PRD_000163
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | doub | 1.21Å | 1.34Å | |
| C1 | C2 | sing | 1.51Å | 1.58Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| N1 | C3 | sing | 1.47Å | 1.53Å | |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C3 | C4 | sing | 1.51Å | 1.53Å | |
| C3 | C5 | sing | 1.53Å | 1.49Å | |
| C3 | C6 | sing | 1.53Å | 1.54Å | |
| C4 | O2 | doub | 1.21Å | 1.26Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | 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 | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| N2 | C7 | sing | 1.47Å | 1.56Å | |
| N2 | C11 | sing | 1.47Å | 1.42Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C7 | C9 | sing | 1.54Å | 1.53Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | O3 | doub | 1.21Å | 1.17Å | |
| C9 | C10 | sing | 1.55Å | 1.54Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | C11 | sing | 1.55Å | 1.50Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| N3 | C12 | sing | 1.46Å | 1.48Å | |
| N3 | H18 | sing | 0.97Å | 1.00Å | |
| C12 | C13 | sing | 1.51Å | 1.53Å | |
| C12 | C14 | sing | 1.53Å | 1.58Å | |
| C12 | C15 | sing | 1.53Å | 1.47Å | |
| C13 | O4 | doub | 1.21Å | 1.41Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| N4 | C16 | sing | 1.47Å | 1.52Å | |
| N4 | H25 | sing | 0.97Å | 1.00Å | |
| C16 | C17 | sing | 1.51Å | 1.53Å | |
| C16 | C18 | sing | 1.53Å | 1.50Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C17 | O5 | doub | 1.21Å | 1.24Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| N5 | C19 | sing | 1.46Å | 1.48Å | |
| N5 | H30 | sing | 0.97Å | 1.00Å | |
| C19 | C20 | sing | 1.51Å | 1.50Å | |
| C19 | C21 | sing | 1.53Å | 1.51Å | |
| C19 | C22 | sing | 1.53Å | 1.53Å | |
| C20 | O6 | doub | 1.21Å | 1.37Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C21 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C22 | H36 | sing | 1.09Å | 1.10Å | |
| N6 | C23 | sing | 1.46Å | 1.51Å | |
| N6 | H37 | sing | 0.97Å | 1.00Å | |
| C23 | C24 | sing | 1.51Å | 1.49Å | |
| C23 | C25 | sing | 1.53Å | 1.54Å | |
| C23 | H38 | sing | 1.09Å | 1.10Å | |
| C24 | O7 | doub | 1.21Å | 1.29Å | |
| C25 | H39 | sing | 1.09Å | 1.10Å | |
| C25 | H40 | sing | 1.09Å | 1.10Å | |
| C25 | H41 | sing | 1.09Å | 1.10Å | |
| N7 | C26 | sing | 1.47Å | 1.50Å | |
| N7 | H42 | sing | 0.97Å | 1.00Å | |
| C26 | C27 | sing | 1.51Å | 1.49Å | |
| C26 | C28 | sing | 1.53Å | 1.58Å | |
| C26 | H43 | sing | 1.09Å | 1.10Å | |
| C27 | O8 | doub | 1.21Å | 1.30Å | |
| C28 | C29 | sing | 1.53Å | 1.46Å | |
| C28 | H44 | sing | 1.09Å | 1.10Å | |
| C28 | H45 | sing | 1.09Å | 1.10Å | |
| C29 | C30 | sing | 1.51Å | 1.61Å | |
| C29 | H46 | sing | 1.09Å | 1.10Å | |
| C29 | H47 | sing | 1.09Å | 1.10Å | |
| C30 | O9 | doub | 1.21Å | 1.21Å | |
| C30 | N8 | sing | 1.35Å | 1.29Å | |
| N8 | H48 | sing | 0.97Å | 1.00Å | |
| N8 | H49 | sing | 0.97Å | 1.00Å | |
| N9 | C31 | sing | 1.47Å | 1.48Å | |
| N9 | H50 | sing | 0.97Å | 1.00Å | |
| C31 | C32 | sing | 1.51Å | 1.50Å | |
| C31 | C33 | sing | 1.53Å | 1.45Å | |
| C31 | C34 | sing | 1.53Å | 1.56Å | |
| C32 | O10 | doub | 1.21Å | 1.41Å | |
| C33 | H51 | sing | 1.09Å | 1.10Å | |
| C33 | H52 | sing | 1.09Å | 1.10Å | |
| C33 | H53 | sing | 1.09Å | 1.10Å | |
| C34 | H54 | sing | 1.09Å | 1.10Å | |
| C34 | H55 | sing | 1.09Å | 1.10Å | |
| C34 | H56 | sing | 1.09Å | 1.10Å | |
| N10 | C35 | sing | 1.47Å | 1.48Å | |
| N10 | H57 | sing | 0.97Å | 1.00Å | |
| C35 | C36 | sing | 1.51Å | 1.45Å | |
| C35 | C37 | sing | 1.53Å | 1.55Å | |
| C35 | H58 | sing | 1.09Å | 1.10Å | |
| C36 | O11 | doub | 1.21Å | 1.30Å | |
| C37 | C38 | sing | 1.53Å | 1.52Å | |
| C37 | C39 | sing | 1.53Å | 1.46Å | |
| C37 | H59 | sing | 1.09Å | 1.10Å | |
| C38 | H60 | sing | 1.09Å | 1.10Å | |
| C38 | H61 | sing | 1.09Å | 1.10Å | |
| C38 | H62 | sing | 1.09Å | 1.10Å | |
| C39 | H63 | sing | 1.09Å | 1.10Å | |
| C39 | H64 | sing | 1.09Å | 1.10Å | |
| C39 | H65 | sing | 1.09Å | 1.10Å | |
| N11 | C40 | sing | 1.46Å | 1.50Å | |
| N11 | H66 | sing | 0.97Å | 1.00Å | |
| C40 | C41 | sing | 1.51Å | 1.51Å | |
| C40 | C42 | sing | 1.53Å | 1.52Å | |
| C40 | C43 | sing | 1.53Å | 1.50Å | |
| C41 | O12 | doub | 1.21Å | 1.27Å | |
| C42 | H67 | sing | 1.09Å | 1.10Å | |
| C42 | H68 | sing | 1.09Å | 1.10Å | |
| C42 | H69 | sing | 1.09Å | 1.10Å | |
| C43 | H70 | sing | 1.09Å | 1.10Å | |
| C43 | H71 | sing | 1.09Å | 1.10Å | |
| C43 | H72 | sing | 1.09Å | 1.10Å | |
| N12 | C44 | sing | 1.47Å | 1.49Å | |
| N12 | H73 | sing | 0.97Å | 1.00Å | |
| C44 | C45 | sing | 1.51Å | 1.49Å | |
| C44 | H74 | sing | 1.09Å | 1.10Å | |
| C44 | H75 | sing | 1.09Å | 1.10Å | |
| C45 | O13 | doub | 1.21Å | 1.31Å | |
| N13 | C46 | sing | 1.47Å | 1.55Å | |
| N13 | H76 | sing | 0.97Å | 1.00Å | |
| C46 | C47 | sing | 1.51Å | 1.47Å | |
| C46 | C48 | sing | 1.53Å | 1.54Å | |
| C46 | H77 | sing | 1.09Å | 1.10Å | |
| C47 | O14 | doub | 1.21Å | 1.33Å | |
| C48 | C49 | sing | 1.53Å | 1.51Å | |
| C48 | H78 | sing | 1.09Å | 1.10Å | |
| C48 | H79 | sing | 1.09Å | 1.10Å | |
| C49 | C50 | sing | 1.53Å | 1.58Å | |
| C49 | C51 | sing | 1.53Å | 1.53Å | |
| C49 | H80 | sing | 1.09Å | 1.10Å | |
| C50 | H81 | sing | 1.09Å | 1.10Å | |
| C50 | H82 | sing | 1.09Å | 1.10Å | |
| C50 | H83 | sing | 1.09Å | 1.10Å | |
| C51 | H84 | sing | 1.09Å | 1.10Å | |
| C51 | H85 | sing | 1.09Å | 1.10Å | |
| C51 | H86 | sing | 1.09Å | 1.10Å | |
| N14 | C52 | sing | 1.47Å | 1.51Å | |
| N14 | H87 | sing | 0.97Å | 1.00Å | |
| C52 | C53 | sing | 1.51Å | 1.45Å | |
| C52 | C54 | sing | 1.53Å | 1.55Å | |
| C52 | C55 | sing | 1.53Å | 1.55Å | |
| C53 | O15 | doub | 1.21Å | 1.19Å | |
| C54 | H88 | sing | 1.09Å | 1.10Å | |
| C54 | 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 | |
| N15 | C56 | sing | 1.47Å | 1.48Å | |
| N15 | C60 | sing | 1.47Å | 1.49Å | |
| C56 | C57 | sing | 1.51Å | 1.51Å | |
| C56 | C58 | sing | 1.54Å | 1.50Å | |
| C56 | H94 | sing | 1.09Å | 1.10Å | |
| C57 | O16 | doub | 1.21Å | 1.28Å | |
| C58 | C59 | sing | 1.55Å | 1.59Å | |
| C58 | H95 | sing | 1.09Å | 1.10Å | |
| C58 | H96 | sing | 1.09Å | 1.10Å | |
| C59 | C60 | sing | 1.55Å | 1.47Å | |
| C59 | H97 | sing | 1.09Å | 1.10Å | |
| C59 | H98 | sing | 1.09Å | 1.10Å | |
| C60 | H99 | sing | 1.09Å | 1.10Å | |
| C60 | H100 | sing | 1.09Å | 1.10Å | |
| N16 | C61 | sing | 1.46Å | 1.54Å | |
| N16 | H101 | sing | 0.97Å | 1.00Å | |
| C61 | C62 | sing | 1.51Å | 1.49Å | |
| C61 | C63 | sing | 1.53Å | 1.63Å | |
| C61 | H102 | sing | 1.09Å | 1.10Å | |
| C62 | O17 | doub | 1.21Å | 1.31Å | |
| C63 | C64 | sing | 1.53Å | 1.57Å | |
| C63 | C65 | sing | 1.53Å | 1.55Å | |
| C63 | H103 | sing | 1.09Å | 1.10Å | |
| 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 | |
| C65 | H109 | sing | 1.09Å | 1.10Å | |
| N17 | C66 | sing | 1.46Å | 1.40Å | |
| N17 | H110 | sing | 0.97Å | 1.00Å | |
| C66 | C67 | sing | 1.51Å | 1.54Å | |
| C66 | C68 | sing | 1.53Å | 1.58Å | |
| C66 | C69 | sing | 1.53Å | 1.50Å | |
| C67 | O18 | doub | 1.21Å | 1.27Å | |
| C68 | H111 | sing | 1.09Å | 1.10Å | |
| C68 | H112 | sing | 1.09Å | 1.10Å | |
| C68 | H113 | sing | 1.09Å | 1.10Å | |
| C69 | H114 | sing | 1.09Å | 1.10Å | |
| C69 | H115 | sing | 1.09Å | 1.10Å | |
| C69 | H116 | sing | 1.09Å | 1.10Å | |
| N18 | C70 | sing | 1.46Å | 1.42Å | |
| N18 | H117 | sing | 0.97Å | 1.00Å | |
| C70 | C71 | sing | 1.51Å | 1.53Å | |
| C70 | C72 | sing | 1.53Å | 1.62Å | |
| C70 | C73 | sing | 1.53Å | 1.54Å | |
| C71 | O19 | doub | 1.21Å | 1.23Å | |
| C72 | H118 | sing | 1.09Å | 1.10Å | |
| C72 | H119 | sing | 1.09Å | 1.10Å | |
| C72 | H120 | sing | 1.09Å | 1.10Å | |
| C73 | H121 | sing | 1.09Å | 1.10Å | |
| C73 | H122 | sing | 1.09Å | 1.10Å | |
| C73 | H123 | sing | 1.09Å | 1.10Å | |
| N19 | C74 | sing | 1.47Å | 1.48Å | |
| N19 | H124 | sing | 0.97Å | 1.00Å | |
| C74 | C75 | sing | 1.51Å | 1.48Å | |
| C74 | C76 | sing | 1.53Å | 1.45Å | |
| C74 | H125 | sing | 1.09Å | 1.10Å | |
| C75 | O20 | doub | 1.21Å | 1.18Å | |
| C76 | C77 | sing | 1.53Å | 1.55Å | |
| C76 | H126 | sing | 1.09Å | 1.10Å | |
| C76 | H127 | sing | 1.09Å | 1.10Å | |
| C77 | C78 | sing | 1.51Å | 1.59Å | |
| C77 | H128 | sing | 1.09Å | 1.10Å | |
| C77 | H129 | sing | 1.09Å | 1.10Å | |
| C78 | O21 | doub | 1.21Å | 1.20Å | |
| C78 | O22 | sing | 1.34Å | 1.10Å | |
| O22 | H130 | sing | 0.97Å | 0.95Å | |
| N20 | C79 | sing | 1.47Å | 1.46Å | |
| N20 | H131 | sing | 0.97Å | 1.00Å | |
| C79 | C80 | sing | 1.51Å | 1.49Å | |
| C79 | C81 | sing | 1.53Å | 1.50Å | |
| C79 | H132 | sing | 1.09Å | 1.10Å | |
| C80 | O23 | doub | 1.21Å | 1.32Å | |
| C81 | C82 | sing | 1.53Å | 1.53Å | |
| C81 | H133 | sing | 1.09Å | 1.10Å | |
| C81 | H134 | sing | 1.09Å | 1.10Å | |
| C82 | C83 | sing | 1.51Å | 1.53Å | |
| C82 | H135 | sing | 1.09Å | 1.10Å | |
| C82 | H136 | sing | 1.09Å | 1.10Å | |
| C83 | O24 | doub | 1.21Å | 1.26Å | |
| C83 | N21 | sing | 1.35Å | 1.27Å | |
| N21 | H137 | sing | 0.97Å | 1.00Å | |
| N21 | H138 | sing | 0.97Å | 1.00Å | |
| N22 | C84 | sing | 1.47Å | 1.49Å | |
| N22 | H139 | sing | 0.97Å | 1.00Å | |
| C84 | C85 | sing | 1.53Å | 1.53Å | |
| C84 | C86 | sing | 1.53Å | 1.57Å | |
| C84 | H140 | sing | 1.09Å | 1.10Å | |
| C85 | O25 | sing | 1.43Å | 1.32Å | |
| C85 | H141 | sing | 1.09Å | 1.10Å | |
| C85 | H142 | sing | 1.09Å | 1.10Å | |
| O25 | H143 | sing | 0.97Å | 0.95Å | |
| C86 | C87 | sing | 1.51Å | 1.50Å | |
| C86 | H144 | sing | 1.09Å | 1.10Å | |
| C86 | H145 | sing | 1.09Å | 1.10Å | |
| C87 | C88 | doub | 1.38Å | 1.43Å | Aromatic |
| C87 | C89 | sing | 1.38Å | 1.44Å | Aromatic |
| C88 | C90 | sing | 1.38Å | 1.41Å | Aromatic |
| C88 | H146 | sing | 1.08Å | 1.08Å | |
| C89 | C91 | doub | 1.38Å | 1.34Å | Aromatic |
| C89 | H147 | sing | 1.08Å | 1.08Å | |
| C90 | C92 | doub | 1.38Å | 1.41Å | Aromatic |
| C90 | H148 | sing | 1.08Å | 1.08Å | |
| C91 | C92 | sing | 1.38Å | 1.44Å | Aromatic |
| C91 | H149 | sing | 1.08Å | 1.08Å | |
| C92 | H150 | sing | 1.08Å | 1.08Å | |
| C1 | N1 | sing | 1.35Å | 1.14Å | |
| C4 | N2 | sing | 1.35Å | 1.25Å | |
| C8 | N3 | sing | 1.35Å | 1.28Å | |
| C13 | N4 | sing | 1.35Å | 1.17Å | |
| C17 | N5 | sing | 1.35Å | 1.23Å | |
| C20 | N6 | sing | 1.35Å | 1.28Å | |
| C27 | N9 | sing | 1.35Å | 1.25Å | |
| C32 | N10 | sing | 1.35Å | 1.26Å | |
| C36 | N11 | sing | 1.35Å | 1.41Å | |
| C41 | N12 | sing | 1.35Å | 1.31Å | |
| C47 | N14 | sing | 1.35Å | 1.33Å | |
| C53 | N15 | sing | 1.35Å | 1.32Å | |
| C62 | N17 | sing | 1.35Å | 1.32Å | |
| C67 | N18 | sing | 1.35Å | 1.34Å | |
| C71 | N19 | sing | 1.35Å | 1.35Å | |
| C80 | N22 | sing | 1.35Å | 1.32Å | |
| C24 | N7 | sing | 1.35Å | 1.32Å | |
| C45 | N13 | sing | 1.35Å | 1.22Å | |
| C57 | N16 | sing | 1.35Å | 1.21Å | |
| C75 | N20 | sing | 1.35Å | 1.41Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 106.8° | 120.0° |
| O1 | C1 | N1 | 121.8° | 120.0° |
| C1 | C2 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | H3 | 109.5° | 109.5° |
| C2 | C1 | N1 | 125.9° | 120.0° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | H3 | 109.4° | 109.4° |
| H2 | C2 | H3 | 109.5° | 109.4° |
| C3 | N1 | H4 | 117.2° | 120.1° |
| N1 | C3 | C4 | 109.1° | 109.4° |
| N1 | C3 | C5 | 109.1° | 109.5° |
| N1 | C3 | C6 | 109.8° | 109.5° |
| C3 | N1 | C1 | 125.6° | 119.9° |
| H4 | N1 | C1 | 117.2° | 120.0° |
| C4 | C3 | C5 | 111.0° | 109.4° |
| C4 | C3 | C6 | 111.6° | 109.5° |
| C3 | C4 | O2 | 113.1° | 120.0° |
| C3 | C4 | N2 | 123.7° | 120.0° |
| C5 | C3 | C6 | 106.3° | 109.5° |
| C3 | C5 | H5 | 109.5° | 109.4° |
| C3 | C5 | H6 | 109.4° | 109.5° |
| C3 | C5 | H7 | 109.5° | 109.5° |
| C3 | C6 | H8 | 109.5° | 109.5° |
| C3 | C6 | H9 | 109.5° | 109.5° |
| C3 | C6 | H10 | 109.5° | 109.5° |
| O2 | C4 | N2 | 123.2° | 120.0° |
| H5 | C5 | H6 | 109.5° | 109.4° |
| H5 | C5 | H7 | 109.5° | 109.5° |
| H6 | C5 | H7 | 109.5° | 109.5° |
| H8 | C6 | H9 | 109.4° | 109.4° |
| H8 | C6 | H10 | 109.5° | 109.5° |
| H9 | C6 | H10 | 109.5° | 109.5° |
| C7 | N2 | C11 | 110.1° | 108.6° |
| N2 | C7 | C8 | 112.2° | 109.9° |
| N2 | C7 | C9 | 102.2° | 107.3° |
| N2 | C7 | H11 | 108.6° | 109.8° |
| C7 | N2 | C4 | 119.2° | 125.7° |
| N2 | C11 | C10 | 107.8° | 104.7° |
| N2 | C11 | H16 | 109.9° | 110.4° |
| N2 | C11 | H17 | 109.9° | 110.3° |
| C11 | N2 | C4 | 130.5° | 125.7° |
| C8 | C7 | C9 | 115.6° | 109.9° |
| C8 | C7 | H11 | 108.9° | 109.9° |
| C7 | C8 | O3 | 116.6° | 120.0° |
| C7 | C8 | N3 | 120.3° | 120.0° |
| C9 | C7 | H11 | 109.0° | 110.1° |
| C7 | C9 | C10 | 107.5° | 103.0° |
| C7 | C9 | H12 | 109.9° | 110.7° |
| C7 | C9 | H13 | 110.0° | 110.7° |
| O3 | C8 | N3 | 123.1° | 119.9° |
| C10 | C9 | H12 | 110.0° | 110.7° |
| C10 | C9 | H13 | 109.9° | 110.7° |
| C9 | C10 | C11 | 103.1° | 101.5° |
| C9 | C10 | H14 | 111.0° | 111.0° |
| C9 | C10 | H15 | 111.0° | 111.0° |
| H12 | C9 | H13 | 109.5° | 110.7° |
| C11 | C10 | H14 | 111.0° | 111.2° |
| C11 | C10 | H15 | 111.1° | 110.9° |
| C10 | C11 | H16 | 109.9° | 110.5° |
| C10 | C11 | H17 | 109.9° | 110.4° |
| H14 | C10 | H15 | 109.5° | 110.9° |
| H16 | C11 | H17 | 109.5° | 110.4° |
| C12 | N3 | H18 | 118.9° | 120.0° |
| N3 | C12 | C13 | 100.1° | 109.4° |
| N3 | C12 | C14 | 107.4° | 109.5° |
| N3 | C12 | C15 | 110.2° | 109.5° |
| C12 | N3 | C8 | 122.2° | 120.0° |
| H18 | N3 | C8 | 118.9° | 120.0° |
| C13 | C12 | C14 | 106.3° | 109.5° |
| C13 | C12 | C15 | 124.3° | 109.5° |
| C12 | C13 | O4 | 109.3° | 120.0° |
| C12 | C13 | N4 | 127.6° | 120.0° |
| C14 | C12 | C15 | 107.4° | 109.5° |
| C12 | C14 | H19 | 109.5° | 109.4° |
| C12 | C14 | H20 | 109.4° | 109.4° |
| C12 | C14 | H21 | 109.4° | 109.5° |
| C12 | C15 | H22 | 109.5° | 109.5° |
| C12 | C15 | H23 | 109.4° | 109.5° |
| C12 | C15 | H24 | 109.5° | 109.5° |
| O4 | C13 | N4 | 121.4° | 120.0° |
| H19 | C14 | H20 | 109.5° | 109.4° |
| H19 | C14 | H21 | 109.5° | 109.5° |
| H20 | C14 | H21 | 109.5° | 109.5° |
| H22 | C15 | H23 | 109.5° | 109.5° |
| H22 | C15 | H24 | 109.5° | 109.5° |
| H23 | C15 | H24 | 109.5° | 109.5° |
| C16 | N4 | H25 | 117.4° | 120.0° |
| N4 | C16 | C17 | 110.7° | 109.5° |
| N4 | C16 | C18 | 110.1° | 109.5° |
| N4 | C16 | H26 | 106.8° | 109.4° |
| C16 | N4 | C13 | 125.2° | 120.0° |
| H25 | N4 | C13 | 117.4° | 120.0° |
| C17 | C16 | C18 | 115.1° | 109.5° |
| C17 | C16 | H26 | 106.7° | 109.5° |
| C16 | C17 | O5 | 114.5° | 120.0° |
| C16 | C17 | N5 | 121.2° | 120.0° |
| C18 | C16 | H26 | 107.0° | 109.5° |
| C16 | C18 | H27 | 109.5° | 109.5° |
| C16 | C18 | H28 | 109.5° | 109.5° |
| C16 | C18 | H29 | 109.5° | 109.5° |
| O5 | C17 | N5 | 124.1° | 120.0° |
| H27 | C18 | H28 | 109.5° | 109.4° |
| H27 | C18 | H29 | 109.5° | 109.4° |
| H28 | C18 | H29 | 109.4° | 109.4° |
| C19 | N5 | H30 | 116.7° | 120.0° |
| N5 | C19 | C20 | 105.1° | 109.5° |
| N5 | C19 | C21 | 108.2° | 109.5° |
| N5 | C19 | C22 | 105.4° | 109.5° |
| C19 | N5 | C17 | 126.5° | 120.0° |
| H30 | N5 | C17 | 116.7° | 120.0° |
| C20 | C19 | C21 | 105.6° | 109.5° |
| C20 | C19 | C22 | 119.1° | 109.4° |
| C19 | C20 | O6 | 111.3° | 120.0° |
| C19 | C20 | N6 | 127.1° | 120.0° |
| C21 | C19 | C22 | 112.8° | 109.5° |
| C19 | C21 | H31 | 109.5° | 109.4° |
| C19 | C21 | H32 | 109.5° | 109.5° |
| C19 | C21 | H33 | 109.5° | 109.4° |
| C19 | C22 | H34 | 109.5° | 109.5° |
| C19 | C22 | H35 | 109.5° | 109.5° |
| C19 | C22 | H36 | 109.5° | 109.4° |
| O6 | C20 | N6 | 120.5° | 120.0° |
| H31 | C21 | H32 | 109.5° | 109.5° |
| H31 | C21 | H33 | 109.5° | 109.5° |
| H32 | C21 | H33 | 109.5° | 109.5° |
| H34 | C22 | H35 | 109.5° | 109.5° |
| H34 | C22 | H36 | 109.5° | 109.4° |
| H35 | C22 | H36 | 109.5° | 109.5° |
| C23 | N6 | H37 | 118.2° | 120.0° |
| N6 | C23 | C24 | 108.2° | 109.4° |
| N6 | C23 | C25 | 106.4° | 109.5° |
| N6 | C23 | H38 | 108.9° | 109.5° |
| C23 | N6 | C20 | 123.7° | 120.0° |
| H37 | N6 | C20 | 118.1° | 120.0° |
| C24 | C23 | C25 | 115.4° | 109.5° |
| C24 | C23 | H38 | 109.3° | 109.5° |
| C23 | C24 | O7 | 116.6° | 120.0° |
| C23 | C24 | N7 | 118.8° | 120.0° |
| C25 | C23 | H38 | 108.5° | 109.5° |
| C23 | C25 | H39 | 109.5° | 109.5° |
| C23 | C25 | H40 | 109.5° | 109.5° |
| C23 | C25 | H41 | 109.4° | 109.5° |
| O7 | C24 | N7 | 124.7° | 120.0° |
| H39 | C25 | H40 | 109.5° | 109.4° |
| H39 | C25 | H41 | 109.5° | 109.5° |
| H40 | C25 | H41 | 109.4° | 109.5° |
| C26 | N7 | H42 | 121.6° | 120.0° |
| N7 | C26 | C27 | 111.4° | 109.5° |
| N7 | C26 | C28 | 108.7° | 109.5° |
| N7 | C26 | H43 | 108.5° | 109.4° |
| C26 | N7 | C24 | 116.7° | 120.0° |
| H42 | N7 | C24 | 121.7° | 120.0° |
| C27 | C26 | C28 | 112.1° | 109.5° |
| C27 | C26 | H43 | 108.5° | 109.4° |
| C26 | C27 | O8 | 115.3° | 120.0° |
| C26 | C27 | N9 | 123.8° | 120.0° |
| C28 | C26 | H43 | 107.5° | 109.5° |
| C26 | C28 | C29 | 112.7° | 109.5° |
| C26 | C28 | H44 | 108.7° | 109.4° |
| C26 | C28 | H45 | 108.7° | 109.5° |
| O8 | C27 | N9 | 120.9° | 120.1° |
| C29 | C28 | H44 | 108.7° | 109.5° |
| C29 | C28 | H45 | 108.7° | 109.5° |
| C28 | C29 | C30 | 115.3° | 109.5° |
| C28 | C29 | H46 | 108.0° | 109.5° |
| C28 | C29 | H47 | 108.0° | 109.5° |
| H44 | C28 | H45 | 109.4° | 109.5° |
| C30 | C29 | H46 | 108.0° | 109.5° |
| C30 | C29 | H47 | 108.0° | 109.5° |
| C29 | C30 | O9 | 121.3° | 120.0° |
| C29 | C30 | N8 | 112.0° | 120.0° |
| H46 | C29 | H47 | 109.5° | 109.4° |
| O9 | C30 | N8 | 126.4° | 120.0° |
| C30 | N8 | H48 | 120.0° | 119.9° |
| C30 | N8 | H49 | 120.0° | 120.0° |
| H48 | N8 | H49 | 120.0° | 120.0° |
| C31 | N9 | H50 | 113.8° | 120.0° |
| N9 | C31 | C32 | 101.9° | 109.5° |
| N9 | C31 | C33 | 117.4° | 109.4° |
| N9 | C31 | C34 | 103.9° | 109.5° |
| C31 | N9 | C27 | 132.4° | 120.0° |
| H50 | N9 | C27 | 113.8° | 120.1° |
| C32 | C31 | C33 | 108.3° | 109.4° |
| C32 | C31 | C34 | 115.4° | 109.5° |
| C31 | C32 | O10 | 111.3° | 120.0° |
| C31 | C32 | N10 | 124.8° | 119.9° |
| C33 | C31 | C34 | 110.0° | 109.5° |
| C31 | C33 | H51 | 109.5° | 109.4° |
| C31 | C33 | H52 | 109.5° | 109.4° |
| C31 | C33 | H53 | 109.5° | 109.5° |
| C31 | C34 | H54 | 109.5° | 109.4° |
| C31 | C34 | H55 | 109.5° | 109.4° |
| C31 | C34 | H56 | 109.5° | 109.5° |
| O10 | C32 | N10 | 123.8° | 120.1° |
| H51 | C33 | H52 | 109.5° | 109.5° |
| H51 | C33 | H53 | 109.5° | 109.5° |
| H52 | C33 | H53 | 109.4° | 109.5° |
| H54 | C34 | H55 | 109.5° | 109.5° |
| H54 | C34 | H56 | 109.5° | 109.5° |
| H55 | C34 | H56 | 109.5° | 109.5° |
| C35 | N10 | H57 | 119.7° | 120.0° |
| N10 | C35 | C36 | 111.8° | 109.5° |
| N10 | C35 | C37 | 106.5° | 109.5° |
| N10 | C35 | H58 | 109.2° | 109.4° |
| C35 | N10 | C32 | 120.7° | 120.0° |
| H57 | N10 | C32 | 119.6° | 120.1° |
| C36 | C35 | C37 | 111.1° | 109.5° |
| C36 | C35 | H58 | 109.7° | 109.5° |
| C35 | C36 | O11 | 126.3° | 120.0° |
| C35 | C36 | N11 | 120.0° | 120.0° |
| C37 | C35 | H58 | 108.4° | 109.5° |
| C35 | C37 | C38 | 104.2° | 109.5° |
| C35 | C37 | C39 | 104.8° | 109.4° |
| C35 | C37 | H59 | 111.8° | 109.4° |
| O11 | C36 | N11 | 113.5° | 120.0° |
| C38 | C37 | C39 | 110.2° | 109.5° |
| C38 | C37 | H59 | 112.1° | 109.5° |
| C37 | C38 | H60 | 109.5° | 109.5° |
| C37 | C38 | H61 | 109.5° | 109.4° |
| C37 | C38 | H62 | 109.5° | 109.5° |
| C39 | C37 | H59 | 113.1° | 109.5° |
| C37 | C39 | H63 | 109.5° | 109.5° |
| C37 | C39 | H64 | 109.5° | 109.5° |
| C37 | C39 | H65 | 109.5° | 109.5° |
| H60 | C38 | H61 | 109.5° | 109.5° |
| H60 | C38 | H62 | 109.5° | 109.5° |
| H61 | C38 | H62 | 109.4° | 109.5° |
| H63 | C39 | H64 | 109.5° | 109.5° |
| H63 | C39 | H65 | 109.4° | 109.4° |
| H64 | C39 | H65 | 109.5° | 109.4° |
| C40 | N11 | H66 | 115.6° | 120.0° |
| N11 | C40 | C41 | 104.2° | 109.5° |
| N11 | C40 | C42 | 107.7° | 109.5° |
| N11 | C40 | C43 | 109.6° | 109.5° |
| C40 | N11 | C36 | 128.7° | 120.0° |
| H66 | N11 | C36 | 115.7° | 119.9° |
| C41 | C40 | C42 | 108.4° | 109.4° |
| C41 | C40 | C43 | 116.4° | 109.5° |
| C40 | C41 | O12 | 116.2° | 120.0° |
| C40 | C41 | N12 | 124.4° | 120.0° |
| C42 | C40 | C43 | 110.1° | 109.5° |
| C40 | C42 | H67 | 109.5° | 109.5° |
| C40 | C42 | H68 | 109.5° | 109.4° |
| C40 | C42 | H69 | 109.5° | 109.5° |
| C40 | C43 | H70 | 109.5° | 109.5° |
| C40 | C43 | H71 | 109.5° | 109.4° |
| C40 | C43 | H72 | 109.5° | 109.5° |
| O12 | C41 | N12 | 118.7° | 120.0° |
| H67 | C42 | H68 | 109.5° | 109.5° |
| H67 | C42 | H69 | 109.5° | 109.5° |
| H68 | C42 | H69 | 109.5° | 109.5° |
| H70 | C43 | H71 | 109.5° | 109.5° |
| H70 | C43 | H72 | 109.4° | 109.5° |
| H71 | C43 | H72 | 109.5° | 109.5° |
| C44 | N12 | H73 | 118.8° | 120.1° |
| N12 | C44 | C45 | 109.4° | 109.4° |
| N12 | C44 | H74 | 109.5° | 109.5° |
| N12 | C44 | H75 | 109.5° | 109.5° |
| C44 | N12 | C41 | 122.4° | 119.9° |
| H73 | N12 | C41 | 118.8° | 120.0° |
| C45 | C44 | H74 | 109.5° | 109.5° |
| C45 | C44 | H75 | 109.4° | 109.5° |
| C44 | C45 | O13 | 121.1° | 120.0° |
| C44 | C45 | N13 | 123.9° | 120.0° |
| H74 | C44 | H75 | 109.5° | 109.5° |
| O13 | C45 | N13 | 114.9° | 120.0° |
| C46 | N13 | H76 | 115.2° | 120.0° |
| N13 | C46 | C47 | 104.1° | 109.5° |
| N13 | C46 | C48 | 116.6° | 109.5° |
| N13 | C46 | H77 | 108.9° | 109.4° |
| C46 | N13 | C45 | 129.5° | 120.0° |
| H76 | N13 | C45 | 115.2° | 120.0° |
| C47 | C46 | C48 | 108.2° | 109.5° |
| C47 | C46 | H77 | 109.9° | 109.5° |
| C46 | C47 | O14 | 114.1° | 120.0° |
| C46 | C47 | N14 | 127.6° | 120.0° |
| C48 | C46 | H77 | 109.0° | 109.5° |
| C46 | C48 | C49 | 107.2° | 109.4° |
| C46 | C48 | H78 | 110.0° | 109.5° |
| C46 | C48 | H79 | 110.1° | 109.5° |
| O14 | C47 | N14 | 118.1° | 120.0° |
| C49 | C48 | H78 | 110.1° | 109.5° |
| C49 | C48 | H79 | 110.1° | 109.5° |
| C48 | C49 | C50 | 107.4° | 109.5° |
| C48 | C49 | C51 | 107.2° | 109.4° |
| C48 | C49 | H80 | 112.4° | 109.5° |
| H78 | C48 | H79 | 109.4° | 109.5° |
| C50 | C49 | C51 | 105.9° | 109.4° |
| C50 | C49 | H80 | 111.4° | 109.5° |
| C49 | C50 | H81 | 109.5° | 109.5° |
| C49 | C50 | H82 | 109.5° | 109.5° |
| C49 | C50 | H83 | 109.5° | 109.5° |
| C51 | C49 | H80 | 112.2° | 109.5° |
| C49 | C51 | H84 | 109.5° | 109.4° |
| C49 | C51 | H85 | 109.5° | 109.5° |
| C49 | C51 | H86 | 109.4° | 109.5° |
| H81 | C50 | H82 | 109.5° | 109.4° |
| H81 | C50 | H83 | 109.5° | 109.4° |
| H82 | C50 | H83 | 109.4° | 109.4° |
| H84 | C51 | H85 | 109.5° | 109.4° |
| H84 | C51 | H86 | 109.5° | 109.5° |
| H85 | C51 | H86 | 109.5° | 109.5° |
| C52 | N14 | H87 | 119.5° | 120.0° |
| N14 | C52 | C53 | 116.5° | 109.5° |
| N14 | C52 | C54 | 101.9° | 109.5° |
| N14 | C52 | C55 | 105.1° | 109.4° |
| C52 | N14 | C47 | 120.9° | 120.0° |
| H87 | N14 | C47 | 119.6° | 120.0° |
| C53 | C52 | C54 | 110.0° | 109.5° |
| C53 | C52 | C55 | 111.5° | 109.5° |
| C52 | C53 | O15 | 115.3° | 119.9° |
| C52 | C53 | N15 | 124.3° | 120.0° |
| C54 | C52 | C55 | 111.5° | 109.5° |
| C52 | C54 | H88 | 109.5° | 109.4° |
| C52 | C54 | H89 | 109.5° | 109.5° |
| C52 | C54 | H90 | 109.5° | 109.5° |
| C52 | C55 | H91 | 109.5° | 109.5° |
| C52 | C55 | H92 | 109.5° | 109.4° |
| C52 | C55 | H93 | 109.5° | 109.5° |
| O15 | C53 | N15 | 120.0° | 120.0° |
| H88 | C54 | H89 | 109.4° | 109.5° |
| H88 | C54 | H90 | 109.5° | 109.5° |
| H89 | C54 | H90 | 109.5° | 109.5° |
| H91 | C55 | H92 | 109.5° | 109.4° |
| H91 | C55 | H93 | 109.5° | 109.5° |
| H92 | C55 | H93 | 109.4° | 109.5° |
| C56 | N15 | C60 | 106.5° | 108.7° |
| N15 | C56 | C57 | 105.1° | 109.9° |
| N15 | C56 | C58 | 105.9° | 107.3° |
| N15 | C56 | H94 | 110.5° | 109.9° |
| C56 | N15 | C53 | 123.9° | 125.7° |
| N15 | C60 | C59 | 106.7° | 104.7° |
| N15 | C60 | H99 | 110.2° | 110.4° |
| N15 | C60 | H100 | 110.1° | 110.4° |
| C60 | N15 | C53 | 127.4° | 125.7° |
| C57 | C56 | C58 | 115.0° | 109.9° |
| C57 | C56 | H94 | 110.0° | 109.8° |
| C56 | C57 | O16 | 109.8° | 120.0° |
| C56 | C57 | N16 | 124.9° | 120.0° |
| C58 | C56 | H94 | 110.1° | 110.0° |
| C56 | C58 | C59 | 103.5° | 102.9° |
| C56 | C58 | H95 | 111.0° | 110.7° |
| C56 | C58 | H96 | 111.0° | 110.7° |
| O16 | C57 | N16 | 125.4° | 120.0° |
| C59 | C58 | H95 | 111.0° | 110.7° |
| C59 | C58 | H96 | 110.9° | 110.7° |
| C58 | C59 | C60 | 98.2° | 101.5° |
| C58 | C59 | H97 | 112.2° | 111.0° |
| C58 | C59 | H98 | 112.2° | 111.0° |
| H95 | C58 | H96 | 109.5° | 110.7° |
| C60 | C59 | H97 | 112.2° | 111.1° |
| C60 | C59 | H98 | 112.2° | 110.9° |
| C59 | C60 | H99 | 110.1° | 110.5° |
| C59 | C60 | H100 | 110.2° | 110.3° |
| H97 | C59 | H98 | 109.5° | 110.9° |
| H99 | C60 | H100 | 109.5° | 110.4° |
| C61 | N16 | H101 | 120.2° | 120.0° |
| N16 | C61 | C62 | 103.5° | 109.5° |
| N16 | C61 | C63 | 103.7° | 109.5° |
| N16 | C61 | H102 | 112.2° | 109.5° |
| C61 | N16 | C57 | 119.7° | 120.0° |
| H101 | N16 | C57 | 120.2° | 120.0° |
| C62 | C61 | C63 | 113.0° | 109.5° |
| C62 | C61 | H102 | 112.9° | 109.5° |
| C61 | C62 | O17 | 113.4° | 120.0° |
| C61 | C62 | N17 | 126.3° | 120.0° |
| C63 | C61 | H102 | 110.9° | 109.4° |
| C61 | C63 | C64 | 108.0° | 109.5° |
| C61 | C63 | C65 | 101.6° | 109.4° |
| C61 | C63 | H103 | 107.9° | 109.5° |
| O17 | C62 | N17 | 117.0° | 120.0° |
| C64 | C63 | C65 | 121.3° | 109.5° |
| C64 | C63 | H103 | 108.5° | 109.5° |
| C63 | C64 | H104 | 109.5° | 109.5° |
| C63 | C64 | H105 | 109.5° | 109.5° |
| C63 | C64 | H106 | 109.5° | 109.5° |
| C65 | C63 | H103 | 108.8° | 109.5° |
| C63 | C65 | H107 | 109.5° | 109.5° |
| C63 | C65 | H108 | 109.5° | 109.5° |
| C63 | C65 | H109 | 109.5° | 109.5° |
| H104 | C64 | H105 | 109.4° | 109.4° |
| H104 | C64 | H106 | 109.4° | 109.5° |
| H105 | C64 | H106 | 109.5° | 109.5° |
| H107 | C65 | H108 | 109.5° | 109.4° |
| H107 | C65 | H109 | 109.4° | 109.4° |
| H108 | C65 | H109 | 109.5° | 109.5° |
| C66 | N17 | H110 | 115.3° | 120.0° |
| N17 | C66 | C67 | 107.9° | 109.5° |
| N17 | C66 | C68 | 112.8° | 109.5° |
| N17 | C66 | C69 | 109.5° | 109.4° |
| C66 | N17 | C62 | 129.3° | 120.0° |
| H110 | N17 | C62 | 115.3° | 120.0° |
| C67 | C66 | C68 | 107.3° | 109.5° |
| C67 | C66 | C69 | 110.2° | 109.4° |
| C66 | C67 | O18 | 120.8° | 119.9° |
| C66 | C67 | N18 | 118.7° | 120.1° |
| C68 | C66 | C69 | 109.0° | 109.5° |
| C66 | C68 | H111 | 109.5° | 109.5° |
| C66 | C68 | H112 | 109.5° | 109.5° |
| C66 | C68 | H113 | 109.5° | 109.5° |
| C66 | C69 | H114 | 109.5° | 109.5° |
| C66 | C69 | H115 | 109.5° | 109.5° |
| C66 | C69 | H116 | 109.5° | 109.5° |
| O18 | C67 | N18 | 120.2° | 120.0° |
| H111 | C68 | H112 | 109.5° | 109.5° |
| H111 | C68 | H113 | 109.5° | 109.4° |
| H112 | C68 | H113 | 109.4° | 109.5° |
| H114 | C69 | H115 | 109.5° | 109.4° |
| H114 | C69 | H116 | 109.5° | 109.5° |
| H115 | C69 | H116 | 109.5° | 109.5° |
| C70 | N18 | H117 | 116.4° | 120.0° |
| N18 | C70 | C71 | 114.1° | 109.5° |
| N18 | C70 | C72 | 108.1° | 109.5° |
| N18 | C70 | C73 | 108.9° | 109.5° |
| C70 | N18 | C67 | 127.3° | 120.1° |
| H117 | N18 | C67 | 116.3° | 120.0° |
| C71 | C70 | C72 | 105.1° | 109.5° |
| C71 | C70 | C73 | 109.1° | 109.5° |
| C70 | C71 | O19 | 119.3° | 120.0° |
| C70 | C71 | N19 | 113.7° | 120.0° |
| C72 | C70 | C73 | 111.4° | 109.5° |
| C70 | C72 | H118 | 109.5° | 109.4° |
| C70 | C72 | H119 | 109.5° | 109.5° |
| C70 | C72 | H120 | 109.5° | 109.5° |
| C70 | C73 | H121 | 109.5° | 109.5° |
| C70 | C73 | H122 | 109.5° | 109.5° |
| C70 | C73 | H123 | 109.5° | 109.4° |
| O19 | C71 | N19 | 125.6° | 120.0° |
| H118 | C72 | H119 | 109.4° | 109.5° |
| H118 | C72 | H120 | 109.5° | 109.5° |
| H119 | C72 | H120 | 109.5° | 109.5° |
| H121 | C73 | H122 | 109.4° | 109.5° |
| H121 | C73 | H123 | 109.5° | 109.5° |
| H122 | C73 | H123 | 109.4° | 109.5° |
| C74 | N19 | H124 | 121.2° | 120.0° |
| N19 | C74 | C75 | 116.6° | 109.5° |
| N19 | C74 | C76 | 108.9° | 109.5° |
| N19 | C74 | H125 | 104.9° | 109.5° |
| C74 | N19 | C71 | 117.6° | 120.0° |
| H124 | N19 | C71 | 121.2° | 120.0° |
| C75 | C74 | C76 | 115.0° | 109.5° |
| C75 | C74 | H125 | 104.9° | 109.5° |
| C74 | C75 | O20 | 124.8° | 120.0° |
| C74 | C75 | N20 | 118.2° | 120.0° |
| C76 | C74 | H125 | 105.3° | 109.5° |
| C74 | C76 | C77 | 122.5° | 109.5° |
| C74 | C76 | H126 | 106.1° | 109.5° |
| C74 | C76 | H127 | 106.2° | 109.5° |
| O20 | C75 | N20 | 116.9° | 120.0° |
| C77 | C76 | H126 | 106.1° | 109.5° |
| C77 | C76 | H127 | 106.1° | 109.5° |
| C76 | C77 | C78 | 103.0° | 109.5° |
| C76 | C77 | H128 | 111.1° | 109.5° |
| C76 | C77 | H129 | 111.1° | 109.4° |
| H126 | C76 | H127 | 109.5° | 109.5° |
| C78 | C77 | H128 | 111.1° | 109.5° |
| C78 | C77 | H129 | 111.0° | 109.5° |
| C77 | C78 | O21 | 118.8° | 120.0° |
| C77 | C78 | O22 | 118.3° | 120.0° |
| H128 | C77 | H129 | 109.5° | 109.5° |
| O21 | C78 | O22 | 119.6° | 120.0° |
| C78 | O22 | H130 | 109.5° | 117.0° |
| C79 | N20 | H131 | 118.0° | 120.0° |
| N20 | C79 | C80 | 105.3° | 109.5° |
| N20 | C79 | C81 | 113.0° | 109.5° |
| N20 | C79 | H132 | 107.0° | 109.4° |
| C79 | N20 | C75 | 123.9° | 120.0° |
| H131 | N20 | C75 | 118.1° | 120.0° |
| C80 | C79 | C81 | 117.7° | 109.5° |
| C80 | C79 | H132 | 106.6° | 109.5° |
| C79 | C80 | O23 | 114.0° | 120.0° |
| C79 | C80 | N22 | 121.9° | 120.0° |
| C81 | C79 | H132 | 106.6° | 109.5° |
| C79 | C81 | C82 | 116.7° | 109.5° |
| C79 | C81 | H133 | 107.6° | 109.5° |
| C79 | C81 | H134 | 107.6° | 109.5° |
| O23 | C80 | N22 | 123.8° | 120.0° |
| C82 | C81 | H133 | 107.6° | 109.5° |
| C82 | C81 | H134 | 107.6° | 109.5° |
| C81 | C82 | C83 | 115.5° | 109.5° |
| C81 | C82 | H135 | 107.9° | 109.5° |
| C81 | C82 | H136 | 107.9° | 109.5° |
| H133 | C81 | H134 | 109.5° | 109.5° |
| C83 | C82 | H135 | 107.9° | 109.4° |
| C83 | C82 | H136 | 107.9° | 109.5° |
| C82 | C83 | O24 | 112.6° | 120.0° |
| C82 | C83 | N21 | 121.3° | 120.0° |
| H135 | C82 | H136 | 109.5° | 109.4° |
| O24 | C83 | N21 | 126.2° | 120.0° |
| C83 | N21 | H137 | 120.0° | 120.0° |
| C83 | N21 | H138 | 120.0° | 120.0° |
| H137 | N21 | H138 | 120.0° | 120.0° |
| C84 | N22 | H139 | 118.5° | 120.0° |
| N22 | C84 | C85 | 110.9° | 109.5° |
| N22 | C84 | C86 | 107.2° | 109.4° |
| N22 | C84 | H140 | 108.6° | 109.5° |
| C84 | N22 | C80 | 123.0° | 120.0° |
| H139 | N22 | C80 | 118.5° | 120.0° |
| C85 | C84 | C86 | 114.2° | 109.5° |
| C85 | C84 | H140 | 108.2° | 109.5° |
| C84 | C85 | O25 | 111.8° | 109.5° |
| C84 | C85 | H141 | 108.9° | 109.4° |
| C84 | C85 | H142 | 108.9° | 109.4° |
| C86 | C84 | H140 | 107.7° | 109.5° |
| C84 | C86 | C87 | 112.5° | 109.5° |
| C84 | C86 | H144 | 108.7° | 109.4° |
| C84 | C86 | H145 | 108.7° | 109.4° |
| O25 | C85 | H141 | 108.9° | 109.5° |
| O25 | C85 | H142 | 108.9° | 109.5° |
| C85 | O25 | H143 | 109.5° | 114.0° |
| H141 | C85 | H142 | 109.5° | 109.5° |
| C87 | C86 | H144 | 108.7° | 109.5° |
| C87 | C86 | H145 | 108.7° | 109.5° |
| C86 | C87 | C88 | 116.7° | 120.0° |
| C86 | C87 | C89 | 124.5° | 120.0° |
| H144 | C86 | H145 | 109.5° | 109.5° |
| C88 | C87 | C89 | 118.8° | 120.0° |
| C87 | C88 | C90 | 119.3° | 120.1° |
| C87 | C88 | H146 | 120.4° | 120.0° |
| C87 | C89 | C91 | 118.6° | 120.0° |
| C87 | C89 | H147 | 120.7° | 120.0° |
| C90 | C88 | H146 | 120.3° | 120.0° |
| C88 | C90 | C92 | 123.0° | 120.0° |
| C88 | C90 | H148 | 118.5° | 120.1° |
| C91 | C89 | H147 | 120.7° | 120.0° |
| C89 | C91 | C92 | 125.7° | 120.0° |
| C89 | C91 | H149 | 117.2° | 120.0° |
| C92 | C90 | H148 | 118.5° | 120.0° |
| C90 | C92 | C91 | 114.4° | 120.0° |
| C90 | C92 | H150 | 122.8° | 120.0° |
| C92 | C91 | H149 | 117.2° | 120.0° |
| C91 | C92 | H150 | 122.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | N1 | 153.9° | 179.7° |
| O1 | C1 | C2 | H1 | 0.0° | 90.0° |
| O1 | C1 | C2 | H2 | 120.0° | 150.0° |
| O1 | C1 | C2 | H3 | 120.0° | 30.0° |
| O1 | C1 | N1 | C3 | 17.1° | 0.0° |
| O1 | C1 | N1 | H4 | 162.9° | 180.0° |
| C1 | C2 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H1 | H3 | 120.0° | 120.0° |
| C1 | C2 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | N1 | C3 | 167.4° | 179.7° |
| C2 | C1 | N1 | H4 | 12.6° | 0.3° |
| H1 | C2 | H2 | H3 | 120.0° | 119.9° |
| H1 | C2 | C1 | N1 | 153.9° | 89.7° |
| H2 | C2 | C1 | N1 | 86.1° | 30.3° |
| H3 | C2 | C1 | N1 | 33.9° | 150.3° |
| C3 | N1 | H4 | C1 | 180.0° | 180.0° |
| N1 | C3 | C4 | C5 | 120.2° | 120.0° |
| N1 | C3 | C4 | C6 | 121.5° | 120.0° |
| N1 | C3 | C5 | C6 | 118.3° | 120.0° |
| N1 | C3 | C4 | O2 | 131.0° | 129.5° |
| N1 | C3 | C5 | H5 | 180.0° | 60.1° |
| N1 | C3 | C5 | H6 | 60.0° | 180.0° |
| N1 | C3 | C5 | H7 | 60.0° | 59.9° |
| N1 | C3 | C6 | H8 | 180.0° | 60.0° |
| N1 | C3 | C6 | H9 | 60.0° | 179.9° |
| N1 | C3 | C6 | H10 | 60.0° | 60.0° |
| N1 | C3 | C4 | N2 | 45.9° | 50.5° |
| H4 | N1 | C3 | C4 | 139.9° | 3.3° |
| H4 | N1 | C3 | C5 | 18.5° | 116.7° |
| H4 | N1 | C3 | C6 | 97.5° | 123.3° |
| C4 | C3 | C5 | C6 | 121.5° | 120.0° |
| C3 | C4 | O2 | N2 | 177.0° | 180.0° |
| C4 | C3 | C5 | H5 | 59.8° | 180.0° |
| C4 | C3 | C5 | H6 | 179.8° | 60.1° |
| C4 | C3 | C5 | H7 | 60.2° | 60.0° |
| C4 | C3 | C6 | H8 | 58.9° | 60.0° |
| C4 | C3 | C6 | H9 | 61.1° | 60.0° |
| C4 | C3 | C6 | H10 | 178.9° | 180.0° |
| C3 | C4 | N2 | C7 | 175.6° | 175.4° |
| C3 | C4 | N2 | C11 | 0.7° | 4.3° |
| C4 | C3 | N1 | C1 | 40.1° | 176.8° |
| C5 | C3 | C4 | O2 | 108.8° | 9.5° |
| C3 | C5 | H5 | H6 | 120.0° | 120.0° |
| C3 | C5 | H5 | H7 | 120.0° | 120.0° |
| C3 | C5 | H6 | H7 | 120.0° | 120.1° |
| C5 | C3 | C6 | H8 | 62.2° | 179.9° |
| C5 | C3 | C6 | H9 | 177.8° | 60.0° |
| C5 | C3 | C6 | H10 | 57.9° | 60.0° |
| C5 | C3 | N1 | C1 | 161.5° | 63.3° |
| C5 | C3 | C4 | N2 | 74.3° | 170.5° |
| C6 | C3 | C4 | O2 | 9.5° | 110.5° |
| C6 | C3 | C5 | H5 | 61.7° | 60.0° |
| C6 | C3 | C5 | H6 | 58.3° | 60.0° |
| C6 | C3 | C5 | H7 | 178.3° | 180.0° |
| C3 | C6 | H8 | H9 | 120.0° | 120.0° |
| C3 | C6 | H8 | H10 | 120.0° | 120.0° |
| C3 | C6 | H9 | H10 | 120.0° | 120.0° |
| C6 | C3 | N1 | C1 | 82.5° | 56.7° |
| C6 | C3 | C4 | N2 | 167.4° | 69.5° |
| O2 | C4 | N2 | C7 | 7.8° | 4.6° |
| O2 | C4 | N2 | C11 | 177.4° | 175.7° |
| H5 | C5 | H6 | H7 | 120.0° | 120.0° |
| H8 | C6 | H9 | H10 | 120.0° | 120.0° |
| C7 | N2 | C11 | C4 | 175.2° | 179.7° |
| N2 | C7 | C8 | C9 | 116.7° | 117.9° |
| N2 | C7 | C8 | H11 | 120.2° | 120.9° |
| N2 | C7 | C9 | H11 | 114.8° | 119.5° |
| N2 | C7 | C8 | O3 | 147.7° | 0.0° |
| N2 | C7 | C9 | C10 | 17.2° | 22.2° |
| N2 | C7 | C9 | H12 | 102.5° | 140.6° |
| N2 | C7 | C9 | H13 | 136.9° | 96.2° |
| C7 | N2 | C11 | C10 | 19.9° | 24.4° |
| C7 | N2 | C11 | H16 | 139.6° | 94.5° |
| C7 | N2 | C11 | H17 | 99.9° | 143.2° |
| N2 | C7 | C8 | N3 | 32.9° | 179.9° |
| C11 | N2 | C7 | C8 | 123.2° | 120.7° |
| C11 | N2 | C7 | C9 | 1.3° | 1.3° |
| C11 | N2 | C7 | H11 | 116.4° | 118.3° |
| N2 | C11 | C10 | C9 | 29.7° | 37.3° |
| N2 | C11 | C10 | H16 | 119.7° | 118.9° |
| N2 | C11 | C10 | H17 | 119.7° | 118.7° |
| N2 | C11 | C10 | H14 | 148.7° | 80.8° |
| N2 | C11 | C10 | H15 | 89.2° | 155.3° |
| N2 | C11 | H16 | H17 | 120.7° | 122.3° |
| C8 | C7 | C9 | H11 | 123.1° | 121.1° |
| C7 | C8 | O3 | N3 | 179.3° | 180.0° |
| C8 | C7 | C9 | C10 | 139.4° | 97.2° |
| C8 | C7 | C9 | H12 | 19.7° | 21.2° |
| C8 | C7 | C9 | H13 | 100.9° | 144.4° |
| C7 | C8 | N3 | C12 | 176.5° | 180.0° |
| C7 | C8 | N3 | H18 | 3.6° | 0.0° |
| C8 | C7 | N2 | C4 | 61.0° | 59.5° |
| C9 | C7 | C8 | O3 | 95.6° | 117.8° |
| C7 | C9 | C10 | H12 | 119.7° | 118.4° |
| C7 | C9 | C10 | H13 | 119.7° | 118.4° |
| C7 | C9 | H12 | H13 | 120.9° | 123.2° |
| C7 | C9 | C10 | C11 | 28.9° | 35.7° |
| C7 | C9 | C10 | H14 | 147.9° | 82.5° |
| C7 | C9 | C10 | H15 | 90.1° | 153.6° |
| C9 | C7 | N2 | C4 | 174.5° | 179.0° |
| C9 | C7 | C8 | N3 | 83.7° | 62.2° |
| H11 | C7 | C8 | O3 | 27.5° | 121.0° |
| H11 | C7 | C9 | C10 | 97.6° | 141.7° |
| H11 | C7 | C9 | H12 | 142.7° | 100.0° |
| H11 | C7 | C9 | H13 | 22.1° | 23.3° |
| H11 | C7 | N2 | C4 | 59.4° | 61.4° |
| H11 | C7 | C8 | N3 | 153.2° | 59.0° |
| O3 | C8 | N3 | C12 | 2.9° | 0.0° |
| O3 | C8 | N3 | H18 | 177.1° | 179.9° |
| C10 | C9 | H12 | H13 | 120.9° | 123.2° |
| C9 | C10 | C11 | H14 | 119.0° | 118.1° |
| C9 | C10 | C11 | H15 | 119.0° | 118.0° |
| C9 | C10 | H14 | H15 | 123.0° | 123.9° |
| C9 | C10 | C11 | H16 | 149.5° | 81.6° |
| C9 | C10 | C11 | H17 | 90.0° | 156.0° |
| H12 | C9 | C10 | C11 | 90.8° | 154.1° |
| H12 | C9 | C10 | H14 | 28.2° | 35.9° |
| H12 | C9 | C10 | H15 | 150.2° | 88.0° |
| H13 | C9 | C10 | C11 | 148.6° | 82.7° |
| H13 | C9 | C10 | H14 | 92.4° | 159.1° |
| H13 | C9 | C10 | H15 | 29.6° | 35.2° |
| C11 | C10 | H14 | H15 | 123.0° | 123.9° |
| C10 | C11 | H16 | H17 | 120.8° | 122.4° |
| C10 | C11 | N2 | C4 | 155.3° | 155.8° |
| H14 | C10 | C11 | H16 | 91.5° | 160.3° |
| H14 | C10 | C11 | H17 | 29.0° | 37.9° |
| H15 | C10 | C11 | H16 | 30.5° | 36.5° |
| H15 | C10 | C11 | H17 | 151.0° | 86.0° |
| H16 | C11 | N2 | C4 | 35.6° | 85.2° |
| H17 | C11 | N2 | C4 | 84.9° | 37.1° |
| C12 | N3 | H18 | C8 | 180.0° | 179.9° |
| N3 | C12 | C13 | C14 | 111.7° | 119.9° |
| N3 | C12 | C13 | C15 | 123.1° | 120.0° |
| N3 | C12 | C14 | C15 | 118.5° | 120.0° |
| N3 | C12 | C13 | O4 | 144.2° | 145.0° |
| N3 | C12 | C14 | H19 | 180.0° | 60.1° |
| N3 | C12 | C14 | H20 | 60.0° | 180.0° |
| N3 | C12 | C14 | H21 | 60.0° | 60.0° |
| N3 | C12 | C15 | H22 | 180.0° | 60.0° |
| N3 | C12 | C15 | H23 | 60.0° | 180.0° |
| N3 | C12 | C15 | H24 | 60.0° | 60.0° |
| N3 | C12 | C13 | N4 | 50.1° | 35.0° |
| H18 | N3 | C12 | C13 | 114.3° | 0.1° |
| H18 | N3 | C12 | C14 | 3.5° | 120.0° |
| H18 | N3 | C12 | C15 | 113.2° | 119.9° |
| C13 | C12 | C14 | C15 | 134.9° | 120.0° |
| C12 | C13 | O4 | N4 | 166.7° | 179.9° |
| C13 | C12 | C14 | H19 | 73.4° | 180.0° |
| C13 | C12 | C14 | H20 | 166.6° | 60.1° |
| C13 | C12 | C14 | H21 | 46.5° | 60.0° |
| C13 | C12 | C15 | H22 | 61.5° | 60.0° |
| C13 | C12 | C15 | H23 | 58.5° | 60.0° |
| C13 | C12 | C15 | H24 | 178.5° | 180.0° |
| C12 | C13 | N4 | C16 | 178.8° | 180.0° |
| C12 | C13 | N4 | H25 | 1.2° | 0.1° |
| C13 | C12 | N3 | C8 | 65.7° | 180.0° |
| C14 | C12 | C13 | O4 | 104.1° | 25.1° |
| C12 | C14 | H19 | H20 | 120.0° | 119.9° |
| C12 | C14 | H19 | H21 | 120.0° | 120.1° |
| C12 | C14 | H20 | H21 | 120.0° | 120.1° |
| C14 | C12 | C15 | H22 | 63.3° | 180.0° |
| C14 | C12 | C15 | H23 | 176.8° | 60.0° |
| C14 | C12 | C15 | H24 | 56.8° | 60.0° |
| C14 | C12 | N3 | C8 | 176.5° | 60.0° |
| C14 | C12 | C13 | N4 | 61.6° | 155.0° |
| C15 | C12 | C13 | O4 | 21.1° | 95.0° |
| C15 | C12 | C14 | H19 | 61.5° | 60.0° |
| C15 | C12 | C14 | H20 | 58.5° | 59.9° |
| C15 | C12 | C14 | H21 | 178.5° | 180.0° |
| C12 | C15 | H22 | H23 | 120.0° | 120.0° |
| C12 | C15 | H22 | H24 | 120.0° | 120.0° |
| C12 | C15 | H23 | H24 | 120.0° | 120.0° |
| C15 | C12 | N3 | C8 | 66.8° | 60.0° |
| C15 | C12 | C13 | N4 | 173.3° | 85.0° |
| O4 | C13 | N4 | C16 | 14.7° | 0.0° |
| O4 | C13 | N4 | H25 | 165.3° | 180.0° |
| H19 | C14 | H20 | H21 | 120.0° | 120.0° |
| H22 | C15 | H23 | H24 | 120.0° | 120.0° |
| C16 | N4 | H25 | C13 | 180.0° | 180.0° |
| N4 | C16 | C17 | C18 | 125.6° | 120.0° |
| N4 | C16 | C17 | H26 | 115.8° | 120.0° |
| N4 | C16 | C18 | H26 | 115.7° | 120.0° |
| N4 | C16 | C17 | O5 | 134.7° | 0.0° |
| N4 | C16 | C18 | H27 | 180.0° | 180.0° |
| N4 | C16 | C18 | H28 | 60.0° | 60.0° |
| N4 | C16 | C18 | H29 | 60.0° | 60.0° |
| N4 | C16 | C17 | N5 | 49.2° | 180.0° |
| H25 | N4 | C16 | C17 | 123.4° | 25.0° |
| H25 | N4 | C16 | C18 | 5.0° | 95.0° |
| H25 | N4 | C16 | H26 | 120.9° | 145.0° |
| C17 | C16 | C18 | H26 | 118.4° | 120.1° |
| C16 | C17 | O5 | N5 | 176.0° | 180.0° |
| C17 | C16 | C18 | H27 | 54.1° | 60.0° |
| C17 | C16 | C18 | H28 | 174.1° | 180.0° |
| C17 | C16 | C18 | H29 | 65.9° | 60.0° |
| C16 | C17 | N5 | C19 | 178.6° | 180.0° |
| C16 | C17 | N5 | H30 | 1.4° | 0.0° |
| C17 | C16 | N4 | C13 | 56.6° | 155.0° |
| C18 | C16 | C17 | O5 | 99.7° | 120.0° |
| C16 | C18 | H27 | H28 | 120.0° | 120.0° |
| C16 | C18 | H27 | H29 | 120.0° | 120.0° |
| C16 | C18 | H28 | H29 | 120.0° | 120.0° |
| C18 | C16 | N4 | C13 | 175.0° | 85.0° |
| C18 | C16 | C17 | N5 | 76.4° | 60.0° |
| H26 | C16 | C17 | O5 | 18.9° | 120.0° |
| H26 | C16 | C18 | H27 | 64.3° | 60.0° |
| H26 | C16 | C18 | H28 | 55.7° | 60.0° |
| H26 | C16 | C18 | H29 | 175.7° | 180.0° |
| H26 | C16 | N4 | C13 | 59.2° | 35.0° |
| H26 | C16 | C17 | N5 | 165.0° | 60.0° |
| O5 | C17 | N5 | C19 | 2.9° | 0.0° |
| O5 | C17 | N5 | H30 | 177.1° | 179.9° |
| H27 | C18 | H28 | H29 | 120.0° | 119.9° |
| C19 | N5 | H30 | C17 | 180.0° | 179.9° |
| N5 | C19 | C20 | C21 | 114.3° | 120.0° |
| N5 | C19 | C20 | C22 | 117.7° | 120.0° |
| N5 | C19 | C21 | C22 | 116.2° | 120.1° |
| N5 | C19 | C20 | O6 | 123.7° | 145.0° |
| N5 | C19 | C21 | H31 | 180.0° | 60.0° |
| N5 | C19 | C21 | H32 | 60.0° | 180.0° |
| N5 | C19 | C21 | H33 | 60.0° | 60.0° |
| N5 | C19 | C22 | H34 | 180.0° | 59.9° |
| N5 | C19 | C22 | H35 | 60.0° | 180.0° |
| N5 | C19 | C22 | H36 | 60.0° | 59.9° |
| N5 | C19 | C20 | N6 | 44.2° | 35.0° |
| H30 | N5 | C19 | C20 | 117.6° | 0.0° |
| H30 | N5 | C19 | C21 | 5.1° | 120.0° |
| H30 | N5 | C19 | C22 | 115.8° | 119.9° |
| C20 | C19 | C21 | C22 | 131.7° | 119.9° |
| C19 | C20 | O6 | N6 | 168.7° | 179.9° |
| C20 | C19 | C21 | H31 | 67.9° | 180.0° |
| C20 | C19 | C21 | H32 | 172.2° | 60.0° |
| C20 | C19 | C21 | H33 | 52.1° | 60.0° |
| C20 | C19 | C22 | H34 | 62.4° | 60.1° |
| C20 | C19 | C22 | H35 | 57.6° | 60.0° |
| C20 | C19 | C22 | H36 | 177.5° | 180.0° |
| C19 | C20 | N6 | C23 | 178.1° | 180.0° |
| C19 | C20 | N6 | H37 | 1.9° | 0.1° |
| C20 | C19 | N5 | C17 | 62.4° | 180.0° |
| C21 | C19 | C20 | O6 | 122.1° | 25.0° |
| C19 | C21 | H31 | H32 | 120.0° | 120.0° |
| C19 | C21 | H31 | H33 | 120.0° | 119.9° |
| C19 | C21 | H32 | H33 | 120.0° | 120.0° |
| C21 | C19 | C22 | H34 | 62.2° | 180.0° |
| C21 | C19 | C22 | H35 | 177.8° | 59.9° |
| C21 | C19 | C22 | H36 | 57.8° | 60.1° |
| C21 | C19 | N5 | C17 | 174.9° | 60.0° |
| C21 | C19 | C20 | N6 | 70.1° | 155.0° |
| C22 | C19 | C20 | O6 | 6.0° | 95.0° |
| C22 | C19 | C21 | H31 | 63.8° | 60.1° |
| C22 | C19 | C21 | H32 | 56.2° | 59.9° |
| C22 | C19 | C21 | H33 | 176.2° | 180.0° |
| C19 | C22 | H34 | H35 | 120.0° | 120.1° |
| C19 | C22 | H34 | H36 | 120.0° | 119.9° |
| C19 | C22 | H35 | H36 | 120.0° | 120.0° |
| C22 | C19 | N5 | C17 | 64.2° | 60.0° |
| C22 | C19 | C20 | N6 | 161.9° | 85.1° |
| O6 | C20 | N6 | C23 | 15.1° | 0.0° |
| O6 | C20 | N6 | H37 | 164.9° | 180.0° |
| H31 | C21 | H32 | H33 | 120.0° | 120.0° |
| H34 | C22 | H35 | H36 | 120.0° | 119.9° |
| C23 | N6 | H37 | C20 | 180.0° | 179.9° |
| N6 | C23 | C24 | C25 | 119.0° | 120.0° |
| N6 | C23 | C24 | H38 | 118.4° | 120.0° |
| N6 | C23 | C25 | H38 | 117.0° | 120.1° |
| N6 | C23 | C24 | O7 | 144.6° | 0.0° |
| N6 | C23 | C25 | H39 | 180.0° | 180.0° |
| N6 | C23 | C25 | H40 | 60.0° | 60.1° |
| N6 | C23 | C25 | H41 | 60.0° | 60.0° |
| N6 | C23 | C24 | N7 | 35.7° | 180.0° |
| H37 | N6 | C23 | C24 | 108.1° | 25.0° |
| H37 | N6 | C23 | C25 | 16.4° | 94.9° |
| H37 | N6 | C23 | H38 | 133.2° | 145.0° |
| C24 | C23 | C25 | H38 | 123.0° | 120.0° |
| C23 | C24 | O7 | N7 | 179.7° | 180.0° |
| C24 | C23 | C25 | H39 | 60.0° | 60.1° |
| C24 | C23 | C25 | H40 | 180.0° | 180.0° |
| C24 | C23 | C25 | H41 | 60.0° | 60.0° |
| C23 | C24 | N7 | C26 | 179.4° | 179.9° |
| C23 | C24 | N7 | H42 | 0.6° | 0.0° |
| C24 | C23 | N6 | C20 | 71.9° | 155.0° |
| C25 | C23 | C24 | O7 | 96.5° | 120.0° |
| C23 | C25 | H39 | H40 | 120.0° | 120.0° |
| C23 | C25 | H39 | H41 | 120.0° | 120.0° |
| C23 | C25 | H40 | H41 | 119.9° | 120.1° |
| C25 | C23 | N6 | C20 | 163.6° | 85.0° |
| C25 | C23 | C24 | N7 | 83.3° | 60.0° |
| H38 | C23 | C24 | O7 | 26.1° | 120.0° |
| H38 | C23 | C25 | H39 | 63.0° | 59.9° |
| H38 | C23 | C25 | H40 | 57.1° | 60.0° |
| H38 | C23 | C25 | H41 | 177.0° | 179.9° |
| H38 | C23 | N6 | C20 | 46.8° | 35.0° |
| H38 | C23 | C24 | N7 | 154.1° | 60.0° |
| O7 | C24 | N7 | C26 | 0.4° | 0.1° |
| O7 | C24 | N7 | H42 | 179.7° | 180.0° |
| H39 | C25 | H40 | H41 | 120.0° | 120.0° |
| C26 | N7 | H42 | C24 | 180.0° | 180.0° |
| N7 | C26 | C27 | C28 | 122.0° | 120.1° |
| N7 | C26 | C27 | H43 | 119.4° | 119.9° |
| N7 | C26 | C28 | H43 | 117.3° | 120.0° |
| N7 | C26 | C27 | O8 | 135.7° | 0.0° |
| N7 | C26 | C28 | C29 | 76.1° | 65.0° |
| N7 | C26 | C28 | H44 | 44.3° | 55.0° |
| N7 | C26 | C28 | H45 | 163.4° | 175.0° |
| N7 | C26 | C27 | N9 | 44.7° | 180.0° |
| H42 | N7 | C26 | C27 | 113.2° | 25.0° |
| H42 | N7 | C26 | C28 | 10.7° | 95.0° |
| H42 | N7 | C26 | H43 | 127.4° | 145.0° |
| C27 | C26 | C28 | H43 | 119.2° | 120.0° |
| C26 | C27 | O8 | N9 | 179.6° | 180.0° |
| C27 | C26 | C28 | C29 | 160.3° | 175.0° |
| C27 | C26 | C28 | H44 | 79.2° | 65.0° |
| C27 | C26 | C28 | H45 | 39.8° | 55.0° |
| C26 | C27 | N9 | C31 | 178.7° | 180.0° |
| C26 | C27 | N9 | H50 | 1.4° | 0.1° |
| C27 | C26 | N7 | C24 | 66.8° | 155.0° |
| C28 | C26 | C27 | O8 | 102.3° | 120.0° |
| C26 | C28 | C29 | H44 | 120.5° | 120.0° |
| C26 | C28 | C29 | H45 | 120.5° | 120.0° |
| C26 | C28 | H44 | H45 | 118.5° | 120.0° |
| C26 | C28 | C29 | C30 | 96.6° | 180.0° |
| C26 | C28 | C29 | H46 | 24.3° | 60.0° |
| C26 | C28 | C29 | H47 | 142.6° | 60.0° |
| C28 | C26 | C27 | N9 | 77.3° | 60.0° |
| C28 | C26 | N7 | C24 | 169.3° | 85.0° |
| H43 | C26 | C27 | O8 | 16.3° | 120.0° |
| H43 | C26 | C28 | C29 | 41.1° | 55.0° |
| H43 | C26 | C28 | H44 | 161.6° | 175.0° |
| H43 | C26 | C28 | H45 | 79.4° | 65.0° |
| H43 | C26 | C27 | N9 | 164.1° | 60.1° |
| H43 | C26 | N7 | C24 | 52.6° | 35.1° |
| O8 | C27 | N9 | C31 | 0.9° | 0.0° |
| O8 | C27 | N9 | H50 | 179.1° | 179.9° |
| C29 | C28 | H44 | H45 | 118.6° | 120.0° |
| C28 | C29 | C30 | H46 | 120.9° | 120.0° |
| C28 | C29 | C30 | H47 | 120.9° | 120.0° |
| C28 | C29 | H46 | H47 | 117.4° | 120.0° |
| C28 | C29 | C30 | O9 | 34.4° | 0.0° |
| C28 | C29 | C30 | N8 | 151.1° | 180.0° |
| H44 | C28 | C29 | C30 | 142.9° | 60.0° |
| H44 | C28 | C29 | H46 | 96.2° | 180.0° |
| H44 | C28 | C29 | H47 | 22.1° | 60.0° |
| H45 | C28 | C29 | C30 | 23.9° | 60.0° |
| H45 | C28 | C29 | H46 | 144.8° | 60.0° |
| H45 | C28 | C29 | H47 | 96.9° | 180.0° |
| C30 | C29 | H46 | H47 | 117.3° | 120.0° |
| C29 | C30 | O9 | N8 | 173.6° | 179.9° |
| C29 | C30 | N8 | H48 | 174.1° | 0.0° |
| C29 | C30 | N8 | H49 | 5.9° | 179.9° |
| H46 | C29 | C30 | O9 | 155.3° | 120.0° |
| H46 | C29 | C30 | N8 | 30.3° | 60.0° |
| H47 | C29 | C30 | O9 | 86.4° | 120.0° |
| H47 | C29 | C30 | N8 | 88.0° | 59.9° |
| O9 | C30 | N8 | H48 | 0.0° | 179.9° |
| O9 | C30 | N8 | H49 | 180.0° | 0.0° |
| C30 | N8 | H48 | H49 | 180.0° | 179.9° |
| C31 | N9 | H50 | C27 | 180.0° | 179.9° |
| N9 | C31 | C32 | C33 | 124.4° | 119.9° |
| N9 | C31 | C32 | C34 | 111.9° | 120.1° |
| N9 | C31 | C33 | C34 | 118.5° | 120.0° |
| N9 | C31 | C32 | O10 | 126.7° | 145.0° |
| N9 | C31 | C33 | H51 | 180.0° | 60.1° |
| N9 | C31 | C33 | H52 | 60.0° | 180.0° |
| N9 | C31 | C33 | H53 | 60.0° | 60.0° |
| N9 | C31 | C34 | H54 | 180.0° | 60.0° |
| N9 | C31 | C34 | H55 | 60.0° | 180.0° |
| N9 | C31 | C34 | H56 | 60.0° | 60.0° |
| N9 | C31 | C32 | N10 | 49.3° | 35.1° |
| H50 | N9 | C31 | C32 | 120.2° | 0.1° |
| H50 | N9 | C31 | C33 | 2.1° | 120.0° |
| H50 | N9 | C31 | C34 | 119.6° | 120.0° |
| C32 | C31 | C33 | C34 | 126.9° | 120.0° |
| C31 | C32 | O10 | N10 | 176.1° | 180.0° |
| C32 | C31 | C33 | H51 | 65.4° | 180.0° |
| C32 | C31 | C33 | H52 | 174.6° | 60.0° |
| C32 | C31 | C33 | H53 | 54.6° | 60.0° |
| C32 | C31 | C34 | H54 | 69.4° | 60.0° |
| C32 | C31 | C34 | H55 | 50.6° | 60.0° |
| C32 | C31 | C34 | H56 | 170.6° | 180.0° |
| C31 | C32 | N10 | C35 | 172.2° | 180.0° |
| C31 | C32 | N10 | H57 | 7.8° | 0.0° |
| C32 | C31 | N9 | C27 | 59.8° | 180.0° |
| C33 | C31 | C32 | O10 | 108.9° | 25.0° |
| C31 | C33 | H51 | H52 | 120.0° | 119.9° |
| C31 | C33 | H51 | H53 | 120.0° | 120.0° |
| C31 | C33 | H52 | H53 | 120.0° | 120.0° |
| C33 | C31 | C34 | H54 | 53.5° | 180.0° |
| C33 | C31 | C34 | H55 | 173.5° | 60.0° |
| C33 | C31 | C34 | H56 | 66.5° | 60.0° |
| C33 | C31 | N9 | C27 | 177.9° | 60.1° |
| C33 | C31 | C32 | N10 | 75.1° | 155.0° |
| C34 | C31 | C32 | O10 | 14.9° | 95.0° |
| C34 | C31 | C33 | H51 | 61.5° | 60.0° |
| C34 | C31 | C33 | H52 | 58.5° | 60.0° |
| C34 | C31 | C33 | H53 | 178.5° | 180.0° |
| C31 | C34 | H54 | H55 | 120.0° | 120.0° |
| C31 | C34 | H54 | H56 | 120.0° | 120.0° |
| C31 | C34 | H55 | H56 | 120.0° | 120.0° |
| C34 | C31 | N9 | C27 | 60.4° | 60.0° |
| C34 | C31 | C32 | N10 | 161.2° | 85.0° |
| O10 | C32 | N10 | C35 | 12.3° | 0.0° |
| O10 | C32 | N10 | H57 | 167.7° | 180.0° |
| H51 | C33 | H52 | H53 | 120.0° | 120.1° |
| H54 | C34 | H55 | H56 | 120.0° | 120.1° |
| C35 | N10 | H57 | C32 | 180.0° | 180.0° |
| N10 | C35 | C36 | C37 | 118.9° | 120.0° |
| N10 | C35 | C36 | H58 | 121.3° | 120.0° |
| N10 | C35 | C37 | H58 | 117.4° | 119.9° |
| N10 | C35 | C36 | O11 | 134.7° | 7.7° |
| N10 | C35 | C37 | C38 | 173.1° | 60.2° |
| N10 | C35 | C37 | C39 | 71.1° | 59.8° |
| N10 | C35 | C37 | H59 | 51.8° | 179.7° |
| N10 | C35 | C36 | N11 | 41.4° | 172.3° |
| H57 | N10 | C35 | C36 | 110.8° | 25.0° |
| H57 | N10 | C35 | C37 | 10.7° | 95.0° |
| H57 | N10 | C35 | H58 | 127.6° | 145.0° |
| C36 | C35 | C37 | H58 | 120.6° | 120.1° |
| C35 | C36 | O11 | N11 | 176.3° | 180.0° |
| C36 | C35 | C37 | C38 | 51.1° | 179.8° |
| C36 | C35 | C37 | C39 | 166.9° | 60.2° |
| C36 | C35 | C37 | H59 | 70.2° | 59.7° |
| C35 | C36 | N11 | C40 | 180.0° | 175.1° |
| C35 | C36 | N11 | H66 | 0.0° | 5.0° |
| C36 | C35 | N10 | C32 | 69.2° | 155.0° |
| C37 | C35 | C36 | O11 | 106.4° | 112.3° |
| C35 | C37 | C38 | C39 | 112.0° | 120.0° |
| C35 | C37 | C38 | H59 | 121.0° | 120.0° |
| C35 | C37 | C39 | H59 | 122.0° | 119.9° |
| C35 | C37 | C38 | H60 | 180.0° | 65.2° |
| C35 | C37 | C38 | H61 | 60.0° | 174.7° |
| C35 | C37 | C38 | H62 | 60.0° | 54.8° |
| C35 | C37 | C39 | H63 | 180.0° | 60.0° |
| C35 | C37 | C39 | H64 | 60.0° | 180.0° |
| C35 | C37 | C39 | H65 | 60.0° | 60.0° |
| C37 | C35 | N10 | C32 | 169.3° | 85.0° |
| C37 | C35 | C36 | N11 | 77.5° | 67.7° |
| H58 | C35 | C36 | O11 | 13.4° | 127.6° |
| H58 | C35 | C37 | C38 | 69.5° | 59.7° |
| H58 | C35 | C37 | C39 | 46.3° | 179.7° |
| H58 | C35 | C37 | H59 | 169.2° | 60.3° |
| H58 | C35 | N10 | C32 | 52.4° | 35.0° |
| H58 | C35 | C36 | N11 | 162.7° | 52.3° |
| O11 | C36 | N11 | C40 | 3.5° | 4.9° |
| O11 | C36 | N11 | H66 | 176.5° | 175.0° |
| C38 | C37 | C39 | H59 | 126.4° | 120.1° |
| C37 | C38 | H60 | H61 | 120.0° | 120.0° |
| C37 | C38 | H60 | H62 | 120.0° | 120.0° |
| C37 | C38 | H61 | H62 | 120.0° | 119.9° |
| C38 | C37 | C39 | H63 | 68.4° | 180.0° |
| C38 | C37 | C39 | H64 | 51.6° | 60.0° |
| C38 | C37 | C39 | H65 | 171.6° | 60.0° |
| C39 | C37 | C38 | H60 | 68.0° | 54.7° |
| C39 | C37 | C38 | H61 | 172.0° | 65.3° |
| C39 | C37 | C38 | H62 | 52.0° | 174.7° |
| C37 | C39 | H63 | H64 | 120.0° | 120.0° |
| C37 | C39 | H63 | H65 | 120.0° | 120.0° |
| C37 | C39 | H64 | H65 | 120.0° | 120.0° |
| H59 | C37 | C38 | H60 | 59.0° | 174.7° |
| H59 | C37 | C38 | H61 | 61.1° | 54.7° |
| H59 | C37 | C38 | H62 | 179.0° | 65.2° |
| H59 | C37 | C39 | H63 | 58.0° | 60.0° |
| H59 | C37 | C39 | H64 | 178.0° | 60.1° |
| H59 | C37 | C39 | H65 | 62.0° | 180.0° |
| H60 | C38 | H61 | H62 | 120.0° | 120.0° |
| H63 | C39 | H64 | H65 | 119.9° | 119.9° |
| C40 | N11 | H66 | C36 | 180.0° | 179.9° |
| N11 | C40 | C41 | C42 | 114.5° | 120.0° |
| N11 | C40 | C41 | C43 | 120.8° | 120.0° |
| N11 | C40 | C42 | C43 | 119.5° | 120.0° |
| N11 | C40 | C41 | O12 | 134.7° | 145.0° |
| N11 | C40 | C42 | H67 | 180.0° | 60.0° |
| N11 | C40 | C42 | H68 | 60.0° | 180.0° |
| N11 | C40 | C42 | H69 | 60.0° | 60.0° |
| N11 | C40 | C43 | H70 | 180.0° | 60.0° |
| N11 | C40 | C43 | H71 | 60.0° | 180.0° |
| N11 | C40 | C43 | H72 | 60.0° | 60.0° |
| N11 | C40 | C41 | N12 | 35.9° | 35.0° |
| H66 | N11 | C40 | C41 | 117.6° | 0.0° |
| H66 | N11 | C40 | C42 | 2.7° | 120.0° |
| H66 | N11 | C40 | C43 | 117.1° | 120.0° |
| C41 | C40 | C42 | C43 | 128.4° | 120.0° |
| C40 | C41 | O12 | N12 | 171.2° | 180.0° |
| C41 | C40 | C42 | H67 | 67.9° | 180.0° |
| C41 | C40 | C42 | H68 | 172.1° | 60.0° |
| C41 | C40 | C42 | H69 | 52.2° | 60.0° |
| C41 | C40 | C43 | H70 | 62.2° | 60.0° |
| C41 | C40 | C43 | H71 | 57.8° | 60.0° |
| C41 | C40 | C43 | H72 | 177.9° | 180.0° |
| C40 | C41 | N12 | C44 | 176.0° | 180.0° |
| C40 | C41 | N12 | H73 | 4.0° | 0.1° |
| C41 | C40 | N11 | C36 | 62.4° | 179.9° |
| C42 | C40 | C41 | O12 | 110.8° | 25.0° |
| C40 | C42 | H67 | H68 | 120.0° | 120.0° |
| C40 | C42 | H67 | H69 | 120.0° | 120.0° |
| C40 | C42 | H68 | H69 | 120.0° | 120.0° |
| C42 | C40 | C43 | H70 | 61.6° | 180.0° |
| C42 | C40 | C43 | H71 | 178.4° | 60.0° |
| C42 | C40 | C43 | H72 | 58.3° | 60.0° |
| C42 | C40 | N11 | C36 | 177.3° | 60.0° |
| C42 | C40 | C41 | N12 | 78.6° | 155.0° |
| C43 | C40 | C41 | O12 | 13.8° | 95.0° |
| C43 | C40 | C42 | H67 | 60.5° | 60.0° |
| C43 | C40 | C42 | H68 | 59.5° | 60.0° |
| C43 | C40 | C42 | H69 | 179.5° | 180.0° |
| C40 | C43 | H70 | H71 | 120.0° | 120.0° |
| C40 | C43 | H70 | H72 | 120.0° | 120.0° |
| C40 | C43 | H71 | H72 | 120.0° | 120.0° |
| C43 | C40 | N11 | C36 | 62.9° | 60.0° |
| C43 | C40 | C41 | N12 | 156.8° | 85.0° |
| O12 | C41 | N12 | C44 | 13.6° | 0.0° |
| O12 | C41 | N12 | H73 | 166.4° | 180.0° |
| H67 | C42 | H68 | H69 | 120.0° | 120.0° |
| H70 | C43 | H71 | H72 | 120.0° | 120.0° |
| C44 | N12 | H73 | C41 | 180.0° | 179.9° |
| N12 | C44 | C45 | H74 | 120.0° | 120.0° |
| N12 | C44 | C45 | H75 | 120.0° | 119.9° |
| N12 | C44 | H74 | H75 | 120.0° | 120.0° |
| N12 | C44 | C45 | O13 | 154.9° | 0.0° |
| N12 | C44 | C45 | N13 | 27.0° | 180.0° |
| H73 | N12 | C44 | C45 | 100.9° | 0.1° |
| H73 | N12 | C44 | H74 | 139.1° | 120.0° |
| H73 | N12 | C44 | H75 | 19.0° | 120.0° |
| C45 | C44 | H74 | H75 | 120.0° | 120.0° |
| C44 | C45 | O13 | N13 | 178.2° | 180.0° |
| C44 | C45 | N13 | C46 | 178.6° | 175.0° |
| C44 | C45 | N13 | H76 | 1.4° | 5.0° |
| C45 | C44 | N12 | C41 | 79.1° | 180.0° |
| H74 | C44 | C45 | O13 | 34.9° | 120.0° |
| H74 | C44 | N12 | C41 | 40.9° | 60.0° |
| H74 | C44 | C45 | N13 | 147.0° | 60.0° |
| H75 | C44 | C45 | O13 | 85.1° | 120.0° |
| H75 | C44 | N12 | C41 | 161.0° | 60.1° |
| H75 | C44 | C45 | N13 | 93.0° | 60.0° |
| O13 | C45 | N13 | C46 | 0.4° | 5.0° |
| O13 | C45 | N13 | H76 | 179.6° | 175.0° |
| C46 | N13 | H76 | C45 | 180.0° | 179.9° |
| N13 | C46 | C47 | C48 | 124.6° | 120.0° |
| N13 | C46 | C47 | H77 | 116.5° | 120.0° |
| N13 | C46 | C48 | H77 | 123.8° | 120.0° |
| N13 | C46 | C47 | O14 | 149.1° | 12.9° |
| N13 | C46 | C48 | C49 | 64.8° | 179.0° |
| N13 | C46 | C48 | H78 | 54.8° | 59.0° |
| N13 | C46 | C48 | H79 | 175.5° | 61.0° |
| N13 | C46 | C47 | N14 | 36.8° | 167.2° |
| H76 | N13 | C46 | C47 | 95.8° | 29.1° |
| H76 | N13 | C46 | C48 | 23.2° | 90.9° |
| H76 | N13 | C46 | H77 | 147.0° | 149.1° |
| C47 | C46 | C48 | H77 | 119.5° | 120.0° |
| C46 | C47 | O14 | N14 | 174.6° | 179.9° |
| C47 | C46 | C48 | C49 | 178.4° | 61.0° |
| C47 | C46 | C48 | H78 | 61.9° | 179.1° |
| C47 | C46 | C48 | H79 | 58.8° | 59.0° |
| C46 | C47 | N14 | C52 | 167.9° | 176.0° |
| C46 | C47 | N14 | H87 | 12.1° | 4.1° |
| C47 | C46 | N13 | C45 | 84.2° | 150.9° |
| C48 | C46 | C47 | O14 | 86.3° | 107.1° |
| C46 | C48 | C49 | H78 | 119.6° | 120.0° |
| C46 | C48 | C49 | H79 | 119.7° | 120.0° |
| C46 | C48 | H78 | H79 | 121.0° | 120.0° |
| C46 | C48 | C49 | C50 | 174.3° | 64.8° |
| C46 | C48 | C49 | C51 | 72.3° | 175.3° |
| C46 | C48 | C49 | H80 | 51.4° | 55.2° |
| C48 | C46 | C47 | N14 | 87.7° | 72.8° |
| C48 | C46 | N13 | C45 | 156.8° | 89.1° |
| H77 | C46 | C47 | O14 | 32.6° | 132.9° |
| H77 | C46 | C48 | C49 | 58.9° | 59.1° |
| H77 | C46 | C48 | H78 | 178.6° | 60.9° |
| H77 | C46 | C48 | H79 | 60.7° | 179.0° |
| H77 | C46 | C47 | N14 | 153.3° | 47.2° |
| H77 | C46 | N13 | C45 | 33.0° | 30.9° |
| O14 | C47 | N14 | C52 | 5.9° | 3.9° |
| O14 | C47 | N14 | H87 | 174.1° | 176.0° |
| C49 | C48 | H78 | H79 | 121.1° | 120.0° |
| C48 | C49 | C50 | C51 | 114.3° | 120.0° |
| C48 | C49 | C50 | H80 | 123.5° | 120.0° |
| C48 | C49 | C51 | H80 | 123.9° | 120.0° |
| C48 | C49 | C50 | H81 | 180.0° | 54.6° |
| C48 | C49 | C50 | H82 | 60.0° | 174.6° |
| C48 | C49 | C50 | H83 | 60.0° | 65.4° |
| C48 | C49 | C51 | H84 | 180.0° | 60.0° |
| C48 | C49 | C51 | H85 | 60.0° | 180.0° |
| C48 | C49 | C51 | H86 | 60.0° | 60.0° |
| H78 | C48 | C49 | C50 | 54.6° | 55.2° |
| H78 | C48 | C49 | C51 | 168.0° | 64.7° |
| H78 | C48 | C49 | H80 | 68.3° | 175.2° |
| H79 | C48 | C49 | C50 | 66.1° | 175.3° |
| H79 | C48 | C49 | C51 | 47.3° | 55.3° |
| H79 | C48 | C49 | H80 | 171.0° | 64.7° |
| C50 | C49 | C51 | H80 | 121.8° | 120.0° |
| C49 | C50 | H81 | H82 | 120.0° | 120.0° |
| C49 | C50 | H81 | H83 | 120.0° | 120.0° |
| C49 | C50 | H82 | H83 | 120.0° | 120.1° |
| C50 | C49 | C51 | H84 | 65.6° | 180.0° |
| C50 | C49 | C51 | H85 | 54.4° | 60.1° |
| C50 | C49 | C51 | H86 | 174.4° | 60.0° |
| C51 | C49 | C50 | H81 | 65.7° | 65.3° |
| C51 | C49 | C50 | H82 | 174.3° | 54.6° |
| C51 | C49 | C50 | H83 | 54.3° | 174.7° |
| C49 | C51 | H84 | H85 | 120.0° | 119.9° |
| C49 | C51 | H84 | H86 | 120.0° | 120.0° |
| C49 | C51 | H85 | H86 | 120.0° | 120.0° |
| H80 | C49 | C50 | H81 | 56.5° | 174.7° |
| H80 | C49 | C50 | H82 | 63.5° | 65.4° |
| H80 | C49 | C50 | H83 | 176.5° | 54.7° |
| H80 | C49 | C51 | H84 | 56.2° | 60.0° |
| H80 | C49 | C51 | H85 | 176.2° | 59.9° |
| H80 | C49 | C51 | H86 | 63.9° | 180.0° |
| H81 | C50 | H82 | H83 | 120.0° | 119.9° |
| H84 | C51 | H85 | H86 | 120.0° | 120.0° |
| C52 | N14 | H87 | C47 | 180.0° | 179.9° |
| N14 | C52 | C53 | C54 | 115.2° | 120.0° |
| N14 | C52 | C53 | C55 | 120.6° | 120.0° |
| N14 | C52 | C54 | C55 | 111.6° | 120.0° |
| N14 | C52 | C53 | O15 | 139.6° | 131.0° |
| N14 | C52 | C54 | H88 | 180.0° | 60.0° |
| N14 | C52 | C54 | H89 | 60.0° | 180.0° |
| N14 | C52 | C54 | H90 | 60.0° | 60.0° |
| N14 | C52 | C55 | H91 | 180.0° | 60.1° |
| N14 | C52 | C55 | H92 | 60.0° | 180.0° |
| N14 | C52 | C55 | H93 | 60.0° | 60.0° |
| N14 | C52 | C53 | N15 | 32.8° | 49.0° |
| H87 | N14 | C52 | C53 | 126.1° | 3.0° |
| H87 | N14 | C52 | C54 | 6.4° | 117.0° |
| H87 | N14 | C52 | C55 | 110.0° | 123.0° |
| C53 | C52 | C54 | C55 | 124.2° | 120.0° |
| C52 | C53 | O15 | N15 | 172.7° | 180.0° |
| C53 | C52 | C54 | H88 | 55.8° | 180.0° |
| C53 | C52 | C54 | H89 | 175.8° | 60.0° |
| C53 | C52 | C54 | H90 | 64.2° | 60.0° |
| C53 | C52 | C55 | H91 | 52.9° | 59.9° |
| C53 | C52 | C55 | H92 | 67.1° | 60.0° |
| C53 | C52 | C55 | H93 | 173.0° | 180.0° |
| C52 | C53 | N15 | C56 | 175.7° | 176.4° |
| C52 | C53 | N15 | C60 | 15.0° | 3.2° |
| C53 | C52 | N14 | C47 | 53.9° | 176.9° |
| C54 | C52 | C53 | O15 | 105.2° | 10.9° |
| C52 | C54 | H88 | H89 | 120.0° | 120.0° |
| C52 | C54 | H88 | H90 | 120.0° | 120.0° |
| C52 | C54 | H89 | H90 | 120.0° | 120.0° |
| C54 | C52 | C55 | H91 | 70.4° | 179.9° |
| C54 | C52 | C55 | H92 | 169.6° | 60.0° |
| C54 | C52 | C55 | H93 | 49.6° | 60.0° |
| C54 | C52 | N14 | C47 | 173.6° | 63.0° |
| C54 | C52 | C53 | N15 | 82.5° | 169.0° |
| C55 | C52 | C53 | O15 | 19.0° | 109.1° |
| C55 | C52 | C54 | H88 | 68.4° | 60.0° |
| C55 | C52 | C54 | H89 | 51.6° | 60.0° |
| C55 | C52 | C54 | H90 | 171.6° | 180.0° |
| C52 | C55 | H91 | H92 | 120.0° | 119.9° |
| C52 | C55 | H91 | H93 | 120.0° | 120.1° |
| C52 | C55 | H92 | H93 | 120.0° | 120.0° |
| C55 | C52 | N14 | C47 | 70.0° | 57.0° |
| C55 | C52 | C53 | N15 | 153.4° | 70.9° |
| O15 | C53 | N15 | C56 | 12.3° | 3.6° |
| O15 | C53 | N15 | C60 | 173.0° | 176.7° |
| H88 | C54 | H89 | H90 | 120.0° | 120.0° |
| H91 | C55 | H92 | H93 | 120.0° | 120.1° |
| C56 | N15 | C60 | C53 | 163.4° | 179.7° |
| N15 | C56 | C57 | C58 | 116.1° | 117.8° |
| N15 | C56 | C57 | H94 | 119.0° | 121.0° |
| N15 | C56 | C58 | H94 | 119.5° | 119.6° |
| N15 | C56 | C57 | O16 | 148.8° | 0.0° |
| N15 | C56 | C58 | C59 | 26.2° | 22.2° |
| N15 | C56 | C58 | H95 | 92.8° | 140.6° |
| N15 | C56 | C58 | H96 | 145.3° | 96.2° |
| C56 | N15 | C60 | C59 | 27.0° | 24.4° |
| C56 | N15 | C60 | H99 | 146.6° | 94.5° |
| C56 | N15 | C60 | H100 | 92.5° | 143.2° |
| N15 | C56 | C57 | N16 | 30.4° | 180.0° |
| C60 | N15 | C56 | C57 | 123.3° | 120.7° |
| C60 | N15 | C56 | C58 | 1.1° | 1.3° |
| C60 | N15 | C56 | H94 | 118.1° | 118.3° |
| N15 | C60 | C59 | C58 | 41.2° | 37.3° |
| N15 | C60 | C59 | H99 | 119.6° | 118.9° |
| N15 | C60 | C59 | H100 | 119.5° | 118.8° |
| N15 | C60 | C59 | H97 | 159.3° | 80.8° |
| N15 | C60 | C59 | H98 | 76.9° | 155.3° |
| N15 | C60 | H99 | H100 | 121.2° | 122.3° |
| C57 | C56 | C58 | H94 | 124.9° | 121.0° |
| C56 | C57 | O16 | N16 | 179.2° | 180.0° |
| C57 | C56 | C58 | C59 | 141.9° | 97.3° |
| C57 | C56 | C58 | H95 | 22.8° | 21.1° |
| C57 | C56 | C58 | H96 | 99.1° | 144.4° |
| C56 | C57 | N16 | C61 | 179.2° | 180.0° |
| C56 | C57 | N16 | H101 | 0.8° | 0.0° |
| C57 | C56 | N15 | C53 | 72.6° | 59.6° |
| C58 | C56 | C57 | O16 | 95.0° | 117.8° |
| C56 | C58 | C59 | H95 | 119.1° | 118.4° |
| C56 | C58 | C59 | H96 | 119.1° | 118.4° |
| C56 | C58 | H95 | H96 | 122.8° | 123.3° |
| C56 | C58 | C59 | C60 | 41.1° | 35.6° |
| C56 | C58 | C59 | H97 | 159.2° | 82.6° |
| C56 | C58 | C59 | H98 | 77.0° | 153.6° |
| C58 | C56 | N15 | C53 | 165.2° | 179.0° |
| C58 | C56 | C57 | N16 | 85.7° | 62.2° |
| H94 | C56 | C57 | O16 | 29.9° | 121.1° |
| H94 | C56 | C58 | C59 | 93.2° | 141.7° |
| H94 | C56 | C58 | H95 | 147.7° | 99.9° |
| H94 | C56 | C58 | H96 | 25.8° | 23.4° |
| H94 | C56 | N15 | C53 | 46.0° | 61.4° |
| H94 | C56 | C57 | N16 | 149.3° | 59.0° |
| O16 | C57 | N16 | C61 | 1.7° | 0.0° |
| O16 | C57 | N16 | H101 | 178.3° | 180.0° |
| C59 | C58 | H95 | H96 | 122.7° | 123.2° |
| C58 | C59 | C60 | H97 | 118.1° | 118.1° |
| C58 | C59 | C60 | H98 | 118.1° | 118.0° |
| C58 | C59 | H97 | H98 | 125.3° | 124.0° |
| C58 | C59 | C60 | H99 | 160.8° | 81.6° |
| C58 | C59 | C60 | H100 | 78.3° | 156.1° |
| H95 | C58 | C59 | C60 | 78.0° | 154.0° |
| H95 | C58 | C59 | H97 | 40.2° | 35.8° |
| H95 | C58 | C59 | H98 | 163.9° | 88.1° |
| H96 | C58 | C59 | C60 | 160.2° | 82.7° |
| H96 | C58 | C59 | H97 | 81.7° | 159.1° |
| H96 | C58 | C59 | H98 | 42.0° | 35.2° |
| C60 | C59 | H97 | H98 | 125.3° | 123.9° |
| C59 | C60 | H99 | H100 | 121.3° | 122.3° |
| C59 | C60 | N15 | C53 | 136.3° | 155.8° |
| H97 | C59 | C60 | H99 | 81.1° | 160.3° |
| H97 | C59 | C60 | H100 | 39.8° | 38.0° |
| H98 | C59 | C60 | H99 | 42.6° | 36.4° |
| H98 | C59 | C60 | H100 | 163.5° | 85.9° |
| H99 | C60 | N15 | C53 | 16.8° | 85.2° |
| H100 | C60 | N15 | C53 | 104.1° | 37.1° |
| C61 | N16 | H101 | C57 | 180.0° | 180.0° |
| N16 | C61 | C62 | C63 | 111.6° | 120.0° |
| N16 | C61 | C62 | H102 | 121.6° | 120.0° |
| N16 | C61 | C63 | H102 | 120.7° | 120.0° |
| N16 | C61 | C62 | O17 | 140.8° | 3.5° |
| N16 | C61 | C63 | C64 | 162.5° | 61.2° |
| N16 | C61 | C63 | C65 | 68.9° | 58.8° |
| N16 | C61 | C63 | H103 | 45.4° | 178.8° |
| N16 | C61 | C62 | N17 | 60.5° | 176.5° |
| H101 | N16 | C61 | C62 | 115.1° | 25.0° |
| H101 | N16 | C61 | C63 | 3.1° | 95.1° |
| H101 | N16 | C61 | H102 | 122.9° | 145.0° |
| C62 | C61 | C63 | H102 | 127.9° | 120.0° |
| C61 | C62 | O17 | N17 | 160.8° | 180.0° |
| C62 | C61 | C63 | C64 | 51.1° | 178.8° |
| C62 | C61 | C63 | C65 | 179.7° | 61.2° |
| C62 | C61 | C63 | H103 | 66.0° | 58.7° |
| C61 | C62 | N17 | C66 | 177.6° | 175.6° |
| C61 | C62 | N17 | H110 | 2.4° | 4.5° |
| C62 | C61 | N16 | C57 | 64.8° | 155.0° |
| C63 | C61 | C62 | O17 | 107.7° | 116.5° |
| C61 | C63 | C64 | C65 | 116.4° | 120.0° |
| C61 | C63 | C64 | H103 | 116.7° | 120.0° |
| C61 | C63 | C65 | H103 | 113.6° | 120.0° |
| C61 | C63 | C64 | H104 | 180.0° | 57.7° |
| C61 | C63 | C64 | H105 | 60.0° | 177.6° |
| C61 | C63 | C64 | H106 | 60.0° | 62.4° |
| C61 | C63 | C65 | H107 | 180.0° | 60.0° |
| C61 | C63 | C65 | H108 | 60.0° | 180.0° |
| C61 | C63 | C65 | H109 | 60.0° | 60.0° |
| C63 | C61 | C62 | N17 | 51.1° | 63.5° |
| C63 | C61 | N16 | C57 | 176.9° | 85.0° |
| H102 | C61 | C62 | O17 | 19.2° | 123.6° |
| H102 | C61 | C63 | C64 | 76.8° | 58.8° |
| H102 | C61 | C63 | C65 | 51.8° | 178.8° |
| H102 | C61 | C63 | H103 | 166.1° | 61.2° |
| H102 | C61 | C62 | N17 | 177.9° | 56.5° |
| H102 | C61 | N16 | C57 | 57.1° | 35.0° |
| O17 | C62 | N17 | C66 | 19.5° | 4.4° |
| O17 | C62 | N17 | H110 | 160.5° | 175.5° |
| C64 | C63 | C65 | H103 | 126.8° | 120.0° |
| C63 | C64 | H104 | H105 | 120.0° | 120.0° |
| C63 | C64 | H104 | H106 | 120.0° | 120.1° |
| C63 | C64 | H105 | H106 | 120.0° | 120.0° |
| C64 | C63 | C65 | H107 | 60.5° | 180.0° |
| C64 | C63 | C65 | H108 | 59.5° | 60.0° |
| C64 | C63 | C65 | H109 | 179.6° | 60.0° |
| C65 | C63 | C64 | H104 | 63.6° | 62.3° |
| C65 | C63 | C64 | H105 | 176.4° | 57.6° |
| C65 | C63 | C64 | H106 | 56.3° | 177.6° |
| C63 | C65 | H107 | H108 | 120.0° | 120.0° |
| C63 | C65 | H107 | H109 | 120.0° | 120.0° |
| C63 | C65 | H108 | H109 | 120.0° | 120.0° |
| H103 | C63 | C64 | H104 | 63.3° | 177.7° |
| H103 | C63 | C64 | H105 | 56.7° | 62.4° |
| H103 | C63 | C64 | H106 | 176.7° | 57.6° |
| H103 | C63 | C65 | H107 | 66.3° | 60.0° |
| H103 | C63 | C65 | H108 | 173.6° | 60.0° |
| H103 | C63 | C65 | H109 | 53.6° | 180.0° |
| H104 | C64 | H105 | H106 | 119.9° | 120.0° |
| H107 | C65 | H108 | H109 | 120.0° | 119.9° |
| C66 | N17 | H110 | C62 | 180.0° | 179.9° |
| N17 | C66 | C67 | C68 | 121.8° | 120.1° |
| N17 | C66 | C67 | C69 | 119.6° | 119.9° |
| N17 | C66 | C68 | C69 | 121.9° | 120.0° |
| N17 | C66 | C67 | O18 | 131.4° | 145.0° |
| N17 | C66 | C68 | H111 | 180.0° | 60.0° |
| N17 | C66 | C68 | H112 | 60.0° | 180.0° |
| N17 | C66 | C68 | H113 | 60.0° | 60.0° |
| N17 | C66 | C69 | H114 | 180.0° | 60.0° |
| N17 | C66 | C69 | H115 | 60.0° | 180.0° |
| N17 | C66 | C69 | H116 | 60.0° | 60.0° |
| N17 | C66 | C67 | N18 | 55.0° | 34.9° |
| H110 | N17 | C66 | C67 | 132.8° | 0.1° |
| H110 | N17 | C66 | C68 | 14.4° | 119.9° |
| H110 | N17 | C66 | C69 | 107.2° | 120.1° |
| C67 | C66 | C68 | C69 | 119.4° | 120.0° |
| C66 | C67 | O18 | N18 | 173.5° | 179.9° |
| C67 | C66 | C68 | H111 | 61.3° | 180.0° |
| C67 | C66 | C68 | H112 | 178.7° | 60.0° |
| C67 | C66 | C68 | H113 | 58.7° | 60.0° |
| C67 | C66 | C69 | H114 | 61.4° | 59.9° |
| C67 | C66 | C69 | H115 | 58.7° | 60.0° |
| C67 | C66 | C69 | H116 | 178.6° | 180.0° |
| C66 | C67 | N18 | C70 | 174.5° | 180.0° |
| C66 | C67 | N18 | H117 | 5.5° | 0.1° |
| C67 | C66 | N17 | C62 | 47.3° | 180.0° |
| C68 | C66 | C67 | O18 | 106.8° | 24.9° |
| C66 | C68 | H111 | H112 | 120.0° | 120.0° |
| C66 | C68 | H111 | H113 | 120.0° | 120.0° |
| C66 | C68 | H112 | H113 | 120.0° | 120.0° |
| C68 | C66 | C69 | H114 | 56.1° | 179.9° |
| C68 | C66 | C69 | H115 | 176.2° | 60.0° |
| C68 | C66 | C69 | H116 | 63.9° | 60.0° |
| C68 | C66 | N17 | C62 | 165.6° | 60.0° |
| C68 | C66 | C67 | N18 | 66.8° | 155.0° |
| C69 | C66 | C67 | O18 | 11.8° | 95.1° |
| C69 | C66 | C68 | H111 | 58.1° | 60.0° |
| C69 | C66 | C68 | H112 | 61.9° | 60.0° |
| C69 | C66 | C68 | H113 | 178.1° | 180.0° |
| C66 | C69 | H114 | H115 | 120.0° | 120.0° |
| C66 | C69 | H114 | H116 | 120.0° | 120.0° |
| C66 | C69 | H115 | H116 | 120.0° | 120.0° |
| C69 | C66 | N17 | C62 | 72.8° | 60.0° |
| C69 | C66 | C67 | N18 | 174.6° | 85.0° |
| O18 | C67 | N18 | C70 | 0.8° | 0.0° |
| O18 | C67 | N18 | H117 | 179.1° | 180.0° |
| H111 | C68 | H112 | H113 | 120.0° | 120.0° |
| H114 | C69 | H115 | H116 | 120.0° | 120.0° |
| C70 | N18 | H117 | C67 | 180.0° | 180.0° |
| N18 | C70 | C71 | C72 | 118.3° | 120.0° |
| N18 | C70 | C71 | C73 | 122.1° | 120.0° |
| N18 | C70 | C72 | C73 | 119.6° | 120.0° |
| N18 | C70 | C71 | O19 | 127.9° | 145.0° |
| N18 | C70 | C72 | H118 | 180.0° | 60.0° |
| N18 | C70 | C72 | H119 | 60.0° | 180.0° |
| N18 | C70 | C72 | H120 | 60.0° | 60.0° |
| N18 | C70 | C73 | H121 | 180.0° | 60.0° |
| N18 | C70 | C73 | H122 | 60.0° | 180.0° |
| N18 | C70 | C73 | H123 | 60.0° | 60.0° |
| N18 | C70 | C71 | N19 | 39.1° | 35.0° |
| H117 | N18 | C70 | C71 | 130.2° | 0.0° |
| H117 | N18 | C70 | C72 | 13.6° | 120.0° |
| H117 | N18 | C70 | C73 | 107.5° | 120.0° |
| C71 | C70 | C72 | C73 | 118.1° | 120.0° |
| C70 | C71 | O19 | N19 | 165.3° | 180.0° |
| C71 | C70 | C72 | H118 | 57.7° | 180.0° |
| C71 | C70 | C72 | H119 | 177.7° | 60.0° |
| C71 | C70 | C72 | H120 | 62.3° | 60.0° |
| C71 | C70 | C73 | H121 | 54.8° | 60.0° |
| C71 | C70 | C73 | H122 | 65.2° | 60.0° |
| C71 | C70 | C73 | H123 | 174.8° | 180.0° |
| C70 | C71 | N19 | C74 | 176.3° | 180.0° |
| C70 | C71 | N19 | H124 | 3.7° | 0.0° |
| C71 | C70 | N18 | C67 | 49.8° | 180.0° |
| C72 | C70 | C71 | O19 | 113.8° | 25.0° |
| C70 | C72 | H118 | H119 | 120.0° | 120.0° |
| C70 | C72 | H118 | H120 | 120.0° | 120.0° |
| C70 | C72 | H119 | H120 | 120.0° | 120.0° |
| C72 | C70 | C73 | H121 | 60.9° | 180.0° |
| C72 | C70 | C73 | H122 | 179.1° | 60.0° |
| C72 | C70 | C73 | H123 | 59.2° | 60.0° |
| C72 | C70 | N18 | C67 | 166.4° | 60.0° |
| C72 | C70 | C71 | N19 | 79.3° | 155.0° |
| C73 | C70 | C71 | O19 | 5.8° | 95.0° |
| C73 | C70 | C72 | H118 | 60.4° | 60.0° |
| C73 | C70 | C72 | H119 | 59.6° | 60.0° |
| C73 | C70 | C72 | H120 | 179.6° | 180.0° |
| C70 | C73 | H121 | H122 | 120.0° | 120.0° |
| C70 | C73 | H121 | H123 | 120.0° | 120.0° |
| C70 | C73 | H122 | H123 | 120.0° | 120.0° |
| C73 | C70 | N18 | C67 | 72.5° | 60.0° |
| C73 | C70 | C71 | N19 | 161.2° | 85.0° |
| O19 | C71 | N19 | C74 | 17.7° | 0.0° |
| O19 | C71 | N19 | H124 | 162.3° | 180.0° |
| H118 | C72 | H119 | H120 | 120.0° | 120.0° |
| H121 | C73 | H122 | H123 | 120.0° | 120.0° |
| C74 | N19 | H124 | C71 | 180.0° | 179.9° |
| N19 | C74 | C75 | C76 | 129.3° | 120.0° |
| N19 | C74 | C75 | H125 | 115.6° | 120.0° |
| N19 | C74 | C76 | H125 | 112.0° | 120.0° |
| N19 | C74 | C75 | O20 | 180.0° | 0.0° |
| N19 | C74 | C76 | C77 | 69.1° | 65.0° |
| N19 | C74 | C76 | H126 | 52.7° | 55.0° |
| N19 | C74 | C76 | H127 | 169.1° | 175.0° |
| N19 | C74 | C75 | N20 | 4.2° | 180.0° |
| H124 | N19 | C74 | C75 | 104.5° | 25.1° |
| H124 | N19 | C74 | C76 | 27.7° | 95.0° |
| H124 | N19 | C74 | H125 | 140.0° | 145.0° |
| C75 | C74 | C76 | H125 | 114.9° | 120.0° |
| C74 | C75 | O20 | N20 | 175.8° | 180.0° |
| C75 | C74 | C76 | C77 | 157.9° | 175.0° |
| C75 | C74 | C76 | H126 | 80.3° | 65.0° |
| C75 | C74 | C76 | H127 | 36.1° | 55.0° |
| C74 | C75 | N20 | C79 | 177.7° | 180.0° |
| C74 | C75 | N20 | H131 | 2.3° | 0.1° |
| C75 | C74 | N19 | C71 | 75.5° | 155.0° |
| C76 | C74 | C75 | O20 | 50.7° | 120.0° |
| C74 | C76 | C77 | H126 | 121.8° | 120.0° |
| C74 | C76 | C77 | H127 | 121.8° | 120.0° |
| C74 | C76 | H126 | H127 | 114.2° | 120.0° |
| C74 | C76 | C77 | C78 | 62.7° | 180.0° |
| C74 | C76 | C77 | H128 | 56.3° | 60.0° |
| C74 | C76 | C77 | H129 | 178.4° | 60.0° |
| C76 | C74 | N19 | C71 | 152.3° | 85.0° |
| C76 | C74 | C75 | N20 | 125.1° | 60.0° |
| H125 | C74 | C75 | O20 | 64.4° | 120.0° |
| H125 | C74 | C76 | C77 | 43.0° | 55.0° |
| H125 | C74 | C76 | H126 | 164.7° | 175.0° |
| H125 | C74 | C76 | H127 | 78.8° | 65.0° |
| H125 | C74 | N19 | C71 | 40.0° | 35.0° |
| H125 | C74 | C75 | N20 | 119.8° | 60.0° |
| O20 | C75 | N20 | C79 | 6.1° | 0.0° |
| O20 | C75 | N20 | H131 | 173.9° | 180.0° |
| C77 | C76 | H126 | H127 | 114.1° | 120.0° |
| C76 | C77 | C78 | H128 | 119.0° | 120.0° |
| C76 | C77 | C78 | H129 | 119.0° | 119.9° |
| C76 | C77 | H128 | H129 | 123.0° | 120.0° |
| C76 | C77 | C78 | O21 | 127.3° | 0.0° |
| C76 | C77 | C78 | O22 | 73.4° | 180.0° |
| H126 | C76 | C77 | C78 | 175.5° | 60.0° |
| H126 | C76 | C77 | H128 | 65.5° | 180.0° |
| H126 | C76 | C77 | H129 | 56.6° | 60.0° |
| H127 | C76 | C77 | C78 | 59.1° | 60.0° |
| H127 | C76 | C77 | H128 | 178.1° | 60.0° |
| H127 | C76 | C77 | H129 | 59.8° | 180.0° |
| C78 | C77 | H128 | H129 | 123.0° | 120.0° |
| C77 | C78 | O21 | O22 | 159.0° | 180.0° |
| C77 | C78 | O22 | H130 | 159.1° | 179.9° |
| H128 | C77 | C78 | O21 | 8.3° | 120.0° |
| H128 | C77 | C78 | O22 | 167.6° | 60.0° |
| H129 | C77 | C78 | O21 | 113.7° | 120.0° |
| H129 | C77 | C78 | O22 | 45.6° | 60.1° |
| O21 | C78 | O22 | H130 | 0.0° | 0.1° |
| C79 | N20 | H131 | C75 | 180.0° | 179.9° |
| N20 | C79 | C80 | C81 | 127.0° | 120.0° |
| N20 | C79 | C80 | H132 | 113.5° | 119.9° |
| N20 | C79 | C81 | H132 | 117.2° | 120.0° |
| N20 | C79 | C80 | O23 | 178.9° | 0.1° |
| N20 | C79 | C81 | C82 | 41.6° | 65.0° |
| N20 | C79 | C81 | H133 | 79.5° | 55.0° |
| N20 | C79 | C81 | H134 | 162.6° | 175.1° |
| N20 | C79 | C80 | N22 | 7.2° | 180.0° |
| H131 | N20 | C79 | C80 | 86.3° | 25.1° |
| H131 | N20 | C79 | C81 | 43.5° | 95.0° |
| H131 | N20 | C79 | H132 | 160.5° | 145.0° |
| C80 | C79 | C81 | H132 | 119.6° | 120.0° |
| C79 | C80 | O23 | N22 | 173.8° | 179.9° |
| C80 | C79 | C81 | C82 | 164.8° | 175.0° |
| C80 | C79 | C81 | H133 | 43.7° | 65.0° |
| C80 | C79 | C81 | H134 | 74.2° | 55.0° |
| C79 | C80 | N22 | C84 | 176.4° | 180.0° |
| C79 | C80 | N22 | H139 | 3.6° | 0.1° |
| C80 | C79 | N20 | C75 | 93.7° | 155.0° |
| C81 | C79 | C80 | O23 | 54.1° | 119.9° |
| C79 | C81 | C82 | H133 | 121.1° | 120.0° |
| C79 | C81 | C82 | H134 | 121.0° | 120.0° |
| C79 | C81 | H133 | H134 | 116.7° | 120.0° |
| C79 | C81 | C82 | C83 | 41.3° | 180.0° |
| C79 | C81 | C82 | H135 | 79.5° | 60.0° |
| C79 | C81 | C82 | H136 | 162.2° | 60.0° |
| C81 | C79 | C80 | N22 | 119.8° | 60.0° |
| C81 | C79 | N20 | C75 | 136.5° | 85.0° |
| H132 | C79 | C80 | O23 | 65.4° | 120.0° |
| H132 | C79 | C81 | C82 | 75.7° | 55.0° |
| H132 | C79 | C81 | H133 | 163.3° | 175.0° |
| H132 | C79 | C81 | H134 | 45.4° | 65.0° |
| H132 | C79 | C80 | N22 | 120.6° | 60.1° |
| H132 | C79 | N20 | C75 | 19.5° | 35.0° |
| O23 | C80 | N22 | C84 | 3.1° | 0.1° |
| O23 | C80 | N22 | H139 | 176.9° | 180.0° |
| C82 | C81 | H133 | H134 | 116.7° | 120.0° |
| C81 | C82 | C83 | H135 | 120.9° | 120.0° |
| C81 | C82 | C83 | H136 | 120.9° | 120.0° |
| C81 | C82 | H135 | H136 | 117.2° | 120.0° |
| C81 | C82 | C83 | O24 | 47.9° | 0.0° |
| C81 | C82 | C83 | N21 | 132.8° | 180.0° |
| H133 | C81 | C82 | C83 | 162.4° | 60.0° |
| H133 | C81 | C82 | H135 | 41.5° | 180.0° |
| H133 | C81 | C82 | H136 | 76.7° | 60.0° |
| H134 | C81 | C82 | C83 | 79.7° | 60.0° |
| H134 | C81 | C82 | H135 | 159.4° | 60.0° |
| H134 | C81 | C82 | H136 | 41.2° | 179.9° |
| C83 | C82 | H135 | H136 | 117.2° | 120.0° |
| C82 | C83 | O24 | N21 | 179.2° | 179.9° |
| C82 | C83 | N21 | H137 | 179.2° | 0.0° |
| C82 | C83 | N21 | H138 | 0.8° | 179.9° |
| H135 | C82 | C83 | O24 | 168.8° | 120.0° |
| H135 | C82 | C83 | N21 | 12.0° | 60.0° |
| H136 | C82 | C83 | O24 | 73.0° | 120.0° |
| H136 | C82 | C83 | N21 | 106.3° | 59.9° |
| O24 | C83 | N21 | H137 | 0.0° | 179.9° |
| O24 | C83 | N21 | H138 | 180.0° | 0.0° |
| C83 | N21 | H137 | H138 | 180.0° | 179.9° |
| C84 | N22 | H139 | C80 | 180.0° | 180.0° |
| N22 | C84 | C85 | C86 | 121.1° | 119.9° |
| N22 | C84 | C85 | H140 | 119.0° | 120.0° |
| N22 | C84 | C86 | H140 | 116.7° | 120.0° |
| N22 | C84 | C85 | O25 | 59.1° | 65.0° |
| N22 | C84 | C85 | H141 | 179.5° | 55.1° |
| N22 | C84 | C85 | H142 | 61.2° | 175.0° |
| N22 | C84 | C86 | C87 | 65.3° | 65.0° |
| N22 | C84 | C86 | H144 | 55.2° | 55.0° |
| N22 | C84 | C86 | H145 | 174.3° | 175.0° |
| H139 | N22 | C84 | C85 | 56.7° | 95.0° |
| H139 | N22 | C84 | C86 | 68.5° | 25.0° |
| H139 | N22 | C84 | H140 | 175.4° | 145.0° |
| C85 | C84 | C86 | H140 | 120.2° | 120.1° |
| C84 | C85 | O25 | H141 | 120.3° | 120.0° |
| C84 | C85 | O25 | H142 | 120.3° | 120.0° |
| C84 | C85 | H141 | H142 | 118.9° | 119.9° |
| C84 | C85 | O25 | H143 | 180.0° | 180.0° |
| C85 | C84 | C86 | C87 | 171.6° | 175.0° |
| C85 | C84 | C86 | H144 | 68.0° | 65.0° |
| C85 | C84 | C86 | H145 | 51.1° | 55.0° |
| C85 | C84 | N22 | C80 | 123.3° | 85.0° |
| C86 | C84 | C85 | O25 | 179.8° | 55.0° |
| C86 | C84 | C85 | H141 | 59.4° | 175.0° |
| C86 | C84 | C85 | H142 | 59.9° | 65.0° |
| C84 | C86 | C87 | H144 | 120.4° | 120.0° |
| C84 | C86 | C87 | H145 | 120.4° | 120.0° |
| C84 | C86 | H144 | H145 | 118.6° | 119.9° |
| C84 | C86 | C87 | C88 | 92.2° | 90.0° |
| C84 | C86 | C87 | C89 | 87.1° | 90.2° |
| C86 | C84 | N22 | C80 | 111.5° | 155.0° |
| H140 | C84 | C85 | O25 | 59.9° | 175.0° |
| H140 | C84 | C85 | H141 | 60.5° | 65.0° |
| H140 | C84 | C85 | H142 | 179.8° | 55.0° |
| H140 | C84 | C86 | C87 | 51.4° | 55.0° |
| H140 | C84 | C86 | H144 | 171.8° | 175.0° |
| H140 | C84 | C86 | H145 | 69.0° | 65.1° |
| H140 | C84 | N22 | C80 | 4.6° | 35.0° |
| O25 | C85 | H141 | H142 | 119.0° | 120.0° |
| H141 | C85 | O25 | H143 | 59.7° | 60.0° |
| H142 | C85 | O25 | H143 | 59.7° | 60.0° |
| C87 | C86 | H144 | H145 | 118.6° | 120.1° |
| C86 | C87 | C88 | C89 | 179.4° | 179.8° |
| C86 | C87 | C88 | C90 | 178.8° | 180.0° |
| C86 | C87 | C88 | H146 | 1.2° | 0.0° |
| C86 | C87 | C89 | C91 | 176.5° | 180.0° |
| C86 | C87 | C89 | H147 | 3.5° | 0.0° |
| H144 | C86 | C87 | C88 | 147.3° | 30.0° |
| H144 | C86 | C87 | C89 | 33.4° | 149.8° |
| H145 | C86 | C87 | C88 | 28.2° | 150.0° |
| H145 | C86 | C87 | C89 | 152.5° | 29.7° |
| C87 | C88 | C90 | H146 | 180.0° | 180.0° |
| C88 | C87 | C89 | C91 | 2.8° | 0.2° |
| C88 | C87 | C89 | H147 | 177.2° | 179.7° |
| C87 | C88 | C90 | C92 | 3.0° | 0.1° |
| C87 | C88 | C90 | H148 | 177.0° | 180.0° |
| C89 | C87 | C88 | C90 | 1.9° | 0.3° |
| C89 | C87 | C88 | H146 | 178.1° | 179.8° |
| C87 | C89 | C91 | H147 | 180.0° | 180.0° |
| C87 | C89 | C91 | C92 | 6.8° | 0.0° |
| C87 | C89 | C91 | H149 | 173.3° | 179.9° |
| C88 | C90 | C92 | H148 | 180.0° | 180.0° |
| C88 | C90 | C92 | C91 | 0.4° | 0.2° |
| C88 | C90 | C92 | H150 | 179.6° | 180.0° |
| H146 | C88 | C90 | C92 | 177.0° | 180.0° |
| H146 | C88 | C90 | H148 | 3.0° | 0.0° |
| C89 | C91 | C92 | C90 | 5.5° | 0.2° |
| C89 | C91 | C92 | H149 | 180.0° | 179.9° |
| C89 | C91 | C92 | H150 | 174.5° | 180.0° |
| H147 | C89 | C91 | C92 | 173.2° | 180.0° |
| H147 | C89 | C91 | H149 | 6.8° | 0.1° |
| C90 | C92 | C91 | H150 | 180.0° | 179.8° |
| C90 | C92 | C91 | H149 | 174.5° | 179.7° |
| H148 | C90 | C92 | C91 | 179.6° | 179.8° |
| H148 | C90 | C92 | H150 | 0.4° | 0.0° |
| H149 | C91 | C92 | H150 | 5.5° | 0.1° |
