109.5° |
| C96 | C97 | H160 | 109.5° | 109.5° |
| C96 | C97 | H161 | 109.5° | 109.5° |
| C96 | C97 | H162 | 109.5° | 109.5° |
| C98 | C96 | H159 | 108.2° | 109.5° |
| C96 | C98 | H163 | 109.5° | 109.5° |
| C96 | C98 | H164 | 109.4° | 109.5° |
| C96 | C98 | H165 | 109.5° | 109.5° |
| H160 | C97 | H161 | 109.5° | 109.5° |
| H160 | C97 | H162 | 109.5° | 109.5° |
| H161 | C97 | H162 | 109.5° | 109.4° |
| H163 | C98 | H164 | 109.4° | 109.5° |
| H163 | C98 | H165 | 109.4° | 109.5° |
| H164 | C98 | H165 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | H1 | H2 | 120.0° | 124.0° |
| N1 | C1 | C2 | H3 | 120.3° | 119.9° |
| N1 | C1 | C2 | H4 | 120.3° | 120.1° |
| N1 | C1 | H3 | H4 | 119.0° | 120.0° |
| N1 | C1 | C2 | O1 | 6.9° | 0.0° |
| N1 | C1 | C2 | N2 | 172.6° | 180.0° |
| H1 | N1 | C1 | C2 | 180.0° | 56.1° |
| H1 | N1 | C1 | H3 | 59.7° | 176.0° |
| H1 | N1 | C1 | H4 | 59.7° | 64.0° |
| H2 | N1 | C1 | C2 | 60.0° | 180.0° |
| H2 | N1 | C1 | H3 | 60.3° | 60.0° |
| H2 | N1 | C1 | H4 | 179.7° | 60.0° |
| C2 | C1 | H3 | H4 | 119.0° | 120.1° |
| C1 | C2 | O1 | N2 | 179.5° | 180.0° |
| C1 | C2 | N2 | C3 | 178.1° | 180.0° |
| C1 | C2 | N2 | H5 | 1.9° | 0.0° |
| H3 | C1 | C2 | O1 | 127.2° | 120.0° |
| H3 | C1 | C2 | N2 | 52.3° | 60.1° |
| H4 | C1 | C2 | O1 | 113.4° | 120.0° |
| H4 | C1 | C2 | N2 | 67.1° | 59.9° |
| O1 | C2 | N2 | C3 | 1.4° | 0.0° |
| O1 | C2 | N2 | H5 | 178.6° | 180.0° |
| C3 | N2 | H5 | C2 | 180.0° | 180.0° |
| N2 | C3 | C4 | C5 | 121.9° | 120.0° |
| N2 | C3 | C4 | H6 | 119.4° | 120.0° |
| N2 | C3 | C5 | H6 | 120.6° | 120.0° |
| N2 | C3 | C4 | O2 | 38.2° | 20.0° |
| N2 | C3 | C5 | C6 | 53.5° | 65.0° |
| N2 | C3 | C5 | H7 | 67.4° | 55.1° |
| N2 | C3 | C5 | H8 | 174.3° | 175.0° |
| N2 | C3 | C4 | N4 | 143.3° | 160.0° |
| H5 | N2 | C3 | C4 | 53.4° | 120.0° |
| H5 | N2 | C3 | C5 | 67.8° | 120.0° |
| H5 | N2 | C3 | H6 | 172.2° | 0.0° |
| C4 | C3 | C5 | H6 | 118.7° | 120.0° |
| C3 | C4 | O2 | N4 | 178.5° | 180.0° |
| C4 | C3 | C5 | C6 | 174.1° | 175.0° |
| C4 | C3 | C5 | H7 | 53.3° | 65.0° |
| C4 | C3 | C5 | H8 | 65.0° | 55.0° |
| C3 | C4 | N4 | C9 | 175.2° | 180.0° |
| C3 | C4 | N4 | C13 | 2.0° | 0.3° |
| C4 | C3 | N2 | C2 | 126.6° | 60.0° |
| C5 | C3 | C4 | O2 | 83.8° | 100.0° |
| C3 | C5 | C6 | H7 | 120.9° | 120.0° |
| C3 | C5 | C6 | H8 | 120.9° | 120.0° |
| C3 | C5 | H7 | H8 | 117.3° | 120.0° |
| C3 | C5 | C6 | C7 | 167.8° | 180.0° |
| C3 | C5 | C6 | H9 | 47.2° | 60.0° |
| C3 | C5 | C6 | H10 | 71.7° | 60.0° |
| C5 | C3 | N2 | C2 | 112.2° | 60.0° |
| C5 | C3 | C4 | N4 | 94.8° | 80.0° |
| H6 | C3 | C4 | O2 | 157.6° | 140.0° |
| H6 | C3 | C5 | C6 | 67.2° | 55.0° |
| H6 | C3 | C5 | H7 | 172.0° | 175.0° |
| H6 | C3 | C5 | H8 | 53.7° | 65.0° |
| H6 | C3 | N2 | C2 | 7.8° | 180.0° |
| H6 | C3 | C4 | N4 | 23.8° | 39.9° |
| O2 | C4 | N4 | C9 | 3.3° | 0.1° |
| O2 | C4 | N4 | C13 | 179.4° | 179.7° |
| C6 | C5 | H7 | H8 | 117.3° | 119.9° |
| C5 | C6 | C7 | H9 | 120.5° | 120.0° |
| C5 | C6 | C7 | H10 | 120.6° | 120.0° |
| C5 | C6 | H9 | H10 | 118.3° | 119.9° |
| C5 | C6 | C7 | C8 | 163.5° | 180.0° |
| C5 | C6 | C7 | H11 | 42.9° | 60.0° |
| C5 | C6 | C7 | H12 | 76.0° | 60.0° |
| H7 | C5 | C6 | C7 | 71.4° | 60.0° |
| H7 | C5 | C6 | H9 | 168.1° | 180.0° |
| H7 | C5 | C6 | H10 | 49.2° | 60.1° |
| H8 | C5 | C6 | C7 | 46.9° | 60.0° |
| H8 | C5 | C6 | H9 | 73.6° | 60.0° |
| H8 | C5 | C6 | H10 | 167.5° | 180.0° |
| C7 | C6 | H9 | H10 | 118.3° | 120.0° |
| C6 | C7 | C8 | H11 | 120.6° | 120.0° |
| C6 | C7 | C8 | H12 | 120.6° | 120.0° |
| C6 | C7 | H11 | H12 | 118.3° | 120.0° |
| C6 | C7 | C8 | N3 | 50.2° | 180.0° |
| C6 | C7 | C8 | H13 | 70.2° | 60.0° |
| C6 | C7 | C8 | H14 | 170.6° | 60.1° |
| H9 | C6 | C7 | C8 | 76.0° | 60.0° |
| H9 | C6 | C7 | H11 | 163.4° | 180.0° |
| H9 | C6 | C7 | H12 | 44.6° | 60.0° |
| H10 | C6 | C7 | C8 | 42.9° | 60.0° |
| H10 | C6 | C7 | H11 | 77.7° | 60.0° |
| H10 | C6 | C7 | H12 | 163.5° | 180.0° |
| C8 | C7 | H11 | H12 | 118.3° | 120.0° |
| C7 | C8 | N3 | H13 | 120.4° | 120.0° |
| C7 | C8 | N3 | H14 | 120.4° | 120.0° |
| C7 | C8 | H13 | H14 | 118.7° | 120.1° |
| C7 | C8 | N3 | H15 | 180.0° | 60.0° |
| C7 | C8 | N3 | H16 | 60.0° | 60.0° |
| C7 | C8 | N3 | H17 | 60.0° | 180.0° |
| H11 | C7 | C8 | N3 | 170.8° | 60.0° |
| H11 | C7 | C8 | H13 | 50.4° | 180.0° |
| H11 | C7 | C8 | H14 | 68.8° | 59.9° |
| H12 | C7 | C8 | N3 | 70.3° | 60.0° |
| H12 | C7 | C8 | H13 | 169.3° | 60.0° |
| H12 | C7 | C8 | H14 | 50.1° | 179.9° |
| N3 | C8 | H13 | H14 | 118.7° | 119.9° |
| C8 | N3 | H15 | H16 | 120.0° | 120.0° |
| C8 | N3 | H15 | H17 | 120.0° | 120.0° |
| C8 | N3 | H16 | H17 | 120.0° | 120.0° |
| H13 | C8 | N3 | H15 | 59.6° | 180.0° |
| H13 | C8 | N3 | H16 | 179.6° | 60.0° |
| H13 | C8 | N3 | H17 | 60.4° | 60.0° |
| H14 | C8 | N3 | H15 | 59.6° | 60.0° |
| H14 | C8 | N3 | H16 | 60.4° | 180.0° |
| H14 | C8 | N3 | H17 | 179.6° | 60.0° |
| H15 | N3 | H16 | H17 | 120.0° | 120.0° |
| C9 | N4 | C13 | C4 | 177.4° | 179.8° |
| N4 | C9 | C10 | C11 | 113.3° | 117.9° |
| N4 | C9 | C10 | H18 | 123.6° | 121.0° |
| N4 | C9 | C11 | H18 | 119.1° | 119.5° |
| N4 | C9 | C10 | O3 | 24.1° | 0.0° |
| N4 | C9 | C11 | C12 | 30.4° | 22.2° |
| N4 | C9 | C11 | H19 | 149.4° | 140.6° |
| N4 | C9 | C11 | H20 | 88.6° | 96.1° |
| C9 | N4 | C13 | C12 | 10.7° | 24.4° |
| C9 | N4 | C13 | H23 | 108.2° | 94.5° |
| C9 | N4 | C13 | H24 | 129.7° | 143.1° |
| N4 | C9 | C10 | N5 | 155.2° | 180.0° |
| C13 | N4 | C9 | C10 | 106.2° | 120.7° |
| C13 | N4 | C9 | C11 | 12.3° | 1.3° |
| C13 | N4 | C9 | H18 | 130.7° | 118.3° |
| N4 | C13 | C12 | C11 | 29.7° | 37.3° |
| N4 | C13 | C12 | H23 | 118.9° | 118.8° |
| N4 | C13 | C12 | H24 | 118.9° | 118.8° |
| N4 | C13 | C12 | H21 | 89.4° | 80.8° |
| N4 | C13 | C12 | H22 | 148.9° | 155.3° |
| N4 | C13 | H23 | H24 | 123.0° | 122.3° |
| C10 | C9 | C11 | H18 | 123.1° | 121.0° |
| C9 | C10 | O3 | N5 | 179.3° | 180.0° |
| C10 | C9 | C11 | C12 | 87.4° | 97.3° |
| C10 | C9 | C11 | H19 | 31.6° | 21.1° |
| C10 | C9 | C11 | H20 | 153.6° | 144.4° |
| C9 | C10 | N5 | C14 | 171.1° | 180.0° |
| C9 | C10 | N5 | H25 | 8.9° | 0.0° |
| C10 | C9 | N4 | C4 | 71.4° | 59.5° |
| C11 | C9 | C10 | O3 | 89.2° | 117.9° |
| C9 | C11 | C12 | H19 | 119.0° | 118.4° |
| C9 | C11 | C12 | H20 | 119.0° | 118.3° |
| C9 | C11 | H19 | H20 | 122.8° | 123.2° |
| C9 | C11 | C12 | C13 | 37.7° | 35.7° |
| C9 | C11 | C12 | H21 | 81.4° | 82.6° |
| C9 | C11 | C12 | H22 | 156.9° | 153.6° |
| C11 | C9 | N4 | C4 | 170.1° | 178.9° |
| C11 | C9 | C10 | N5 | 91.5° | 62.2° |
| H18 | C9 | C10 | O3 | 147.7° | 121.0° |
| H18 | C9 | C11 | C12 | 149.5° | 141.7° |
| H18 | C9 | C11 | H19 | 91.4° | 99.9° |
| H18 | C9 | C11 | H20 | 30.5° | 23.3° |
| H18 | C9 | N4 | C4 | 51.7° | 61.5° |
| H18 | C9 | C10 | N5 | 31.6° | 58.9° |
| O3 | C10 | N5 | C14 | 9.6° | 0.1° |
| O3 | C10 | N5 | H25 | 170.4° | 180.0° |
| C12 | C11 | H19 | H20 | 122.8° | 123.3° |
| C11 | C12 | C13 | H21 | 119.2° | 118.1° |
| C11 | C12 | C13 | H22 | 119.2° | 118.0° |
| C11 | C12 | H21 | H22 | 122.4° | 123.9° |
| C11 | C12 | C13 | H23 | 89.2° | 81.5° |
| C11 | C12 | C13 | H24 | 148.7° | 156.0° |
| H19 | C11 | C12 | C13 | 156.8° | 154.0° |
| H19 | C11 | C12 | H21 | 37.6° | 35.8° |
| H19 | C11 | C12 | H22 | 84.1° | 88.1° |
| H20 | C11 | C12 | C13 | 81.3° | 82.7° |
| H20 | C11 | C12 | H21 | 159.5° | 159.1° |
| H20 | C11 | C12 | H22 | 37.9° | 35.2° |
| C13 | C12 | H21 | H22 | 122.4° | 123.9° |
| C12 | C13 | H23 | H24 | 123.0° | 122.4° |
| C12 | C13 | N4 | C4 | 166.7° | 155.8° |
| H21 | C12 | C13 | H23 | 151.6° | 160.4° |
| H21 | C12 | C13 | H24 | 29.5° | 37.9° |
| H22 | C12 | C13 | H23 | 30.0° | 36.5° |
| H22 | C12 | C13 | H24 | 92.2° | 86.0° |
| H23 | C13 | N4 | C4 | 74.3° | 85.3° |
| H24 | C13 | N4 | C4 | 47.8° | 37.1° |
| C14 | N5 | H25 | C10 | 180.0° | 180.0° |
| N5 | C14 | C15 | C16 | 122.0° | 120.0° |
| N5 | C14 | C15 | H26 | 119.0° | 120.0° |
| N5 | C14 | C16 | H26 | 120.7° | 119.9° |
| N5 | C14 | C15 | O4 | 43.2° | 22.5° |
| N5 | C14 | C16 | C17 | 75.5° | 66.1° |
| N5 | C14 | C16 | H27 | 45.2° | 54.0° |
| N5 | C14 | C16 | H28 | 163.8° | 173.9° |
| N5 | C14 | C15 | N9 | 136.4° | 157.4° |
| H25 | N5 | C14 | C15 | 121.8° | 25.0° |
| H25 | N5 | C14 | C16 | 0.3° | 95.0° |
| H25 | N5 | C14 | H26 | 119.8° | 145.0° |
| C15 | C14 | C16 | H26 | 119.0° | 120.0° |
| C14 | C15 | O4 | N9 | 179.6° | 180.0° |
| C15 | C14 | C16 | C17 | 164.2° | 173.9° |
| C15 | C14 | C16 | H27 | 75.1° | 66.1° |
| C15 | C14 | C16 | H28 | 43.5° | 53.9° |
| C14 | C15 | N9 | C20 | 175.9° | 177.0° |
| C14 | C15 | N9 | C24 | 5.8° | 2.7° |
| C15 | C14 | N5 | C10 | 58.1° | 155.0° |
| C16 | C14 | C15 | O4 | 78.8° | 97.5° |
| C14 | C16 | C17 | H27 | 120.7° | 120.0° |
| C14 | C16 | C17 | H28 | 120.7° | 120.0° |
| C14 | C16 | H27 | H28 | 117.9° | 119.9° |
| C14 | C16 | C17 | C18 | 75.8° | 180.0° |
| C14 | C16 | C17 | H29 | 44.7° | 60.0° |
| C14 | C16 | C17 | H30 | 163.8° | 60.0° |
| C16 | C14 | N5 | C10 | 179.7° | 85.0° |
| C16 | C14 | C15 | N9 | 101.6° | 82.6° |
| H26 | C14 | C15 | O4 | 162.3° | 142.5° |
| H26 | C14 | C16 | C17 | 45.2° | 53.8° |
| H26 | C14 | C16 | H27 | 165.9° | 173.9° |
| H26 | C14 | C16 | H28 | 75.5° | 66.2° |
| H26 | C14 | N5 | C10 | 60.3° | 35.0° |
| H26 | C14 | C15 | N9 | 17.3° | 37.4° |
| O4 | C15 | N9 | C20 | 3.7° | 3.0° |
| O4 | C15 | N9 | C24 | 174.7° | 177.3° |
| C17 | C16 | H27 | H28 | 117.8° | 120.0° |
| C16 | C17 | C18 | H29 | 120.5° | 120.0° |
| C16 | C17 | C18 | H30 | 120.5° | 120.0° |
| C16 | C17 | H29 | H30 | 118.5° | 120.0° |
| C16 | C17 | C18 | N6 | 164.7° | 180.0° |
| C16 | C17 | C18 | H31 | 44.2° | 60.0° |
| C16 | C17 | C18 | H32 | 74.8° | 60.0° |
| H27 | C16 | C17 | C18 | 163.5° | 60.0° |
| H27 | C16 | C17 | H29 | 76.0° | 180.0° |
| H27 | C16 | C17 | H30 | 43.1° | 60.0° |
| H28 | C16 | C17 | C18 | 44.9° | 60.0° |
| H28 | C16 | C17 | H29 | 165.4° | 60.0° |
| H28 | C16 | C17 | H30 | 75.5° | 180.0° |
| C18 | C17 | H29 | H30 | 118.5° | 120.0° |
| C17 | C18 | N6 | H31 | 120.5° | 120.0° |
| C17 | C18 | N6 | H32 | 120.5° | 120.0° |
| C17 | C18 | H31 | H32 | 118.5° | 120.0° |
| C17 | C18 | N6 | C19 | 64.2° | 180.0° |
| C17 | C18 | N6 | H33 | 115.8° | 0.0° |
| H29 | C17 | C18 | N6 | 74.8° | 60.0° |
| H29 | C17 | C18 | H31 | 164.7° | NaN° |
| H29 | C17 | C18 | H32 | 45.7° | 60.0° |
| H30 | C17 | C18 | N6 | 44.2° | 60.0° |
| H30 | C17 | C18 | H31 | 76.2° | 60.0° |
| H30 | C17 | C18 | H32 | 164.7° | 180.0° |
| N6 | C18 | H31 | H32 | 118.5° | 119.9° |
| C18 | N6 | C19 | H33 | 180.0° | 180.0° |
| C18 | N6 | C19 | N7 | 173.3° | 0.0° |
| C18 | N6 | C19 | N8 | 6.3° | 180.0° |
| H31 | C18 | N6 | C19 | 175.3° | 59.9° |
| H31 | C18 | N6 | H33 | 4.7° | 120.0° |
| H32 | C18 | N6 | C19 | 56.3° | 60.0° |
| H32 | C18 | N6 | H33 | 123.7° | 120.0° |
| N6 | C19 | N7 | N8 | 179.6° | 179.9° |
| N6 | C19 | N7 | H34 | 179.6° | 0.0° |
| N6 | C19 | N7 | H35 | 0.4° | 180.0° |
| N6 | C19 | N8 | H36 | 179.5° | 0.1° |
| N6 | C19 | N8 | H37 | 0.4° | 180.0° |
| H33 | N6 | C19 | N7 | 6.7° | 180.0° |
| H33 | N6 | C19 | N8 | 173.7° | 0.0° |
| C19 | N7 | H34 | H35 | 180.0° | 180.0° |
| N7 | C19 | N8 | H36 | 0.0° | 180.0° |
| N7 | C19 | N8 | H37 | 180.0° | 0.1° |
| N8 | C19 | N7 | H34 | 0.0° | 179.9° |
| N8 | C19 | N7 | H35 | 180.0° | 0.0° |
| C19 | N8 | H36 | H37 | 180.0° | 179.9° |
| C20 | N9 | C24 | C15 | 178.5° | 179.8° |
| N9 | C20 | C21 | C22 | 114.7° | 117.8° |
| N9 | C20 | C21 | H38 | 123.6° | 121.1° |
| N9 | C20 | C22 | H38 | 117.9° | 119.5° |
| N9 | C20 | C21 | O5 | 21.3° | 7.2° |
| N9 | C20 | C22 | C23 | 30.3° | 22.2° |
| N9 | C20 | C22 | H39 | 149.4° | 140.5° |
| N9 | C20 | C22 | H40 | 88.8° | 96.2° |
| C20 | N9 | C24 | C23 | 7.7° | 24.4° |
| C20 | N9 | C24 | H43 | 111.3° | 94.5° |
| C20 | N9 | C24 | H44 | 126.8° | 143.3° |
| N9 | C20 | C21 | N10 | 158.9° | 172.8° |
| C24 | N9 | C20 | C21 | 105.6° | 120.7° |
| C24 | N9 | C20 | C22 | 14.2° | 1.3° |
| C24 | N9 | C20 | H38 | 131.3° | 118.3° |
| N9 | C24 | C23 | C22 | 26.9° | 37.3° |
| N9 | C24 | C23 | H43 | 119.0° | 118.9° |
| N9 | C24 | C23 | H44 | 119.0° | 118.8° |
| N9 | C24 | C23 | H41 | 92.3° | 80.8° |
| N9 | C24 | C23 | H42 | 146.2° | 155.3° |
| N9 | C24 | H43 | H44 | 122.8° | 122.3° |
| C21 | C20 | C22 | H38 | 121.8° | 121.1° |
| C20 | C21 | O5 | N10 | 179.8° | 180.0° |
| C21 | C20 | C22 | C23 | 90.0° | 97.2° |
| C21 | C20 | C22 | H39 | 29.0° | 21.1° |
| C21 | C20 | C22 | H40 | 150.9° | 144.5° |
| C20 | C21 | N10 | C25 | 178.7° | 175.5° |
| C20 | C21 | N10 | H45 | 1.3° | 4.5° |
| C21 | C20 | N9 | C15 | 73.0° | 59.6° |
| C22 | C20 | C21 | O5 | 93.4° | 110.5° |
| C20 | C22 | C23 | H39 | 119.1° | 118.4° |
| C20 | C22 | C23 | H40 | 119.1° | 118.3° |
| C20 | C22 | H39 | H40 | 122.7° | 123.3° |
| C20 | C22 | C23 | C24 | 35.9° | 35.6° |
| C20 | C22 | C23 | H41 | 83.3° | 82.5° |
| C20 | C22 | C23 | H42 | 155.2° | 153.5° |
| C22 | C20 | N9 | C15 | 167.3° | 179.0° |
| C22 | C20 | C21 | N10 | 86.5° | 69.5° |
| H38 | C20 | C21 | O5 | 144.9° | 128.3° |
| H38 | C20 | C22 | C23 | 148.2° | 141.7° |
| H38 | C20 | C22 | H39 | 92.7° | 99.9° |
| H38 | C20 | C22 | H40 | 29.1° | 23.4° |
| H38 | C20 | N9 | C15 | 50.2° | 61.5° |
| H38 | C20 | C21 | N10 | 35.2° | 51.7° |
| O5 | C21 | N10 | C25 | 1.5° | 4.5° |
| O5 | C21 | N10 | H45 | 178.5° | 175.5° |
| C23 | C22 | H39 | H40 | 122.7° | 123.2° |
| C22 | C23 | C24 | H41 | 119.3° | 118.1° |
| C22 | C23 | C24 | H42 | 119.2° | 118.0° |
| C22 | C23 | H41 | H42 | 122.2° | 124.0° |
| C22 | C23 | C24 | H43 | 92.1° | 81.6° |
| C22 | C23 | C24 | H44 | 146.0° | 156.1° |
| H39 | C22 | C23 | C24 | 155.0° | 154.0° |
| H39 | C22 | C23 | H41 | 35.7° | 35.9° |
| H39 | C22 | C23 | H42 | 85.8° | 88.1° |
| H40 | C22 | C23 | C24 | 83.2° | 82.7° |
| H40 | C22 | C23 | H41 | 157.5° | 159.1° |
| H40 | C22 | C23 | H42 | 36.1° | 35.2° |
| C24 | C23 | H41 | H42 | 122.1° | 123.9° |
| C23 | C24 | H43 | H44 | 122.8° | 122.4° |
| C23 | C24 | N9 | C15 | 170.8° | 155.8° |
| H41 | C23 | C24 | H43 | 148.6° | 160.3° |
| H41 | C23 | C24 | H44 | 26.7° | 38.0° |
| H42 | C23 | C24 | H43 | 27.2° | 36.4° |
| H42 | C23 | C24 | H44 | 94.8° | 85.9° |
| H43 | C24 | N9 | C15 | 70.2° | 85.3° |
| H44 | C24 | N9 | C15 | 51.7° | 37.0° |
| C25 | N10 | H45 | C21 | 180.0° | 180.0° |
| N10 | C25 | C26 | C27 | 121.5° | 120.0° |
| N10 | C25 | C26 | H46 | 119.8° | 120.0° |
| N10 | C25 | C27 | H46 | 120.0° | 120.0° |
| N10 | C25 | C26 | O6 | 29.6° | 0.0° |
| N10 | C25 | C27 | C28 | 59.4° | 64.9° |
| N10 | C25 | C27 | H47 | 61.3° | 55.1° |
| N10 | C25 | C27 | H48 | 180.0° | 175.1° |
| N10 | C25 | C26 | N11 | 151.3° | 180.0° |
| H45 | N10 | C25 | C26 | 99.1° | 46.2° |
| H45 | N10 | C25 | C27 | 22.3° | 73.8° |
| H45 | N10 | C25 | H46 | 141.7° | 166.2° |
| C26 | C25 | C27 | H46 | 118.7° | 120.0° |
| C25 | C26 | O6 | N11 | 179.0° | 180.0° |
| C26 | C25 | C27 | C28 | 179.4° | 175.1° |
| C26 | C25 | C27 | H47 | 60.0° | 64.9° |
| C26 | C25 | C27 | H48 | 58.7° | 55.1° |
| C25 | C26 | N11 | C34 | 165.4° | 180.0° |
| C25 | C26 | N11 | H54 | 14.6° | 0.0° |
| C26 | C25 | N10 | C21 | 80.9° | 133.8° |
| C27 | C25 | C26 | O6 | 91.9° | 120.0° |
| C25 | C27 | C28 | H47 | 120.6° | 120.1° |
| C25 | C27 | C28 | H48 | 120.7° | 120.0° |
| C25 | C27 | H47 | H48 | 118.0° | 120.0° |
| C25 | C27 | C28 | C29 | 109.0° | 89.5° |
| C25 | C27 | C28 | C30 | 70.2° | 90.7° |
| C27 | C25 | N10 | C21 | 157.7° | 106.2° |
| C27 | C25 | C26 | N11 | 87.2° | 60.0° |
| H46 | C25 | C26 | O6 | 149.4° | 120.0° |
| H46 | C25 | C27 | C28 | 60.7° | 55.1° |
| H46 | C25 | C27 | H47 | 178.7° | 175.1° |
| H46 | C25 | C27 | H48 | 60.0° | 64.9° |
| H46 | C25 | N10 | C21 | 38.3° | 13.8° |
| H46 | C25 | C26 | N11 | 31.5° | 60.0° |
| O6 | C26 | N11 | C34 | 13.7° | 0.0° |
| O6 | C26 | N11 | H54 | 166.3° | 180.0° |
| C28 | C27 | H47 | H48 | 118.0° | 120.0° |
| C27 | C28 | C29 | C30 | 179.2° | 179.8° |
| C27 | C28 | C29 | C31 | 179.9° | 180.0° |
| C27 | C28 | C29 | H49 | 0.1° | 0.0° |
| C27 | C28 | C30 | C32 | 179.7° | 180.0° |
| C27 | C28 | C30 | H50 | 0.3° | 0.1° |
| H47 | C27 | C28 | C29 | 11.6° | 30.5° |
| H47 | C27 | C28 | C30 | 169.2° | 149.3° |
| H48 | C27 | C28 | C29 | 130.3° | 150.5° |
| H48 | C27 | C28 | C30 | 50.5° | 29.3° |
| C28 | C29 | C31 | H49 | 180.0° | 180.0° |
| C29 | C28 | C30 | C32 | 0.5° | 0.2° |
| C29 | C28 | C30 | H50 | 179.5° | 179.8° |
| C28 | C29 | C31 | C33 | 0.6° | 0.0° |
| C28 | C29 | C31 | H51 | 179.4° | 180.0° |
| C30 | C28 | C29 | C31 | 0.7° | 0.2° |
| C30 | C28 | C29 | H49 | 179.3° | 179.8° |
| C28 | C30 | C32 | H50 | 180.0° | 180.0° |
| C28 | C30 | C32 | C33 | 0.1° | 0.0° |
| C28 | C30 | C32 | H52 | 179.9° | 179.9° |
| C29 | C31 | C33 | H51 | 180.0° | 180.0° |
| C29 | C31 | C33 | C32 | 0.3° | 0.2° |
| C29 | C31 | C33 | O7 | 179.7° | 180.0° |
| H49 | C29 | C31 | C33 | 179.4° | 180.0° |
| H49 | C29 | C31 | H51 | 0.6° | 0.0° |
| C30 | C32 | C33 | C31 | 0.0° | 0.2° |
| C30 | C32 | C33 | H52 | 180.0° | 179.9° |
| C30 | C32 | C33 | O7 | 180.0° | 180.0° |
| H50 | C30 | C32 | C33 | 179.9° | 180.0° |
| H50 | C30 | C32 | H52 | 0.2° | 0.0° |
| C31 | C33 | C32 | O7 | 180.0° | 179.8° |
| C31 | C33 | C32 | H52 | 180.0° | 179.7° |
| C31 | C33 | O7 | H53 | 180.0° | 90.0° |
| H51 | C31 | C33 | C32 | 179.7° | 179.8° |
| H51 | C31 | C33 | O7 | 0.3° | 0.0° |
| C32 | C33 | O7 | H53 | 0.0° | 89.8° |
| H52 | C32 | C33 | O7 | 0.0° | 0.1° |
| C34 | N11 | H54 | C26 | 180.0° | 179.9° |
| N11 | C34 | C35 | C36 | 122.7° | 120.0° |
| N11 | C34 | C35 | H55 | 118.4° | 120.0° |
| N11 | C34 | C36 | H55 | 119.7° | 120.0° |
| N11 | C34 | C35 | O8 | 15.8° | 23.8° |
| N11 | C34 | C36 | O9 | 67.3° | 65.1° |
| N11 | C34 | C36 | H56 | 172.5° | 174.9° |
| N11 | C34 | C36 | H57 | 52.9° | 54.9° |
| N11 | C34 | C35 | N12 | 163.9° | 156.1° |
| H54 | N11 | C34 | C35 | 116.5° | 25.0° |
| H54 | N11 | C34 | C36 | 6.3° | 94.9° |
| H54 | N11 | C34 | H55 | 125.7° | 145.1° |
| C35 | C34 | C36 | H55 | 118.7° | 120.0° |
| C34 | C35 | O8 | N12 | 179.7° | 180.0° |
| C35 | C34 | C36 | O9 | 54.3° | 54.9° |
| C35 | C34 | C36 | H56 | 65.9° | 65.1° |
| C35 | C34 | C36 | H57 | 174.5° | 174.9° |
| C34 | C35 | N12 | C37 | 177.4° | 175.3° |
| C34 | C35 | N12 | C41 | 2.7° | 4.4° |
| C35 | C34 | N11 | C26 | 63.5° | 155.0° |
| C36 | C34 | C35 | O8 | 106.9° | 96.2° |
| C34 | C36 | O9 | H56 | 120.2° | 120.0° |
| C34 | C36 | O9 | H57 | 120.2° | 120.0° |
| C34 | C36 | H56 | H57 | 119.4° | 120.0° |
| C34 | C36 | O9 | H58 | 180.0° | 180.0° |
| C36 | C34 | N11 | C26 | 173.7° | 85.0° |
| C36 | C34 | C35 | N12 | 73.4° | 83.9° |
| H55 | C34 | C35 | O8 | 134.2° | 143.8° |
| H55 | C34 | C36 | O9 | 173.0° | 174.9° |
| H55 | C34 | C36 | H56 | 52.8° | 54.9° |
| H55 | C34 | C36 | H57 | 66.8° | 65.1° |
| H55 | C34 | N11 | C26 | 54.4° | 35.0° |
| H55 | C34 | C35 | N12 | 45.5° | 36.1° |
| O8 | C35 | N12 | C37 | 2.3° | 4.6° |
| O8 | C35 | N12 | C41 | 177.6° | 175.7° |
| O9 | C36 | H56 | H57 | 119.4° | 120.0° |
| H56 | C36 | O9 | H58 | 59.8° | 60.0° |
| H57 | C36 | O9 | H58 | 59.8° | 60.0° |
| C37 | N12 | C41 | C35 | 179.9° | 179.7° |
| N12 | C37 | C38 | C39 | 115.2° | 117.8° |
| N12 | C37 | C38 | H59 | 122.9° | 121.0° |
| N12 | C37 | C39 | H59 | 118.2° | 119.5° |
| N12 | C37 | C38 | O10 | 44.2° | 0.0° |
| N12 | C37 | C39 | C40 | 24.3° | 22.2° |
| N12 | C37 | C39 | H60 | 94.9° | 140.5° |
| N12 | C37 | C39 | H61 | 143.4° | 96.2° |
| C37 | N12 | C41 | C40 | 17.0° | 24.5° |
| C37 | N12 | C41 | H64 | 135.9° | 94.5° |
| C37 | N12 | C41 | H65 | 101.9° | 143.2° |
| N12 | C37 | C38 | N13 | 133.7° | 180.0° |
| C41 | N12 | C37 | C38 | 124.6° | 120.7° |
| C41 | N12 | C37 | C39 | 4.5° | 1.3° |
| C41 | N12 | C37 | H59 | 113.0° | 118.2° |
| N12 | C41 | C40 | C39 | 31.8° | 37.3° |
| N12 | C41 | C40 | H64 | 118.9° | 118.9° |
| N12 | C41 | C40 | H65 | 118.9° | 118.7° |
| N12 | C41 | C40 | H62 | 151.0° | 80.8° |
| N12 | C41 | C40 | H63 | 87.4° | 155.3° |
| N12 | C41 | H64 | H65 | 123.2° | 122.3° |
| C38 | C37 | C39 | H59 | 122.0° | 121.1° |
| C37 | C38 | O10 | N13 | 177.7° | 180.0° |
| C38 | C37 | C39 | C40 | 144.1° | 97.2° |
| C38 | C37 | C39 | H60 | 24.9° | 21.1° |
| C38 | C37 | C39 | H61 | 96.8° | 144.4° |
| C37 | C38 | N13 | C42 | 175.9° | 180.0° |
| C37 | C38 | N13 | H66 | 4.1° | 0.0° |
| C38 | C37 | N12 | C35 | 55.4° | 59.5° |
| C39 | C37 | C38 | O10 | 71.0° | 117.8° |
| C37 | C39 | C40 | H60 | 119.2° | 118.3° |
| C37 | C39 | C40 | H61 | 119.1° | 118.4° |
| C37 | C39 | H60 | H61 | 122.5° | 123.2° |
| C37 | C39 | C40 | C41 | 35.3° | 35.7° |
| C37 | C39 | C40 | H62 | 154.5° | 82.5° |
| C37 | C39 | C40 | H63 | 84.0° | 153.6° |
| C39 | C37 | N12 | C35 | 175.5° | 179.0° |
| C39 | C37 | C38 | N13 | 111.1° | 62.2° |
| H59 | C37 | C38 | O10 | 167.1° | 121.0° |
| H59 | C37 | C39 | C40 | 94.0° | 141.7° |
| H59 | C37 | C39 | H60 | 146.9° | 100.0° |
| H59 | C37 | C39 | H61 | 25.2° | 23.3° |
| H59 | C37 | N12 | C35 | 67.0° | 61.5° |
| H59 | C37 | C38 | N13 | 10.8° | 59.0° |
| O10 | C38 | N13 | C42 | 6.3° | 0.0° |
| O10 | C38 | N13 | H66 | 173.7° | 179.9° |
| C40 | C39 | H60 | H61 | 122.5° | 123.2° |
| C39 | C40 | C41 | H62 | 119.2° | 118.1° |
| C39 | C40 | C41 | H63 | 119.2° | 118.0° |
| C39 | C40 | H62 | H63 | 122.2° | 123.9° |
| C39 | C40 | C41 | H64 | 150.7° | 81.6° |
| C39 | C40 | C41 | H65 | 87.1° | 156.0° |
| H60 | C39 | C40 | C41 | 83.9° | 154.0° |
| H60 | C39 | C40 | H62 | 35.3° | 35.8° |
| H60 | C39 | C40 | H63 | 156.9° | 88.1° |
| H61 | C39 | C40 | C41 | 154.4° | 82.7° |
| H61 | C39 | C40 | H62 | 86.4° | 159.1° |
| H61 | C39 | C40 | H63 | 35.1° | 35.2° |
| C41 | C40 | H62 | H63 | 122.2° | 123.9° |
| C40 | C41 | H64 | H65 | 123.2° | 122.3° |
| C40 | C41 | N12 | C35 | 163.0° | 155.8° |
| H62 | C40 | C41 | H64 | 90.1° | 160.3° |
| H62 | C40 | C41 | H65 | 32.2° | 38.0° |
| H63 | C40 | C41 | H64 | 31.5° | 36.4° |
| H63 | C40 | C41 | H65 | 153.7° | 86.0° |
| H64 | C41 | N12 | C35 | 44.1° | 85.2° |
| H65 | C41 | N12 | C35 | 78.1° | 37.1° |
| C42 | N13 | H66 | C38 | 180.0° | 179.9° |
| N13 | C42 | C43 | C44 | 121.5° | 120.0° |
| N13 | C42 | C43 | H67 | 118.5° | 120.0° |
| N13 | C42 | C44 | H67 | 119.4° | 120.0° |
| N13 | C42 | C43 | O11 | 11.2° | 26.0° |
| N13 | C42 | C44 | C45 | 56.2° | 66.1° |
| N13 | C42 | C44 | H68 | 64.5° | 53.9° |
| N13 | C42 | C44 | H69 | 176.9° | 173.9° |
| N13 | C42 | C43 | N17 | 167.1° | 154.0° |
| H66 | N13 | C42 | C43 | 67.9° | 24.9° |
| H66 | N13 | C42 | C44 | 55.4° | 95.1° |
| H66 | N13 | C42 | H67 | 174.3° | 145.0° |
| C43 | C42 | C44 | H67 | 120.1° | 120.0° |
| C42 | C43 | O11 | N17 | 178.3° | 180.0° |
| C43 | C42 | C44 | C45 | 176.7° | 173.9° |
| C43 | C42 | C44 | H68 | 56.0° | 66.1° |
| C43 | C42 | C44 | H69 | 62.7° | 53.9° |
| C42 | C43 | N17 | C48 | 179.8° | 174.9° |
| C42 | C43 | N17 | C52 | 1.3° | 5.4° |
| C43 | C42 | N13 | C38 | 112.1° | 155.0° |
| C44 | C42 | C43 | O11 | 110.3° | 94.0° |
| C42 | C44 | C45 | H68 | 120.7° | 120.0° |
| C42 | C44 | C45 | H69 | 120.7° | 120.0° |
| C42 | C44 | H68 | H69 | 117.8° | 120.0° |
| C42 | C44 | C45 | C46 | 67.6° | 180.0° |
| C42 | C44 | C45 | H70 | 53.0° | 60.0° |
| C42 | C44 | C45 | H71 | 171.8° | 60.0° |
| C44 | C42 | N13 | C38 | 124.6° | 85.0° |
| C44 | C42 | C43 | N17 | 71.4° | 86.1° |
| H67 | C42 | C43 | O11 | 129.7° | 146.0° |
| H67 | C42 | C44 | C45 | 63.3° | 53.9° |
| H67 | C42 | C44 | H68 | 176.1° | 173.9° |
| H67 | C42 | C44 | H69 | 57.4° | 66.2° |
| H67 | C42 | N13 | C38 | 5.7° | 34.9° |
| H67 | C42 | C43 | N17 | 48.6° | 33.9° |
| O11 | C43 | N17 | C48 | 1.9° | 5.2° |
| O11 | C43 | N17 | C52 | 177.0° | 174.5° |
| C45 | C44 | H68 | H69 | 117.8° | 120.0° |
| C44 | C45 | C46 | H70 | 120.6° | 120.0° |
| C44 | C45 | C46 | H71 | 120.6° | 120.0° |
| C44 | C45 | H70 | H71 | 118.2° | 120.0° |
| C44 | C45 | C46 | N14 | 148.9° | 180.0° |
| C44 | C45 | C46 | H72 | 90.8° | 60.0° |
| C44 | C45 | C46 | H73 | 28.5° | 60.0° |
| H68 | C44 | C45 | C46 | 171.7° | 60.0° |
| H68 | C44 | C45 | H70 | 67.7° | 180.0° |
| H68 | C44 | C45 | H71 | 51.1° | 60.0° |
| H69 | C44 | C45 | C46 | 53.1° | 60.0° |
| H69 | C44 | C45 | H70 | 173.7° | 60.0° |
| H69 | C44 | C45 | H71 | 67.5° | 180.0° |
| C46 | C45 | H70 | H71 | 118.1° | 119.9° |
| C45 | C46 | N14 | H72 | 120.3° | 120.0° |
| C45 | C46 | N14 | H73 | 120.3° | 120.0° |
| C45 | C46 | H72 | H73 | 119.0° | 120.0° |
| C45 | C46 | N14 | C47 | 105.3° | 180.0° |
| C45 | C46 | N14 | H74 | 74.7° | 0.0° |
| H70 | C45 | C46 | N14 | 28.3° | 60.0° |
| H70 | C45 | C46 | H72 | 148.6° | 180.0° |
| H70 | C45 | C46 | H73 | 92.1° | 60.0° |
| H71 | C45 | C46 | N14 | 90.5° | 60.0° |
| H71 | C45 | C46 | H72 | 29.8° | 60.0° |
| H71 | C45 | C46 | H73 | 149.1° | 180.0° |
| N14 | C46 | H72 | H73 | 119.0° | 120.0° |
| C46 | N14 | C47 | H74 | 180.0° | 180.0° |
| C46 | N14 | C47 | N15 | 7.9° | 0.0° |
| C46 | N14 | C47 | N16 | 173.0° | 180.0° |
| H72 | C46 | N14 | C47 | 15.0° | 60.0° |
| H72 | C46 | N14 | H74 | 165.0° | 120.0° |
| H73 | C46 | N14 | C47 | 134.3° | 60.0° |
| H73 | C46 | N14 | H74 | 45.7° | 120.0° |
| N14 | C47 | N15 | N16 | 179.1° | 180.0° |
| N14 | C47 | N15 | H75 | 179.1° | 0.0° |
| N14 | C47 | N15 | H76 | 0.9° | 179.9° |
| N14 | C47 | N16 | H77 | 179.1° | 0.0° |
| N14 | C47 | N16 | H78 | 0.9° | 179.9° |
| H74 | N14 | C47 | N15 | 172.1° | 180.0° |
| H74 | N14 | C47 | N16 | 7.0° | 0.0° |
| C47 | N15 | H75 | H76 | 180.0° | 179.9° |
| N15 | C47 | N16 | H77 | 0.0° | 180.0° |
| N15 | C47 | N16 | H78 | 180.0° | 0.0° |
| N16 | C47 | N15 | H75 | 0.0° | 179.9° |
| N16 | C47 | N15 | H76 | 180.0° | 0.0° |
| C47 | N16 | H77 | H78 | 179.9° | 180.0° |
| C48 | N17 | C52 | C43 | 179.0° | 179.8° |
| N17 | C48 | C49 | C50 | 114.9° | 117.8° |
| N17 | C48 | C49 | H79 | 124.6° | 121.0° |
| N17 | C48 | C50 | H79 | 119.0° | 119.5° |
| N17 | C48 | C49 | O12 | 44.0° | 0.0° |
| N17 | C48 | C50 | C51 | 20.8° | 22.2° |
| N17 | C48 | C50 | H80 | 98.5° | 140.6° |
| N17 | C48 | C50 | H81 | 140.0° | 96.1° |
| C48 | N17 | C52 | C51 | 17.7° | 24.4° |
| C48 | N17 | C52 | H84 | 136.7° | 94.5° |
| C48 | N17 | C52 | H85 | 101.3° | 143.2° |
| N17 | C48 | C49 | N18 | 143.0° | 180.0° |
| C52 | N17 | C48 | C49 | 119.4° | 120.7° |
| C52 | N17 | C48 | C50 | 1.8° | 1.3° |
| C52 | N17 | C48 | H79 | 116.5° | 118.3° |
| N17 | C52 | C51 | C50 | 30.3° | 37.3° |
| N17 | C52 | C51 | H84 | 118.9° | 118.8° |
| N17 | C52 | C51 | H85 | 119.0° | 118.7° |
| N17 | C52 | C51 | H82 | 149.7° | 80.8° |
| N17 | C52 | C51 | H83 | 89.1° | 155.3° |
| N17 | C52 | H84 | H85 | 123.0° | 122.3° |
| C49 | C48 | C50 | H79 | 120.6° | 121.1° |
| C48 | C49 | O12 | N18 | 172.4° | 180.0° |
| C49 | C48 | C50 | C51 | 141.2° | 97.2° |
| C49 | C48 | C50 | H80 | 21.9° | 21.1° |
| C49 | C48 | C50 | H81 | 99.6° | 144.4° |
| C48 | C49 | N18 | C53 | 179.5° | 180.0° |
| C48 | C49 | N18 | H86 | 0.5° | 0.0° |
| C49 | C48 | N17 | C43 | 61.5° | 59.6° |
| C50 | C48 | C49 | O12 | 70.9° | 117.8° |
| C48 | C50 | C51 | H80 | 119.2° | 118.4° |
| C48 | C50 | C51 | H81 | 119.2° | 118.4° |
| C48 | C50 | H80 | H81 | 122.2° | 123.3° |
| C48 | C50 | C51 | C52 | 32.0° | 35.7° |
| C48 | C50 | C51 | H82 | 151.4° | 82.6° |
| C48 | C50 | C51 | H83 | 87.4° | 153.6° |
| C50 | C48 | N17 | C43 | 179.2° | 179.0° |
| C50 | C48 | C49 | N18 | 102.1° | 62.2° |
| H79 | C48 | C49 | O12 | 168.6° | 121.0° |
| H79 | C48 | C50 | C51 | 98.3° | 141.7° |
| H79 | C48 | C50 | H80 | 142.5° | 100.0° |
| H79 | C48 | C50 | H81 | 21.0° | 23.3° |
| H79 | C48 | N17 | C43 | 62.5° | 61.4° |
| H79 | C48 | C49 | N18 | 18.4° | 59.0° |
| O12 | C49 | N18 | C53 | 7.8° | 0.0° |
| O12 | C49 | N18 | H86 | 172.2° | 180.0° |
| C51 | C50 | H80 | H81 | 122.2° | 123.2° |
| C50 | C51 | C52 | H82 | 119.4° | 118.1° |
| C50 | C51 | C52 | H83 | 119.4° | 118.0° |
| C50 | C51 | H82 | H83 | 121.9° | 123.9° |
| C50 | C51 | C52 | H84 | 149.2° | 81.5° |
| C50 | C51 | C52 | H85 | 88.7° | 156.0° |
| H80 | C50 | C51 | C52 | 87.2° | 154.1° |
| H80 | C50 | C51 | H82 | 32.2° | 35.8° |
| H80 | C50 | C51 | H83 | 153.4° | 88.0° |
| H81 | C50 | C51 | C52 | 151.2° | 82.7° |
| H81 | C50 | C51 | H82 | 89.4° | 159.0° |
| H81 | C50 | C51 | H83 | 31.9° | 35.2° |
| C52 | C51 | H82 | H83 | 121.9° | 123.9° |
| C51 | C52 | H84 | H85 | 123.0° | 122.4° |
| C51 | C52 | N17 | C43 | 161.3° | 155.8° |
| H82 | C51 | C52 | H84 | 91.4° | 160.3° |
| H82 | C51 | C52 | H85 | 30.7° | 37.9° |
| H83 | C51 | C52 | H84 | 29.9° | 36.4° |
| H83 | C51 | C52 | H85 | 152.0° | 86.0° |
| H84 | C52 | N17 | C43 | 42.3° | 85.3° |
| H85 | C52 | N17 | C43 | 79.7° | 37.1° |
| C53 | N18 | H86 | C49 | 180.0° | 180.0° |
| N18 | C53 | C54 | C55 | 119.0° | 120.0° |
| N18 | C53 | C54 | H87 | 123.0° | 120.0° |
| N18 | C53 | C55 | H87 | 121.7° | 120.0° |
| N18 | C53 | C54 | O13 | 41.4° | 0.0° |
| N18 | C53 | C55 | O14 | 49.2° | 65.0° |
| N18 | C53 | C55 | C56 | 69.3° | 55.0° |
| N18 | C53 | C55 | H88 | 169.9° | 175.0° |
| N18 | C53 | C54 | N19 | 134.7° | 180.0° |
| H86 | N18 | C53 | C54 | 74.7° | 25.0° |
| H86 | N18 | C53 | C55 | 41.6° | 95.0° |
| H86 | N18 | C53 | H87 | 162.6° | 145.0° |
| C54 | C53 | C55 | H87 | 118.3° | 120.0° |
| C53 | C54 | O13 | N19 | 175.8° | 180.0° |
| C54 | C53 | C55 | O14 | 70.8° | 55.0° |
| C54 | C53 | C55 | C56 | 170.7° | 175.0° |
| C54 | C53 | C55 | H88 | 49.9° | 64.9° |
| C53 | C54 | N19 | C57 | 177.3° | 180.0° |
| C53 | C54 | N19 | H93 | 2.7° | 0.0° |
| C54 | C53 | N18 | C49 | 105.3° | 155.0° |
| C55 | C53 | C54 | O13 | 77.6° | 120.0° |
| C53 | C55 | O14 | C56 | 119.7° | 120.0° |
| C53 | C55 | O14 | H88 | 119.7° | 120.0° |
| C53 | C55 | C56 | H88 | 120.6° | 120.0° |
| C53 | C55 | O14 | H89 | 35.7° | 180.0° |
| C53 | C55 | C56 | H90 | 180.0° | 180.0° |
| C53 | C55 | C56 | H91 | 60.0° | 60.0° |
| C53 | C55 | C56 | H92 | 60.0° | 60.0° |
| C55 | C53 | N18 | C49 | 138.4° | 85.0° |
| C55 | C53 | C54 | N19 | 106.3° | 60.0° |
| H87 | C53 | C54 | O13 | 164.4° | 120.0° |
| H87 | C53 | C55 | O14 | 170.9° | 175.0° |
| H87 | C53 | C55 | C56 | 52.4° | 65.0° |
| H87 | C53 | C55 | H88 | 68.4° | 55.0° |
| H87 | C53 | N18 | C49 | 17.4° | 35.0° |
| H87 | C53 | C54 | N19 | 11.7° | 60.0° |
| O13 | C54 | N19 | C57 | 6.7° | 0.0° |
| O13 | C54 | N19 | H93 | 173.3° | 180.0° |
| O14 | C55 | C56 | H88 | 121.4° | 120.0° |
| O14 | C55 | C56 | H90 | 62.0° | 60.0° |
| O14 | C55 | C56 | H91 | 178.0° | 180.0° |
| O14 | C55 | C56 | H92 | 58.0° | 60.0° |
| C56 | C55 | O14 | H89 | 155.4° | 60.0° |
| C55 | C56 | H90 | H91 | 120.0° | 120.0° |
| C55 | C56 | H90 | H92 | 120.0° | 119.9° |
| C55 | C56 | H91 | H92 | 120.0° | 120.0° |
| H88 | C55 | O14 | H89 | 84.0° | 60.0° |
| H88 | C55 | C56 | H90 | 59.4° | 60.0° |
| H88 | C55 | C56 | H91 | 60.6° | 60.1° |
| H88 | C55 | C56 | H92 | 179.4° | 179.9° |
| H90 | C56 | H91 | H92 | 120.0° | 120.0° |
| C57 | N19 | H93 | C54 | 180.0° | 180.0° |
| N19 | C57 | C58 | C59 | 123.8° | 120.0° |
| N19 | C57 | C58 | H94 | 119.9° | 120.1° |
| N19 | C57 | C59 | H94 | 114.6° | 120.1° |
| N19 | C57 | C58 | O15 | 151.7° | 0.0° |
| N19 | C57 | C59 | O16 | 44.3° | 65.0° |
| N19 | C57 | C59 | H95 | 75.3° | 175.0° |
| N19 | C57 | C59 | H96 | 164.0° | 55.0° |
| N19 | C57 | C58 | N20 | 38.4° | 180.0° |
| H93 | N19 | C57 | C58 | 114.9° | 25.0° |
| H93 | N19 | C57 | C59 | 11.3° | 95.0° |
| H93 | N19 | C57 | H94 | 125.6° | 145.0° |
| C58 | C57 | C59 | H94 | 116.1° | 119.9° |
| C57 | C58 | O15 | N20 | 169.5° | 180.0° |
| C58 | C57 | C59 | O16 | 173.6° | 55.0° |
| C58 | C57 | C59 | H95 | 53.9° | 65.0° |
| C58 | C57 | C59 | H96 | 66.7° | 175.0° |
| C57 | C58 | N20 | C60 | 177.2° | 180.0° |
| C57 | C58 | N20 | H98 | 2.8° | 0.0° |
| C58 | C57 | N19 | C54 | 65.1° | 155.0° |
| C59 | C57 | C58 | O15 | 84.5° | 120.0° |
| C57 | C59 | O16 | H95 | 119.7° | 120.0° |
| C57 | C59 | O16 | H96 | 119.7° | 119.9° |
| C57 | C59 | H95 | H96 | 121.0° | 120.0° |
| C57 | C59 | O16 | H97 | 180.0° | 180.0° |
| C59 | C57 | N19 | C54 | 168.7° | 85.0° |
| C59 | C57 | C58 | N20 | 85.4° | 60.0° |
| H94 | C57 | C58 | O15 | 31.7° | 120.0° |
| H94 | C57 | C59 | O16 | 70.3° | 175.0° |
| H94 | C57 | C59 | H95 | 170.0° | 55.0° |
| H94 | C57 | C59 | H96 | 49.4° | 65.1° |
| H94 | C57 | N19 | C54 | 54.4° | 35.0° |
| H94 | C57 | C58 | N20 | 158.3° | 60.0° |
| O15 | C58 | N20 | C60 | 7.6° | 0.0° |
| O15 | C58 | N20 | H98 | 172.4° | 179.9° |
| O16 | C59 | H95 | H96 | 121.0° | 120.1° |
| H95 | C59 | O16 | H97 | 60.3° | 60.0° |
| H96 | C59 | O16 | H97 | 60.3° | 60.1° |
| C60 | N20 | H98 | C58 | 180.0° | 179.9° |
| N20 | C60 | C61 | C62 | 120.9° | 120.0° |
| N20 | C60 | C61 | H99 | 120.7° | 120.0° |
| N20 | C60 | C62 | H99 | 119.8° | 120.0° |
| N20 | C60 | C61 | O17 | 29.2° | 26.9° |
| N20 | C60 | C62 | C63 | 67.2° | 66.0° |
| N20 | C60 | C62 | H100 | 172.2° | 54.1° |
| N20 | C60 | C62 | H101 | 53.3° | 174.0° |
| N20 | C60 | C61 | N23 | 149.1° | 153.1° |
| H98 | N20 | C60 | C61 | 45.7° | 25.1° |
| H98 | N20 | C60 | C62 | 74.8° | 95.0° |
| H98 | N20 | C60 | H99 | 165.9° | 145.1° |
| C61 | C60 | C62 | H99 | 118.4° | 120.0° |
| C60 | C61 | O17 | N23 | 178.2° | 180.0° |
| C61 | C60 | C62 | C63 | 54.6° | 174.0° |
| C61 | C60 | C62 | H100 | 66.0° | 66.0° |
| C61 | C60 | C62 | H101 | 175.2° | 54.0° |
| C60 | C61 | N23 | C66 | 175.5° | 175.2° |
| C60 | C61 | N23 | C70 | 10.6° | 4.5° |
| C61 | C60 | N20 | C58 | 134.3° | 155.0° |
| C62 | C60 | C61 | O17 | 91.6° | 93.1° |
| C60 | C62 | C63 | H100 | 120.6° | 120.0° |
| C60 | C62 | C63 | H101 | 120.6° | 120.0° |
| C60 | C62 | H100 | H101 | 118.3° | 120.0° |
| C60 | C62 | C63 | N21 | 111.9° | 95.0° |
| C60 | C62 | C63 | C64 | 66.7° | 85.3° |
| C62 | C60 | N20 | C58 | 105.2° | 85.0° |
| C62 | C60 | C61 | N23 | 90.0° | 86.9° |
| H99 | C60 | C61 | O17 | 149.9° | 146.9° |
| H99 | C60 | C62 | C63 | 173.0° | 54.0° |
| H99 | C60 | C62 | H100 | 52.4° | 174.0° |
| H99 | C60 | C62 | H101 | 66.4° | 66.0° |
| H99 | C60 | N20 | C58 | 14.1° | 35.0° |
| H99 | C60 | C61 | N23 | 28.4° | 33.1° |
| O17 | C61 | N23 | C66 | 6.2° | 4.8° |
| O17 | C61 | N23 | C70 | 171.2° | 175.5° |
| C63 | C62 | H100 | H101 | 118.3° | 120.0° |
| C62 | C63 | N21 | C64 | 178.9° | 179.7° |
| C62 | C63 | N21 | C65 | 179.6° | 180.0° |
| C62 | C63 | N21 | H102 | 0.4° | 0.1° |
| C62 | C63 | C64 | N22 | 179.8° | 179.9° |
| C62 | C63 | C64 | H103 | 0.2° | 0.1° |
| H100 | C62 | C63 | N21 | 8.7° | 25.0° |
| H100 | C62 | C63 | C64 | 172.7° | 154.7° |
| H101 | C62 | C63 | N21 | 127.6° | 145.0° |
| H101 | C62 | C63 | C64 | 53.9° | 34.7° |
| C63 | N21 | C65 | H102 | 180.0° | 180.0° |
| N21 | C63 | C64 | N22 | 1.0° | 0.2° |
| N21 | C63 | C64 | H103 | 179.0° | 179.7° |
| C63 | N21 | C65 | N22 | 0.1° | 0.1° |
| C63 | N21 | C65 | H104 | 179.9° | 180.0° |
| C64 | C63 | N21 | C65 | 0.7° | 0.2° |
| C64 | C63 | N21 | H102 | 179.3° | 179.8° |
| C63 | C64 | N22 | H103 | 180.0° | 179.9° |
| C63 | C64 | N22 | C65 | 1.0° | 0.1° |
| C63 | C64 | N22 | H105 | 179.0° | 180.0° |
| N21 | C65 | N22 | C64 | 0.5° | 0.0° |
| N21 | C65 | N22 | H104 | 180.0° | 179.9° |
| N21 | C65 | N22 | H105 | 179.5° | 179.9° |
| H102 | N21 | C65 | N22 | 179.9° | 179.9° |
| H102 | N21 | C65 | H104 | 0.1° | 0.0° |
| C64 | N22 | C65 | H105 | 180.0° | 179.9° |
| C64 | N22 | C65 | H104 | 179.5° | 179.9° |
| H103 | C64 | N22 | C65 | 179.0° | 179.8° |
| H103 | C64 | N22 | H105 | 1.0° | 0.1° |
| H104 | C65 | N22 | H105 | 0.5° | 0.0° |
| C66 | N23 | C70 | C61 | 166.2° | 179.7° |
| N23 | C66 | C67 | C68 | 114.2° | 117.8° |
| N23 | C66 | C67 | H106 | 124.7° | 121.0° |
| N23 | C66 | C68 | H106 | 117.8° | 119.5° |
| N23 | C66 | C67 | O18 | 32.9° | 0.0° |
| N23 | C66 | C68 | C69 | 31.0° | 22.1° |
| N23 | C66 | C68 | H107 | 150.2° | 140.5° |
| N23 | C66 | C68 | H108 | 88.2° | 96.2° |
| C66 | N23 | C70 | C69 | 7.3° | 24.5° |
| C66 | N23 | C70 | H111 | 126.4° | 94.4° |
| C66 | N23 | C70 | H112 | 111.7° | 143.2° |
| N23 | C66 | C67 | N24 | 146.5° | 180.0° |
| C70 | N23 | C66 | C67 | 94.4° | 120.7° |
| C70 | N23 | C66 | C68 | 24.1° | 1.3° |
| C70 | N23 | C66 | H106 | 141.3° | 118.3° |
| N23 | C70 | C69 | C68 | 13.3° | 37.3° |
| N23 | C70 | C69 | H111 | 119.1° | 118.8° |
| N23 | C70 | C69 | H112 | 119.1° | 118.8° |
| N23 | C70 | C69 | H109 | 106.5° | 80.8° |
| N23 | C70 | C69 | H110 | 133.0° | 155.3° |
| N23 | C70 | H111 | H112 | 122.7° | 122.4° |
| C67 | C66 | C68 | H106 | 121.1° | 121.1° |
| C66 | C67 | O18 | N24 | 179.3° | 179.9° |
| C67 | C66 | C68 | C69 | 90.0° | 97.2° |
| C67 | C66 | C68 | H107 | 29.2° | 21.2° |
| C67 | C66 | C68 | H108 | 150.8° | 144.5° |
| C66 | C67 | N24 | C71 | 173.6° | 180.0° |
| C66 | C67 | N24 | H113 | 6.4° | 0.0° |
| C67 | C66 | N23 | C61 | 72.5° | 59.6° |
| C68 | C66 | C67 | O18 | 81.4° | 117.8° |
| C66 | C68 | C69 | H107 | 119.2° | 118.4° |
| C66 | C68 | C69 | H108 | 119.2° | 118.3° |
| C66 | C68 | H107 | H108 | 122.4° | 123.2° |
| C66 | C68 | C69 | C70 | 27.9° | 35.6° |
| C66 | C68 | C69 | H109 | 91.8° | 82.6° |
| C66 | C68 | C69 | H110 | 147.7° | 153.5° |
| C68 | C66 | N23 | C61 | 169.0° | 179.0° |
| C68 | C66 | C67 | N24 | 99.3° | 62.2° |
| H106 | C66 | C67 | O18 | 157.6° | 121.0° |
| H106 | C66 | C68 | C69 | 148.9° | 141.7° |
| H106 | C66 | C68 | H107 | 91.9° | 100.0° |
| H106 | C66 | C68 | H108 | 29.7° | 23.3° |
| H106 | C66 | N23 | C61 | 51.7° | 61.4° |
| H106 | C66 | C67 | N24 | 21.8° | 59.0° |
| O18 | C67 | N24 | C71 | 7.1° | 0.0° |
| O18 | C67 | N24 | H113 | 172.9° | 180.0° |
| C69 | C68 | H107 | H108 | 122.3° | 123.2° |
| C68 | C69 | C70 | H109 | 119.7° | 118.1° |
| C68 | C69 | C70 | H110 | 119.7° | 118.0° |
| C68 | C69 | H109 | H110 | 120.8° | 124.0° |
| C68 | C69 | C70 | H111 | 105.8° | 81.6° |
| C68 | C69 | C70 | H112 | 132.4° | 156.0° |
| H107 | C68 | C69 | C70 | 147.1° | 154.0° |
| H107 | C68 | C69 | H109 | 27.4° | 35.8° |
| H107 | C68 | C69 | H110 | 93.1° | 88.1° |
| H108 | C68 | C69 | C70 | 91.3° | 82.7° |
| H108 | C68 | C69 | H109 | 149.0° | 159.1° |
| H108 | C68 | C69 | H110 | 28.5° | 35.2° |
| C70 | C69 | H109 | H110 | 120.8° | 123.9° |
| C69 | C70 | H111 | H112 | 122.6° | 122.3° |
| C69 | C70 | N23 | C61 | 173.5° | 155.9° |
| H109 | C69 | C70 | H111 | 134.4° | 160.4° |
| H109 | C69 | C70 | H112 | 12.6° | 38.0° |
| H110 | C69 | C70 | H111 | 13.9° | 36.5° |
| H110 | C69 | C70 | H112 | 107.9° | 85.9° |
| H111 | C70 | N23 | C61 | 67.4° | 85.3° |
| H112 | C70 | N23 | C61 | 54.4° | 37.1° |
| C71 | N24 | H113 | C67 | 180.0° | 180.0° |
| N24 | C71 | C72 | C73 | 119.9° | 120.0° |
| N24 | C71 | C72 | H114 | 119.7° | 120.0° |
| N24 | C71 | C73 | H114 | 121.9° | 120.0° |
| N24 | C71 | C72 | O19 | 46.4° | 18.8° |
| N24 | C71 | C73 | C74 | 176.9° | 66.0° |
| N24 | C71 | C73 | H115 | 56.2° | 54.0° |
| N24 | C71 | C73 | H116 | 62.5° | 174.0° |
| N24 | C71 | C72 | N28 | 135.9° | 161.2° |
| H113 | N24 | C71 | C72 | 115.0° | 25.0° |
| H113 | N24 | C71 | C73 | 4.5° | 95.0° |
| H113 | N24 | C71 | H114 | 125.9° | 145.0° |
| C72 | C71 | C73 | H114 | 120.4° | 120.0° |
| C71 | C72 | O19 | N28 | 177.5° | 180.0° |
| C72 | C71 | C73 | C74 | 65.4° | 174.0° |
| C72 | C71 | C73 | H115 | 173.9° | 66.0° |
| C72 | C71 | C73 | H116 | 55.2° | 54.0° |
| C71 | C72 | N28 | C77 | 178.9° | 4.7° |
| C71 | C72 | N28 | C81 | 8.6° | 175.6° |
| C72 | C71 | N24 | C67 | 65.0° | 155.0° |
| C73 | C71 | C72 | O19 | 73.5° | 101.2° |
| C71 | C73 | C74 | H115 | 120.6° | 120.0° |
| C71 | C73 | C74 | H116 | 120.6° | 120.0° |
| C71 | C73 | H115 | H116 | 118.0° | 120.0° |
| C71 | C73 | C74 | C75 | 176.9° | 180.0° |
| C71 | C73 | C74 | H117 | 56.8° | 60.0° |
| C71 | C73 | C74 | H118 | 63.0° | 60.0° |
| C73 | C71 | N24 | C67 | 175.5° | 85.0° |
| C73 | C71 | C72 | N28 | 104.1° | 78.8° |
| H114 | C71 | C72 | O19 | 166.1° | 138.8° |
| H114 | C71 | C73 | C74 | 54.9° | 54.0° |
| H114 | C71 | C73 | H115 | 65.7° | 174.0° |
| H114 | C71 | C73 | H116 | 175.6° | 66.0° |
| H114 | C71 | N24 | C67 | 54.1° | 35.0° |
| H114 | C71 | C72 | N28 | 16.3° | 41.2° |
| O19 | C72 | N28 | C77 | 3.5° | 175.3° |
| O19 | C72 | N28 | C81 | 173.8° | 4.5° |
| C74 | C73 | H115 | H116 | 118.0° | 120.0° |
| C73 | C74 | C75 | H117 | 120.1° | 120.0° |
| C73 | C74 | C75 | H118 | 120.1° | 120.0° |
| C73 | C74 | H117 | H118 | 119.6° | 120.0° |
| C73 | C74 | C75 | N25 | 61.3° | 180.0° |
| C73 | C74 | C75 | H119 | 178.7° | 60.0° |
| C73 | C74 | C75 | H120 | 58.8° | 60.0° |
| H115 | C73 | C74 | C75 | 62.5° | 60.0° |
| H115 | C73 | C74 | H117 | 177.4° | 180.0° |
| H115 | C73 | C74 | H118 | 57.6° | 60.0° |
| H116 | C73 | C74 | C75 | 56.3° | 60.0° |
| H116 | C73 | C74 | H117 | 63.9° | 60.0° |
| H116 | C73 | C74 | H118 | 176.4° | 180.0° |
| C75 | C74 | H117 | H118 | 119.6° | 120.0° |
| C74 | C75 | N25 | H119 | 120.1° | 120.0° |
| C74 | C75 | N25 | H120 | 120.0° | 120.0° |
| C74 | C75 | H119 | H120 | 119.8° | 120.0° |
| C74 | C75 | N25 | C76 | 154.3° | 180.0° |
| C74 | C75 | N25 | H121 | 25.7° | 0.0° |
| H117 | C74 | C75 | N25 | 58.8° | 60.0° |
| H117 | C74 | C75 | H119 | 61.2° | 180.0° |
| H117 | C74 | C75 | H120 | 178.9° | 60.0° |
| H118 | C74 | C75 | N25 | 178.6° | 60.0° |
| H118 | C74 | C75 | H119 | 58.6° | 60.0° |
| H118 | C74 | C75 | H120 | 61.3° | 180.0° |
| N25 | C75 | H119 | H120 | 119.9° | 120.0° |
| C75 | N25 | C76 | H121 | 180.0° | 180.0° |
| C75 | N25 | C76 | N26 | 179.6° | 0.0° |
| C75 | N25 | C76 | N27 | 0.3° | 180.0° |
| H119 | C75 | N25 | C76 | 85.7° | 60.0° |
| H119 | C75 | N25 | H121 | 94.3° | 120.0° |
| H120 | C75 | N25 | C76 | 34.2° | 60.0° |
| H120 | C75 | N25 | H121 | 145.8° | 120.0° |
| N25 | C76 | N26 | N27 | 179.9° | 180.0° |
| N25 | C76 | N26 | H122 | 179.9° | 0.1° |
| N25 | C76 | N26 | H123 | 0.1° | 179.9° |
| N25 | C76 | N27 | H124 | 179.9° | 0.0° |
| N25 | C76 | N27 | H125 | 0.1° | 180.0° |
| H121 | N25 | C76 | N26 | 0.3° | 180.0° |
| H121 | N25 | C76 | N27 | 179.7° | 0.0° |
| C76 | N26 | H122 | H123 | 180.0° | 179.9° |
| N26 | C76 | N27 | H124 | 0.0° | 180.0° |
| N26 | C76 | N27 | H125 | 180.0° | 0.0° |
| N27 | C76 | N26 | H122 | 0.0° | 180.0° |
| N27 | C76 | N26 | H123 | 180.0° | 0.1° |
| C76 | N27 | H124 | H125 | 180.0° | 180.0° |
| C77 | N28 | C81 | C72 | 170.5° | 179.8° |
| N28 | C77 | C78 | C79 | 114.2° | 117.9° |
| N28 | C77 | C78 | H126 | 123.5° | 121.0° |
| N28 | C77 | C79 | H126 | 118.9° | 119.5° |
| N28 | C77 | C78 | O20 | 38.1° | 19.4° |
| N28 | C77 | C79 | C80 | 21.7° | 22.2° |
| N28 | C77 | C79 | H127 | 97.7° | 140.5° |
| N28 | C77 | C79 | H128 | 141.0° | 96.2° |
| C77 | N28 | C81 | C80 | 17.6° | 24.4° |
| C77 | N28 | C81 | H131 | 136.5° | 94.4° |
| C77 | N28 | C81 | H132 | 101.4° | 143.2° |
| N28 | C77 | C78 | N29 | 142.7° | 160.6° |
| C81 | N28 | C77 | C78 | 121.3° | 120.7° |
| C81 | N28 | C77 | C79 | 2.3° | 1.3° |
| C81 | N28 | C77 | H126 | 115.8° | 118.3° |
| N28 | C81 | C80 | C79 | 30.8° | 37.3° |
| N28 | C81 | C80 | H131 | 118.9° | 118.8° |
| N28 | C81 | C80 | H132 | 118.9° | 118.8° |
| N28 | C81 | C80 | H129 | 150.2° | 80.9° |
| N28 | C81 | C80 | H130 | 88.5° | 155.3° |
| N28 | C81 | H131 | H132 | 123.0° | 122.3° |
| C78 | C77 | C79 | H126 | 122.4° | 121.0° |
| C77 | C78 | O20 | N29 | 179.1° | 179.9° |
| C78 | C77 | C79 | C80 | 140.3° | 97.3° |
| C78 | C77 | C79 | H127 | 21.0° | 21.1° |
| C78 | C77 | C79 | H128 | 100.4° | 144.4° |
| C77 | C78 | N29 | C82 | 177.9° | 174.8° |
| C77 | C78 | N29 | H133 | 2.1° | 5.2° |
| C78 | C77 | N28 | C72 | 66.5° | 59.5° |
| C79 | C77 | C78 | O20 | 76.1° | 98.4° |
| C77 | C79 | C80 | H127 | 119.3° | 118.4° |
| C77 | C79 | C80 | H128 | 119.3° | 118.4° |
| C77 | C79 | H127 | H128 | 122.0° | 123.3° |
| C77 | C79 | C80 | C81 | 33.0° | 35.6° |
| C77 | C79 | C80 | H129 | 152.4° | 82.6° |
| C77 | C79 | C80 | H130 | 86.3° | 153.6° |
| C79 | C77 | N28 | C72 | 174.6° | 179.0° |
| C79 | C77 | C78 | N29 | 103.0° | 81.5° |
| H126 | C77 | C78 | O20 | 161.6° | 140.4° |
| H126 | C77 | C79 | C80 | 97.3° | 141.7° |
| H126 | C77 | C79 | H127 | 143.4° | 100.0° |
| H126 | C77 | C79 | H128 | 22.0° | 23.3° |
| H126 | C77 | N28 | C72 | 56.4° | 61.5° |
| H126 | C77 | C78 | N29 | 19.3° | 39.6° |
| O20 | C78 | N29 | C82 | 3.0° | 5.1° |
| O20 | C78 | N29 | H133 | 177.0° | 174.9° |
| C80 | C79 | H127 | H128 | 122.0° | 123.2° |
| C79 | C80 | C81 | H129 | 119.4° | 118.2° |
| C79 | C80 | C81 | H130 | 119.4° | 118.1° |
| C79 | C80 | H129 | H130 | 121.9° | 124.0° |
| C79 | C80 | C81 | H131 | 149.8° | 81.5° |
| C79 | C80 | C81 | H132 | 88.1° | 156.0° |
| H127 | C79 | C80 | C81 | 86.3° | 154.0° |
| H127 | C79 | C80 | H129 | 33.1° | 35.8° |
| H127 | C79 | C80 | H130 | 154.4° | 88.0° |
| H128 | C79 | C80 | C81 | 152.3° | 82.7° |
| H128 | C79 | C80 | H129 | 88.3° | 159.1° |
| H128 | C79 | C80 | H130 | 33.0° | 35.2° |
| C81 | C80 | H129 | H130 | 121.9° | 123.8° |
| C80 | C81 | H131 | H132 | 123.1° | 122.4° |
| C80 | C81 | N28 | C72 | 152.9° | 155.8° |
| H129 | C80 | C81 | H131 | 90.9° | 160.3° |
| H129 | C80 | C81 | H132 | 31.3° | 37.9° |
| H130 | C80 | C81 | H131 | 30.4° | 36.5° |
| H130 | C80 | C81 | H132 | 152.5° | 85.9° |
| H131 | C81 | N28 | C72 | 34.0° | 85.3° |
| H132 | C81 | N28 | C72 | 88.1° | 37.1° |
| C82 | N29 | H133 | C78 | 180.0° | 180.0° |
| N29 | C82 | C83 | C84 | 120.1° | 120.0° |
| N29 | C82 | C83 | H134 | 120.8° | 119.9° |
| N29 | C82 | C84 | H134 | 122.0° | 119.9° |
| N29 | C82 | C83 | O21 | 72.3° | 25.1° |
| N29 | C82 | C84 | C85 | 62.7° | 175.6° |
| N29 | C82 | C84 | C86 | 174.7° | 64.4° |
| N29 | C82 | C84 | H135 | 55.7° | 55.6° |
| N29 | C82 | C83 | N30 | 107.7° | 155.0° |
| H133 | N29 | C82 | C83 | 87.6° | 28.4° |
| H133 | N29 | C82 | C84 | 30.8° | 91.6° |
| H133 | N29 | C82 | H134 | 152.0° | 148.4° |
| C83 | C82 | C84 | H134 | 119.5° | 120.1° |
| C82 | C83 | O21 | N30 | 180.0° | 180.0° |
| C83 | C82 | C84 | C85 | 178.9° | 64.4° |
| C83 | C82 | C84 | C86 | 56.3° | 55.5° |
| C83 | C82 | C84 | H135 | 62.7° | 175.6° |
| C82 | C83 | N30 | C88 | 176.8° | 175.4° |
| C82 | C83 | N30 | H144 | 3.2° | 4.6° |
| C83 | C82 | N29 | C78 | 92.4° | 151.6° |
| C84 | C82 | C83 | O21 | 47.8° | 94.9° |
| C82 | C84 | C85 | C86 | 123.2° | 120.0° |
| C82 | C84 | C85 | H135 | 118.3° | 120.0° |
| C82 | C84 | C86 | H135 | 118.8° | 120.0° |
| C82 | C84 | C85 | C87 | 170.1° | 65.4° |
| C82 | C84 | C85 | H136 | 69.4° | 174.6° |
| C82 | C84 | C85 | H137 | 49.5° | 54.6° |
| C82 | C84 | C86 | H138 | 180.0° | 55.6° |
| C82 | C84 | C86 | H139 | 60.0° | 175.7° |
| C82 | C84 | C86 | H140 | 60.0° | 64.3° |
| C84 | C82 | N29 | C78 | 149.2° | 88.4° |
| C84 | C82 | C83 | N30 | 132.2° | 85.1° |
| H134 | C82 | C83 | O21 | 166.9° | 145.0° |
| H134 | C82 | C84 | C85 | 59.3° | 55.7° |
| H134 | C82 | C84 | C86 | 63.3° | 175.7° |
| H134 | C82 | C84 | H135 | 177.7° | 64.3° |
| H134 | C82 | N29 | C78 | 28.0° | 31.6° |
| H134 | C82 | C83 | N30 | 13.1° | 35.0° |
| O21 | C83 | N30 | C88 | 3.2° | 4.7° |
| O21 | C83 | N30 | H144 | 176.8° | 175.4° |
| C85 | C84 | C86 | H135 | 118.4° | 120.0° |
| C84 | C85 | C87 | H136 | 120.6° | 120.0° |
| C84 | C85 | C87 | H137 | 120.6° | 120.0° |
| C84 | C85 | H136 | H137 | 118.2° | 120.0° |
| C85 | C84 | C86 | H138 | 57.2° | 64.3° |
| C85 | C84 | C86 | H139 | 177.2° | 55.7° |
| C85 | C84 | C86 | H140 | 62.8° | 175.7° |
| C84 | C85 | C87 | H141 | 180.0° | 63.9° |
| C84 | C85 | C87 | H142 | 60.0° | 176.1° |
| C84 | C85 | C87 | H143 | 60.0° | 56.2° |
| C86 | C84 | C85 | C87 | 66.8° | 174.6° |
| C86 | C84 | C85 | H136 | 53.8° | 54.6° |
| C86 | C84 | C85 | H137 | 172.7° | 65.4° |
| C84 | C86 | H138 | H139 | 120.0° | 120.0° |
| C84 | C86 | H138 | H140 | 120.0° | 120.0° |
| C84 | C86 | H139 | H140 | 120.0° | 119.9° |
| H135 | C84 | C85 | C87 | 51.8° | 54.6° |
| H135 | C84 | C85 | H136 | 172.4° | 65.4° |
| H135 | C84 | C85 | H137 | 68.8° | 174.6° |
| H135 | C84 | C86 | H138 | 61.2° | 175.7° |
| H135 | C84 | C86 | H139 | 58.8° | 64.3° |
| H135 | C84 | C86 | H140 | 178.7° | 55.7° |
| C87 | C85 | H136 | H137 | 118.2° | 120.0° |
| C85 | C87 | H141 | H142 | 120.0° | 120.1° |
| C85 | C87 | H141 | H143 | 120.0° | 120.0° |
| C85 | C87 | H142 | H143 | 120.0° | 120.0° |
| H136 | C85 | C87 | H141 | 59.4° | 56.2° |
| H136 | C85 | C87 | H142 | 179.4° | 63.9° |
| H136 | C85 | C87 | H143 | 60.6° | 176.2° |
| H137 | C85 | C87 | H141 | 59.4° | 176.2° |
| H137 | C85 | C87 | H142 | 60.5° | 56.1° |
| H137 | C85 | C87 | H143 | 179.4° | 63.8° |
| H138 | C86 | H139 | H140 | 120.0° | 120.0° |
| H141 | C87 | H142 | H143 | 120.0° | 119.9° |
| C88 | N30 | H144 | C83 | 180.0° | 180.0° |
| N30 | C88 | C89 | C90 | 120.8° | 120.0° |
| N30 | C88 | C89 | H145 | 117.8° | 119.9° |
| N30 | C88 | C90 | H145 | 118.6° | 119.9° |
| N30 | C88 | C89 | O22 | 111.8° | 0.0° |
| N30 | C88 | C90 | C91 | 52.5° | 65.0° |
| N30 | C88 | C90 | H146 | 67.9° | 55.0° |
| N30 | C88 | C90 | H147 | 173.0° | 175.0° |
| N30 | C88 | C89 | N34 | 70.2° | 180.0° |
| H144 | N30 | C88 | C89 | 90.9° | 95.0° |
| H144 | N30 | C88 | C90 | 34.1° | 25.0° |
| H144 | N30 | C88 | H145 | 152.0° | 145.0° |
| C89 | C88 | C90 | H145 | 121.3° | 120.0° |
| C88 | C89 | O22 | N34 | 178.0° | 180.0° |
| C89 | C88 | C90 | C91 | 172.7° | 175.0° |
| C89 | C88 | C90 | H146 | 52.2° | 65.0° |
| C89 | C88 | C90 | H147 | 66.9° | 55.0° |
| C88 | C89 | N34 | C94 | 174.8° | 180.0° |
| C88 | C89 | N34 | H157 | 5.2° | 0.0° |
| C89 | C88 | N30 | C83 | 89.2° | 85.0° |
| C90 | C88 | C89 | O22 | 9.1° | 120.0° |
| C88 | C90 | C91 | H146 | 120.5° | 120.0° |
| C88 | C90 | C91 | H147 | 120.5° | 120.0° |
| C88 | C90 | H146 | H147 | 118.6° | 120.0° |
| C88 | C90 | C91 | C92 | 54.5° | 180.0° |
| C88 | C90 | C91 | H148 | 65.9° | 60.0° |
| C88 | C90 | C91 | H149 | 174.9° | 60.0° |
| C90 | C88 | N30 | C83 | 145.9° | 155.0° |
| C90 | C88 | C89 | N34 | 169.0° | 60.0° |
| H145 | C88 | C89 | O22 | 130.4° | 120.0° |
| H145 | C88 | C90 | C91 | 66.0° | 54.9° |
| H145 | C88 | C90 | H146 | 173.5° | 175.0° |
| H145 | C88 | C90 | H147 | 54.5° | 65.0° |
| H145 | C88 | N30 | C83 | 28.0° | 35.0° |
| H145 | C88 | C89 | N34 | 47.7° | 60.1° |
| O22 | C89 | N34 | C94 | 7.2° | 0.0° |
| O22 | C89 | N34 | H157 | 172.8° | 180.0° |
| C91 | C90 | H146 | H147 | 118.6° | 120.0° |
| C90 | C91 | C92 | H148 | 120.4° | 120.0° |
| C90 | C91 | C92 | H149 | 120.4° | 120.0° |
| C90 | C91 | H148 | H149 | 118.8° | 120.0° |
| C90 | C91 | C92 | N31 | 60.4° | 180.0° |
| C90 | C91 | C92 | H150 | 60.0° | 60.0° |
| C90 | C91 | C92 | H151 | 179.3° | 60.1° |
| H146 | C90 | C91 | C92 | 174.9° | 60.0° |
| H146 | C90 | C91 | H148 | 54.5° | 180.0° |
| H146 | C90 | C91 | H149 | 64.7° | 59.9° |
| H147 | C90 | C91 | C92 | 66.0° | 60.0° |
| H147 | C90 | C91 | H148 | 173.6° | 59.9° |
| H147 | C90 | C91 | H149 | 54.4° | 180.0° |
| C92 | C91 | H148 | H149 | 118.7° | 120.0° |
| C91 | C92 | N31 | H150 | 120.3° | 120.0° |
| C91 | C92 | N31 | H151 | 120.3° | 120.0° |
| C91 | C92 | H150 | H151 | 119.0° | 120.0° |
| C91 | C92 | N31 | C93 | 76.3° | 180.0° |
| C91 | C92 | N31 | H152 | 103.7° | 0.0° |
| H148 | C91 | C92 | N31 | 179.2° | 60.0° |
| H148 | C91 | C92 | H150 | 60.4° | 180.0° |
| H148 | C91 | C92 | H151 | 58.9° | 60.0° |
| H149 | C91 | C92 | N31 | 60.1° | 60.0° |
| H149 | C91 | C92 | H150 | 179.6° | 60.0° |
| H149 | C91 | C92 | H151 | 60.2° | 180.0° |
| N31 | C92 | H150 | H151 | 119.0° | 120.0° |
| C92 | N31 | C93 | H152 | 180.0° | 180.0° |
| C92 | N31 | C93 | N32 | 179.8° | 0.0° |
| C92 | N31 | C93 | N33 | 1.0° | 180.0° |
| H150 | C92 | N31 | C93 | 163.4° | 60.0° |
| H150 | C92 | N31 | H152 | 16.6° | 120.0° |
| H151 | C92 | N31 | C93 | 44.0° | 60.1° |
| H151 | C92 | N31 | H152 | 136.0° | 120.0° |
| N31 | C93 | N32 | N33 | 179.2° | 180.0° |
| N31 | C93 | N32 | H153 | 179.1° | 0.1° |
| N31 | C93 | N32 | H154 | 0.9° | 180.0° |
| N31 | C93 | N33 | H155 | 179.1° | 0.0° |
| N31 | C93 | N33 | H156 | 0.9° | 179.9° |
| H152 | N31 | C93 | N32 | 0.1° | 180.0° |
| H152 | N31 | C93 | N33 | 179.0° | 0.0° |
| C93 | N32 | H153 | H154 | 180.0° | 179.9° |
| N32 | C93 | N33 | H155 | 0.0° | 179.9° |
| N32 | C93 | N33 | H156 | 180.0° | 0.0° |
| N33 | C93 | N32 | H153 | 0.0° | 179.9° |
| N33 | C93 | N32 | H154 | 180.0° | 0.0° |
| C93 | N33 | H155 | H156 | 180.0° | 179.9° |
| C94 | N34 | H157 | C89 | 180.0° | 180.0° |
| N34 | C94 | C95 | C96 | 124.1° | 119.9° |
| N34 | C94 | C95 | H158 | 119.9° | 120.0° |
| N34 | C94 | C96 | H158 | 121.8° | 120.0° |
| N34 | C94 | C95 | O23 | 138.4° | 0.1° |
| N34 | C94 | C95 | O24 | 163.8° | 180.0° |
| N34 | C94 | C96 | C97 | 50.1° | 180.0° |
| N34 | C94 | C96 | C98 | 172.8° | 60.0° |
| N34 | C94 | C96 | H159 | 69.0° | 60.0° |
| H157 | N34 | C94 | C95 | 8.7° | 95.0° |
| H157 | N34 | C94 | C96 | 127.6° | 25.0° |
| H157 | N34 | C94 | H158 | 110.9° | 145.0° |
| C95 | C94 | C96 | H158 | 116.0° | 120.0° |
| C94 | C95 | O23 | O24 | 78.9° | 180.0° |
| C95 | C94 | C96 | C97 | 72.1° | 60.0° |
| C95 | C94 | C96 | C98 | 50.6° | 180.0° |
| C95 | C94 | C96 | H159 | 168.8° | 60.0° |
| C94 | C95 | O24 | H166 | 90.0° | 179.9° |
| C95 | C94 | N34 | C89 | 171.3° | 85.0° |
| C96 | C94 | C95 | O23 | 97.5° | 120.0° |
| C96 | C94 | C95 | O24 | 39.7° | 60.0° |
| C94 | C96 | C97 | C98 | 122.8° | 120.0° |
| C94 | C96 | C97 | H159 | 118.9° | 120.0° |
| C94 | C96 | C98 | H159 | 118.1° | 120.0° |
| C94 | C96 | C97 | H160 | 180.0° | 60.0° |
| C94 | C96 | C97 | H161 | 60.0° | 180.0° |
| C94 | C96 | C97 | H162 | 60.0° | 60.0° |
| C94 | C96 | C98 | H163 | 180.0° | 60.0° |
| C94 | C96 | C98 | H164 | 60.0° | 180.0° |
| C94 | C96 | C98 | H165 | 60.0° | 60.0° |
| C96 | C94 | N34 | C89 | 52.4° | 155.0° |
| H158 | C94 | C95 | O23 | 18.4° | 119.9° |
| H158 | C94 | C95 | O24 | 76.3° | 60.0° |
| H158 | C94 | C96 | C97 | 171.9° | 60.0° |
| H158 | C94 | C96 | C98 | 65.4° | 60.0° |
| H158 | C94 | C96 | H159 | 52.8° | 180.0° |
| H158 | C94 | N34 | C89 | 69.1° | 35.0° |
| O23 | C95 | O24 | H166 | 90.0° | 0.0° |
| C97 | C96 | C98 | H159 | 118.4° | 120.0° |
| C96 | C97 | H160 | H161 | 120.0° | 120.0° |
| C96 | C97 | H160 | H162 | 120.0° | 120.1° |
| C96 | C97 | H161 | H162 | 120.0° | 120.0° |
| C97 | C96 | C98 | H163 | 56.5° | 180.0° |
| C97 | C96 | C98 | H164 | 63.5° | 60.0° |
| C97 | C96 | C98 | H165 | 176.5° | 60.0° |
| C98 | C96 | C97 | H160 | 57.2° | 60.0° |
| C98 | C96 | C97 | H161 | 177.2° | 60.0° |
| C98 | C96 | C97 | H162 | 62.9° | 180.0° |
| C96 | C98 | H163 | H164 | 120.0° | 120.0° |
| C96 | C98 | H163 | H165 | 120.0° | 120.0° |
| C96 | C98 | H164 | H165 | 120.0° | 120.0° |
| H159 | C96 | C97 | H160 | 61.1° | NaN° |
| H159 | C96 | C97 | H161 | 58.9° | 60.0° |
| H159 | C96 | C97 | H162 | 178.9° | 60.0° |
| H159 | C96 | C98 | H163 | 61.9° | 60.0° |
| H159 | C96 | C98 | H164 | 178.2° | 60.0° |
| H159 | C96 | C98 | H165 | 58.1° | 180.0° |
| H160 | C97 | H161 | H162 | 120.0° | 120.0° |
| H163 | C98 | H164 | H165 | 120.0° | 120.0° |
