PRD_001009
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.48Å | 1.43Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | O1 | doub | 1.21Å | 1.22Å | |
| N2 | C3 | sing | 1.48Å | 1.45Å | |
| N2 | H4 | sing | 0.97Å | 1.00Å | |
| C3 | C4 | sing | 1.51Å | 1.54Å | |
| C3 | C5 | sing | 1.53Å | 1.58Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | O2 | doub | 1.21Å | 1.24Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | C7 | sing | 1.53Å | 1.53Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| N3 | C8 | sing | 1.48Å | 1.44Å | |
| N3 | H13 | sing | 0.97Å | 1.00Å | |
| C8 | C9 | sing | 1.51Å | 1.51Å | |
| C8 | C10 | sing | 1.53Å | 1.54Å | |
| C8 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | O3 | doub | 1.21Å | 1.23Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| N4 | C12 | sing | 1.48Å | 1.44Å | |
| N4 | H20 | sing | 0.97Å | 1.00Å | |
| C12 | C13 | sing | 1.51Å | 1.51Å | |
| C12 | C14 | sing | 1.53Å | 1.53Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | O4 | doub | 1.21Å | 1.24Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C16 | N5 | sing | 1.47Å | 1.46Å | |
| C16 | H26 | sing | 1.09Å | 1.10Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| N5 | C17 | sing | 1.37Å | 1.33Å | |
| N5 | H28 | sing | 0.97Å | 1.00Å | |
| C17 | N6 | sing | 1.33Å | 1.33Å | |
| C17 | N7 | doub | 1.33Å | 1.32Å | |
| N6 | H29 | sing | 0.97Å | 1.00Å | |
| N6 | H30 | sing | 0.97Å | 1.00Å | |
| N7 | H31 | sing | 0.97Å | 1.00Å | |
| N7 | H32 | sing | 0.97Å | 1.00Å | |
| N8 | C18 | sing | 1.48Å | 1.45Å | |
| N8 | H33 | sing | 0.97Å | 1.00Å | |
| C18 | C19 | sing | 1.51Å | 1.53Å | |
| C18 | C20 | sing | 1.53Å | 1.54Å | |
| C18 | H34 | sing | 1.09Å | 1.10Å | |
| C19 | O5 | doub | 1.21Å | 1.23Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | H35 | sing | 1.09Å | 1.10Å | |
| C20 | H36 | sing | 1.09Å | 1.10Å | |
| C21 | H37 | sing | 1.09Å | 1.10Å | |
| C21 | H38 | sing | 1.09Å | 1.10Å | |
| C21 | H39 | sing | 1.09Å | 1.10Å | |
| N9 | C22 | sing | 1.48Å | 1.44Å | |
| N9 | H40 | sing | 0.97Å | 1.00Å | |
| C22 | C23 | sing | 1.51Å | 1.50Å | |
| C22 | C24 | sing | 1.53Å | 1.55Å | |
| C22 | H41 | sing | 1.09Å | 1.10Å | |
| C23 | O6 | doub | 1.21Å | 1.22Å | |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| C24 | C26 | sing | 1.53Å | 1.52Å | |
| C24 | H42 | sing | 1.09Å | 1.10Å | |
| C25 | H43 | sing | 1.09Å | 1.10Å | |
| C25 | H44 | sing | 1.09Å | 1.10Å | |
| C25 | H45 | sing | 1.09Å | 1.10Å | |
| C26 | H46 | sing | 1.09Å | 1.10Å | |
| C26 | H47 | sing | 1.09Å | 1.10Å | |
| C26 | H48 | sing | 1.09Å | 1.10Å | |
| N10 | C27 | sing | 1.48Å | 1.43Å | |
| N10 | H49 | sing | 0.97Å | 1.00Å | |
| C27 | C28 | sing | 1.51Å | 1.53Å | |
| C27 | C29 | sing | 1.53Å | 1.53Å | |
| C27 | H50 | sing | 1.09Å | 1.10Å | |
| C28 | O7 | doub | 1.21Å | 1.23Å | |
| C29 | C30 | sing | 1.53Å | 1.52Å | |
| C29 | H51 | sing | 1.09Å | 1.10Å | |
| C29 | H52 | sing | 1.09Å | 1.10Å | |
| C30 | H53 | sing | 1.09Å | 1.10Å | |
| C30 | H54 | sing | 1.09Å | 1.10Å | |
| C30 | H55 | sing | 1.09Å | 1.10Å | |
| N11 | C31 | sing | 1.48Å | 1.43Å | |
| N11 | H56 | sing | 0.97Å | 1.00Å | |
| C31 | C32 | sing | 1.51Å | 1.50Å | |
| C31 | C33 | sing | 1.53Å | 1.53Å | |
| C31 | H57 | sing | 1.09Å | 1.10Å | |
| C32 | O8 | doub | 1.21Å | 1.23Å | |
| C33 | C34 | sing | 1.53Å | 1.52Å | |
| C33 | H58 | sing | 1.09Å | 1.10Å | |
| C33 | H59 | sing | 1.09Å | 1.10Å | |
| C34 | C35 | sing | 1.53Å | 1.52Å | |
| C34 | H60 | sing | 1.09Å | 1.10Å | |
| C34 | H61 | sing | 1.09Å | 1.10Å | |
| C35 | N12 | sing | 1.46Å | 1.46Å | |
| C35 | H62 | sing | 1.09Å | 1.10Å | |
| C35 | H63 | sing | 1.09Å | 1.10Å | |
| N12 | C36 | sing | 1.37Å | 1.34Å | |
| N12 | H64 | sing | 0.97Å | 1.00Å | |
| C36 | N13 | sing | 1.33Å | 1.33Å | |
| C36 | N14 | doub | 1.33Å | 1.32Å | |
| N13 | H65 | sing | 0.97Å | 1.00Å | |
| N13 | H66 | sing | 0.97Å | 1.00Å | |
| N14 | H67 | sing | 0.97Å | 1.00Å | |
| N14 | H68 | sing | 0.97Å | 1.00Å | |
| N15 | C37 | sing | 1.48Å | 1.45Å | |
| N15 | H69 | sing | 0.97Å | 1.00Å | |
| C37 | C38 | sing | 1.51Å | 1.50Å | |
| C37 | C39 | sing | 1.53Å | 1.53Å | |
| C37 | H70 | sing | 1.09Å | 1.10Å | |
| C38 | O9 | doub | 1.21Å | 1.23Å | |
| C39 | C40 | sing | 1.53Å | 1.51Å | |
| C39 | H71 | sing | 1.09Å | 1.10Å | |
| C39 | H72 | sing | 1.09Å | 1.10Å | |
| C40 | C41 | sing | 1.53Å | 1.51Å | |
| C40 | H73 | sing | 1.09Å | 1.10Å | |
| C40 | H74 | sing | 1.09Å | 1.10Å | |
| C41 | N16 | sing | 1.46Å | 1.47Å | |
| C41 | H75 | sing | 1.09Å | 1.10Å | |
| C41 | H76 | sing | 1.09Å | 1.10Å | |
| N16 | C42 | sing | 1.37Å | 1.34Å | |
| N16 | H77 | sing | 0.97Å | 1.00Å | |
| C42 | N17 | sing | 1.33Å | 1.33Å | |
| C42 | N18 | doub | 1.33Å | 1.32Å | |
| N17 | H78 | sing | 0.97Å | 1.00Å | |
| N17 | H79 | sing | 0.97Å | 1.00Å | |
| N18 | H80 | sing | 0.97Å | 1.00Å | |
| N18 | H81 | sing | 0.97Å | 1.00Å | |
| N19 | C43 | sing | 1.48Å | 1.42Å | |
| N19 | H82 | sing | 0.97Å | 1.00Å | |
| C43 | C44 | sing | 1.51Å | 1.50Å | |
| C43 | H83 | sing | 1.09Å | 1.10Å | |
| C43 | H84 | sing | 1.09Å | 1.10Å | |
| C44 | O10 | doub | 1.21Å | 1.23Å | |
| N20 | C45 | sing | 1.48Å | 1.45Å | |
| N20 | H85 | sing | 0.97Å | 1.00Å | |
| C45 | C46 | sing | 1.51Å | 1.53Å | |
| C45 | C47 | sing | 1.53Å | 1.56Å | |
| C45 | H86 | sing | 1.09Å | 1.10Å | |
| C46 | O11 | doub | 1.21Å | 1.24Å | |
| C47 | C48 | sing | 1.53Å | 1.53Å | |
| C47 | C49 | sing | 1.53Å | 1.53Å | |
| C47 | H87 | sing | 1.09Å | 1.10Å | |
| C48 | H88 | sing | 1.09Å | 1.10Å | |
| C48 | H89 | sing | 1.09Å | 1.10Å | |
| C48 | H90 | sing | 1.09Å | 1.10Å | |
| C49 | H91 | sing | 1.09Å | 1.10Å | |
| C49 | H92 | sing | 1.09Å | 1.10Å | |
| C49 | H93 | sing | 1.09Å | 1.10Å | |
| N21 | C50 | sing | 1.48Å | 1.44Å | |
| N21 | H94 | sing | 0.97Å | 1.00Å | |
| C50 | C51 | sing | 1.51Å | 1.51Å | |
| C50 | C52 | sing | 1.53Å | 1.53Å | |
| C50 | H95 | sing | 1.09Å | 1.10Å | |
| C51 | O12 | doub | 1.21Å | 1.24Å | |
| C52 | C53 | sing | 1.53Å | 1.51Å | |
| C52 | H96 | sing | 1.09Å | 1.10Å | |
| C52 | H97 | sing | 1.09Å | 1.10Å | |
| C53 | H98 | sing | 1.09Å | 1.10Å | |
| C53 | H99 | sing | 1.09Å | 1.10Å | |
| C53 | H100 | sing | 1.09Å | 1.10Å | |
| N22 | C54 | sing | 1.48Å | 1.43Å | |
| N22 | H101 | sing | 0.97Å | 1.00Å | |
| C54 | C55 | sing | 1.51Å | 1.52Å | |
| C54 | C56 | sing | 1.53Å | 1.56Å | |
| C54 | H102 | sing | 1.09Å | 1.10Å | |
| C55 | O13 | doub | 1.21Å | 1.22Å | |
| C56 | C57 | sing | 1.53Å | 1.55Å | |
| C56 | H103 | sing | 1.09Å | 1.10Å | |
| C56 | H104 | sing | 1.09Å | 1.10Å | |
| C57 | C58 | sing | 1.53Å | 1.52Å | |
| C57 | H105 | sing | 1.09Å | 1.10Å | |
| C57 | H106 | sing | 1.09Å | 1.10Å | |
| C58 | N23 | sing | 1.46Å | 1.47Å | |
| C58 | H107 | sing | 1.09Å | 1.10Å | |
| C58 | H108 | sing | 1.09Å | 1.10Å | |
| N23 | C59 | sing | 1.37Å | 1.34Å | |
| N23 | H109 | sing | 0.97Å | 1.00Å | |
| C59 | N24 | sing | 1.33Å | 1.33Å | |
| C59 | N25 | doub | 1.33Å | 1.33Å | |
| N24 | H110 | sing | 0.97Å | 1.00Å | |
| N24 | H111 | sing | 0.97Å | 1.00Å | |
| N25 | H112 | sing | 0.97Å | 1.00Å | |
| N25 | H113 | sing | 0.97Å | 1.00Å | |
| N26 | C60 | sing | 1.48Å | 1.45Å | |
| N26 | H114 | sing | 0.97Å | 1.00Å | |
| C60 | C61 | sing | 1.51Å | 1.51Å | |
| C60 | C62 | sing | 1.53Å | 1.53Å | |
| C60 | H115 | sing | 1.09Å | 1.10Å | |
| C61 | O14 | doub | 1.21Å | 1.24Å | |
| C62 | C63 | sing | 1.53Å | 1.51Å | |
| C62 | H116 | sing | 1.09Å | 1.10Å | |
| C62 | H117 | sing | 1.09Å | 1.10Å | |
| C63 | H118 | sing | 1.09Å | 1.10Å | |
| C63 | H119 | sing | 1.09Å | 1.10Å | |
| C63 | H120 | sing | 1.09Å | 1.10Å | |
| N27 | C64 | sing | 1.48Å | 1.44Å | |
| N27 | H121 | sing | 0.97Å | 1.00Å | |
| C64 | C65 | sing | 1.51Å | 1.50Å | |
| C64 | C66 | sing | 1.53Å | 1.54Å | |
| C64 | H122 | sing | 1.09Å | 1.10Å | |
| C65 | O15 | doub | 1.21Å | 1.26Å | |
| C66 | C67 | sing | 1.53Å | 1.53Å | |
| C66 | C68 | sing | 1.53Å | 1.52Å | |
| C66 | H123 | sing | 1.09Å | 1.10Å | |
| C67 | H124 | sing | 1.09Å | 1.10Å | |
| C67 | H125 | sing | 1.09Å | 1.10Å | |
| C67 | H126 | sing | 1.09Å | 1.10Å | |
| C68 | H127 | sing | 1.09Å | 1.10Å | |
| C68 | H128 | sing | 1.09Å | 1.10Å | |
| C68 | H129 | sing | 1.09Å | 1.10Å | |
| N28 | C69 | sing | 1.48Å | 1.44Å | |
| N28 | H130 | sing | 0.97Å | 1.00Å | |
| C69 | C70 | sing | 1.51Å | 1.52Å | |
| C69 | C71 | sing | 1.53Å | 1.55Å | |
| C69 | H131 | sing | 1.09Å | 1.10Å | |
| C70 | O16 | doub | 1.21Å | 1.23Å | |
| C71 | C72 | sing | 1.53Å | 1.52Å | |
| C71 | H132 | sing | 1.09Å | 1.10Å | |
| C71 | H133 | sing | 1.09Å | 1.10Å | |
| C72 | H134 | sing | 1.09Å | 1.10Å | |
| C72 | H135 | sing | 1.09Å | 1.10Å | |
| C72 | H136 | sing | 1.09Å | 1.10Å | |
| N29 | C73 | sing | 1.48Å | 1.43Å | |
| N29 | H137 | sing | 0.97Å | 1.00Å | |
| C73 | C74 | sing | 1.51Å | 1.49Å | |
| C73 | C75 | sing | 1.53Å | 1.52Å | |
| C73 | H138 | sing | 1.09Å | 1.10Å | |
| C74 | O17 | doub | 1.21Å | 1.23Å | |
| C75 | C76 | sing | 1.53Å | 1.51Å | |
| C75 | H139 | sing | 1.09Å | 1.10Å | |
| C75 | H140 | sing | 1.09Å | 1.10Å | |
| C76 | C77 | sing | 1.53Å | 1.51Å | |
| C76 | H141 | sing | 1.09Å | 1.10Å | |
| C76 | H142 | sing | 1.09Å | 1.10Å | |
| C77 | N30 | sing | 1.47Å | 1.46Å | |
| C77 | H143 | sing | 1.09Å | 1.10Å | |
| C77 | H144 | sing | 1.09Å | 1.10Å | |
| N30 | C78 | sing | 1.37Å | 1.34Å | |
| N30 | H145 | sing | 0.97Å | 1.00Å | |
| C78 | N31 | sing | 1.33Å | 1.34Å | |
| C78 | N32 | doub | 1.33Å | 1.32Å | |
| N31 | H146 | sing | 0.97Å | 1.00Å | |
| N31 | H147 | sing | 0.97Å | 1.00Å | |
| N32 | H148 | sing | 0.97Å | 1.00Å | |
| N32 | H149 | sing | 0.97Å | 1.00Å | |
| N33 | C79 | sing | 1.47Å | 1.45Å | |
| N33 | H150 | sing | 0.97Å | 1.00Å | |
| C79 | C80 | sing | 1.51Å | 1.51Å | |
| C79 | C81 | sing | 1.53Å | 1.53Å | |
| C79 | H151 | sing | 1.09Å | 1.10Å | |
| C80 | O18 | doub | 1.21Å | 1.24Å | |
| C81 | C82 | sing | 1.53Å | 1.52Å | |
| C81 | H152 | sing | 1.09Å | 1.10Å | |
| C81 | H153 | sing | 1.09Å | 1.10Å | |
| C82 | C83 | sing | 1.53Å | 1.52Å | |
| C82 | H154 | sing | 1.09Å | 1.10Å | |
| C82 | H155 | sing | 1.09Å | 1.10Å | |
| C83 | N34 | sing | 1.46Å | 1.46Å | |
| C83 | H156 | sing | 1.09Å | 1.10Å | |
| C83 | H157 | sing | 1.09Å | 1.10Å | |
| N34 | C84 | sing | 1.37Å | 1.34Å | |
| N34 | H158 | sing | 0.97Å | 1.00Å | |
| C84 | N35 | sing | 1.33Å | 1.34Å | |
| C84 | N36 | doub | 1.33Å | 1.33Å | |
| N35 | H159 | sing | 0.97Å | 1.00Å | |
| N35 | H160 | sing | 0.97Å | 1.00Å | |
| N36 | H161 | sing | 0.97Å | 1.00Å | |
| N36 | H162 | sing | 0.97Å | 1.00Å | |
| N1 | C80 | sing | 1.36Å | 1.30Å | |
| C2 | N2 | sing | 1.36Å | 1.33Å | |
| C4 | N3 | sing | 1.36Å | 1.30Å | |
| C9 | N4 | sing | 1.36Å | 1.30Å | |
| C13 | N8 | sing | 1.36Å | 1.31Å | |
| C19 | N9 | sing | 1.36Å | 1.31Å | |
| C23 | N10 | sing | 1.36Å | 1.28Å | |
| C28 | N11 | sing | 1.36Å | 1.30Å | |
| C32 | N15 | sing | 1.36Å | 1.30Å | |
| C38 | N19 | sing | 1.36Å | 1.30Å | |
| C44 | N20 | sing | 1.36Å | 1.31Å | |
| C46 | N21 | sing | 1.36Å | 1.30Å | |
| C51 | N22 | sing | 1.36Å | 1.30Å | |
| C55 | N26 | sing | 1.36Å | 1.31Å | |
| C61 | N27 | sing | 1.36Å | 1.30Å | |
| C65 | N28 | sing | 1.36Å | 1.28Å | |
| C70 | N29 | sing | 1.36Å | 1.30Å | |
| C74 | N33 | sing | 1.36Å | 1.29Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | H1 | 118.5° | 121.9° |
| N1 | C1 | C2 | 110.2° | 108.8° |
| N1 | C1 | H2 | 109.3° | 109.6° |
| N1 | C1 | H3 | 109.3° | 109.6° |
| C1 | N1 | C80 | 123.0° | 116.3° |
| H1 | N1 | C80 | 118.5° | 121.8° |
| C2 | C1 | H2 | 109.3° | 109.6° |
| C2 | C1 | H3 | 109.3° | 109.6° |
| C1 | C2 | O1 | 121.0° | 120.4° |
| C1 | C2 | N2 | 116.1° | 119.1° |
| H2 | C1 | H3 | 109.5° | 109.7° |
| O1 | C2 | N2 | 122.8° | 120.5° |
| C3 | N2 | H4 | 119.1° | 121.6° |
| N2 | C3 | C4 | 111.8° | 109.0° |
| N2 | C3 | C5 | 113.1° | 109.6° |
| N2 | C3 | H5 | 107.2° | 109.6° |
| C3 | N2 | C2 | 121.9° | 116.8° |
| H4 | N2 | C2 | 119.0° | 121.6° |
| C4 | C3 | C5 | 112.4° | 109.5° |
| C4 | C3 | H5 | 106.0° | 109.5° |
| C3 | C4 | O2 | 121.8° | 120.4° |
| C3 | C4 | N3 | 115.8° | 119.1° |
| C5 | C3 | H5 | 105.7° | 109.6° |
| C3 | C5 | C6 | 112.8° | 109.5° |
| C3 | C5 | C7 | 111.2° | 109.5° |
| C3 | C5 | H6 | 106.9° | 109.5° |
| O2 | C4 | N3 | 122.4° | 120.5° |
| C6 | C5 | C7 | 110.8° | 109.5° |
| C6 | C5 | H6 | 107.5° | 109.5° |
| C5 | C6 | H7 | 109.5° | 109.5° |
| C5 | C6 | H8 | 109.5° | 109.5° |
| C5 | C6 | H9 | 109.5° | 109.5° |
| C7 | C5 | H6 | 107.4° | 109.5° |
| C5 | C7 | H10 | 109.5° | 109.5° |
| C5 | C7 | H11 | 109.5° | 109.5° |
| C5 | C7 | H12 | 109.5° | 109.5° |
| H7 | C6 | H8 | 109.4° | 109.5° |
| H7 | C6 | H9 | 109.5° | 109.5° |
| H8 | C6 | H9 | 109.5° | 109.4° |
| H10 | C7 | H11 | 109.5° | 109.5° |
| H10 | C7 | H12 | 109.5° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.4° |
| C8 | N3 | H13 | 118.6° | 121.8° |
| N3 | C8 | C9 | 108.2° | 108.8° |
| N3 | C8 | C10 | 111.5° | 109.6° |
| N3 | C8 | H14 | 110.0° | 109.6° |
| C8 | N3 | C4 | 122.8° | 116.3° |
| H13 | N3 | C4 | 118.6° | 121.8° |
| C9 | C8 | C10 | 109.3° | 109.6° |
| C9 | C8 | H14 | 109.1° | 109.6° |
| C8 | C9 | O3 | 120.4° | 120.4° |
| C8 | C9 | N4 | 117.0° | 119.3° |
| C10 | C8 | H14 | 108.7° | 109.7° |
| C8 | C10 | C11 | 114.6° | 109.4° |
| C8 | C10 | H15 | 108.2° | 109.5° |
| C8 | C10 | H16 | 108.2° | 109.5° |
| O3 | C9 | N4 | 122.6° | 120.4° |
| C11 | C10 | H15 | 108.2° | 109.5° |
| C11 | C10 | H16 | 108.2° | 109.4° |
| C10 | C11 | H17 | 109.5° | 109.5° |
| C10 | C11 | H18 | 109.5° | 109.5° |
| C10 | C11 | H19 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.6° |
| H17 | C11 | H18 | 109.5° | 109.4° |
| H17 | C11 | H19 | 109.4° | 109.5° |
| H18 | C11 | H19 | 109.5° | 109.5° |
| C12 | N4 | H20 | 119.7° | 121.6° |
| N4 | C12 | C13 | 109.9° | 109.0° |
| N4 | C12 | C14 | 111.5° | 109.6° |
| N4 | C12 | H21 | 108.8° | 109.6° |
| C12 | N4 | C9 | 120.6° | 116.8° |
| H20 | N4 | C9 | 119.7° | 121.6° |
| C13 | C12 | C14 | 110.8° | 109.6° |
| C13 | C12 | H21 | 108.0° | 109.5° |
| C12 | C13 | O4 | 120.2° | 120.5° |
| C12 | C13 | N8 | 116.4° | 119.0° |
| C14 | C12 | H21 | 107.8° | 109.6° |
| C12 | C14 | C15 | 114.0° | 109.5° |
| C12 | C14 | H22 | 108.3° | 109.5° |
| C12 | C14 | H23 | 108.3° | 109.5° |
| O4 | C13 | N8 | 123.4° | 120.6° |
| C15 | C14 | H22 | 108.3° | 109.5° |
| C15 | C14 | H23 | 108.3° | 109.5° |
| C14 | C15 | C16 | 111.6° | 109.5° |
| C14 | C15 | H24 | 108.9° | 109.5° |
| C14 | C15 | H25 | 108.9° | 109.5° |
| H22 | C14 | H23 | 109.5° | 109.4° |
| C16 | C15 | H24 | 108.9° | 109.5° |
| C16 | C15 | H25 | 108.9° | 109.4° |
| C15 | C16 | N5 | 112.2° | 109.5° |
| C15 | C16 | H26 | 108.8° | 109.5° |
| C15 | C16 | H27 | 108.8° | 109.4° |
| H24 | C15 | H25 | 109.5° | 109.4° |
| N5 | C16 | H26 | 108.8° | 109.4° |
| N5 | C16 | H27 | 108.8° | 109.5° |
| C16 | N5 | C17 | 124.7° | 120.0° |
| C16 | N5 | H28 | 117.7° | 120.0° |
| H26 | C16 | H27 | 109.5° | 109.5° |
| C17 | N5 | H28 | 117.6° | 120.0° |
| N5 | C17 | N6 | 120.3° | 120.0° |
| N5 | C17 | N7 | 119.8° | 120.0° |
| N6 | C17 | N7 | 119.9° | 120.0° |
| C17 | N6 | H29 | 120.0° | 120.0° |
| C17 | N6 | H30 | 120.0° | 120.0° |
| C17 | N7 | H31 | 120.0° | 120.0° |
| C17 | N7 | H32 | 120.0° | 120.0° |
| H29 | N6 | H30 | 120.0° | 120.0° |
| H31 | N7 | H32 | 120.0° | 120.0° |
| C18 | N8 | H33 | 118.6° | 121.9° |
| N8 | C18 | C19 | 109.3° | 108.8° |
| N8 | C18 | C20 | 110.6° | 109.6° |
| N8 | C18 | H34 | 109.6° | 109.6° |
| C18 | N8 | C13 | 122.8° | 116.2° |
| H33 | N8 | C13 | 118.6° | 121.9° |
| C19 | C18 | C20 | 110.5° | 109.6° |
| C19 | C18 | H34 | 108.5° | 109.6° |
| C18 | C19 | O5 | 121.5° | 120.4° |
| C18 | C19 | N9 | 115.8° | 119.2° |
| C20 | C18 | H34 | 108.4° | 109.7° |
| C18 | C20 | C21 | 114.0° | 109.5° |
| C18 | C20 | H35 | 108.3° | 109.4° |
| C18 | C20 | H36 | 108.3° | 109.5° |
| O5 | C19 | N9 | 122.6° | 120.4° |
| C21 | C20 | H35 | 108.3° | 109.5° |
| C21 | C20 | H36 | 108.3° | 109.5° |
| C20 | C21 | H37 | 109.5° | 109.5° |
| C20 | C21 | H38 | 109.5° | 109.5° |
| C20 | C21 | H39 | 109.4° | 109.5° |
| H35 | C20 | H36 | 109.5° | 109.4° |
| H37 | C21 | H38 | 109.5° | 109.5° |
| H37 | C21 | H39 | 109.5° | 109.5° |
| H38 | C21 | H39 | 109.5° | 109.5° |
| C22 | N9 | H40 | 118.6° | 121.6° |
| N9 | C22 | C23 | 107.1° | 108.9° |
| N9 | C22 | C24 | 112.7° | 109.6° |
| N9 | C22 | H41 | 110.2° | 109.6° |
| C22 | N9 | C19 | 122.8° | 116.8° |
| H40 | N9 | C19 | 118.6° | 121.6° |
| C23 | C22 | C24 | 108.8° | 109.5° |
| C23 | C22 | H41 | 109.3° | 109.6° |
| C22 | C23 | O6 | 120.5° | 120.5° |
| C22 | C23 | N10 | 116.4° | 119.1° |
| C24 | C22 | H41 | 108.7° | 109.7° |
| C22 | C24 | C25 | 111.1° | 109.5° |
| C22 | C24 | C26 | 112.1° | 109.4° |
| C22 | C24 | H42 | 107.3° | 109.5° |
| O6 | C23 | N10 | 123.2° | 120.5° |
| C25 | C24 | C26 | 110.9° | 109.4° |
| C25 | C24 | H42 | 107.6° | 109.5° |
| C24 | C25 | H43 | 109.5° | 109.5° |
| C24 | C25 | H44 | 109.5° | 109.5° |
| C24 | C25 | H45 | 109.5° | 109.5° |
| C26 | C24 | H42 | 107.6° | 109.5° |
| C24 | C26 | H46 | 109.5° | 109.5° |
| C24 | C26 | H47 | 109.5° | 109.5° |
| C24 | C26 | H48 | 109.5° | 109.5° |
| H43 | C25 | H44 | 109.5° | 109.5° |
| H43 | C25 | H45 | 109.4° | 109.4° |
| H44 | C25 | H45 | 109.5° | 109.5° |
| H46 | C26 | H47 | 109.4° | 109.4° |
| H46 | C26 | H48 | 109.4° | 109.5° |
| H47 | C26 | H48 | 109.5° | 109.5° |
| C27 | N10 | H49 | 118.9° | 121.9° |
| N10 | C27 | C28 | 110.6° | 108.8° |
| N10 | C27 | C29 | 109.1° | 109.6° |
| N10 | C27 | H50 | 109.2° | 109.5° |
| C27 | N10 | C23 | 122.2° | 116.3° |
| H49 | N10 | C23 | 118.9° | 121.8° |
| C28 | C27 | C29 | 112.1° | 109.6° |
| C28 | C27 | H50 | 108.0° | 109.6° |
| C27 | C28 | O7 | 121.9° | 120.4° |
| C27 | C28 | N11 | 116.0° | 119.2° |
| C29 | C27 | H50 | 107.8° | 109.7° |
| C27 | C29 | C30 | 114.9° | 109.5° |
| C27 | C29 | H51 | 108.1° | 109.5° |
| C27 | C29 | H52 | 108.1° | 109.5° |
| O7 | C28 | N11 | 122.1° | 120.4° |
| C30 | C29 | H51 | 108.1° | 109.5° |
| C30 | C29 | H52 | 108.1° | 109.5° |
| C29 | C30 | H53 | 109.5° | 109.5° |
| C29 | C30 | H54 | 109.5° | 109.4° |
| C29 | C30 | H55 | 109.5° | 109.5° |
| H51 | C29 | H52 | 109.5° | 109.4° |
| H53 | C30 | H54 | 109.5° | 109.5° |
| H53 | C30 | H55 | 109.4° | 109.5° |
| H54 | C30 | H55 | 109.5° | 109.4° |
| C31 | N11 | H56 | 119.0° | 121.7° |
| N11 | C31 | C32 | 108.8° | 108.8° |
| N11 | C31 | C33 | 109.9° | 109.6° |
| N11 | C31 | H57 | 110.2° | 109.6° |
| C31 | N11 | C28 | 122.0° | 116.7° |
| H56 | N11 | C28 | 119.0° | 121.6° |
| C32 | C31 | C33 | 110.1° | 109.6° |
| C32 | C31 | H57 | 109.1° | 109.6° |
| C31 | C32 | O8 | 120.7° | 120.5° |
| C31 | C32 | N15 | 116.1° | 119.0° |
| C33 | C31 | H57 | 108.8° | 109.7° |
| C31 | C33 | C34 | 114.0° | 109.5° |
| C31 | C33 | H58 | 108.3° | 109.5° |
| C31 | C33 | H59 | 108.3° | 109.5° |
| O8 | C32 | N15 | 123.2° | 120.5° |
| C34 | C33 | H58 | 108.3° | 109.5° |
| C34 | C33 | H59 | 108.3° | 109.5° |
| C33 | C34 | C35 | 112.1° | 109.5° |
| C33 | C34 | H60 | 108.8° | 109.5° |
| C33 | C34 | H61 | 108.8° | 109.5° |
| H58 | C33 | H59 | 109.5° | 109.5° |
| C35 | C34 | H60 | 108.8° | 109.4° |
| C35 | C34 | H61 | 108.8° | 109.4° |
| C34 | C35 | N12 | 111.4° | 109.5° |
| C34 | C35 | H62 | 109.0° | 109.4° |
| C34 | C35 | H63 | 109.0° | 109.4° |
| H60 | C34 | H61 | 109.5° | 109.5° |
| N12 | C35 | H62 | 109.0° | 109.5° |
| N12 | C35 | H63 | 109.0° | 109.6° |
| C35 | N12 | C36 | 125.2° | 120.0° |
| C35 | N12 | H64 | 117.4° | 120.0° |
| H62 | C35 | H63 | 109.5° | 109.5° |
| C36 | N12 | H64 | 117.4° | 120.0° |
| N12 | C36 | N13 | 120.7° | 120.0° |
| N12 | C36 | N14 | 119.7° | 120.0° |
| N13 | C36 | N14 | 119.6° | 120.0° |
| C36 | N13 | H65 | 120.0° | 120.0° |
| C36 | N13 | H66 | 120.0° | 120.0° |
| C36 | N14 | H67 | 120.0° | 120.0° |
| C36 | N14 | H68 | 120.0° | 120.1° |
| H65 | N13 | H66 | 120.0° | 120.0° |
| H67 | N14 | H68 | 120.0° | 119.9° |
| C37 | N15 | H69 | 119.2° | 121.9° |
| N15 | C37 | C38 | 109.7° | 108.9° |
| N15 | C37 | C39 | 112.2° | 109.6° |
| N15 | C37 | H70 | 108.5° | 109.6° |
| C37 | N15 | C32 | 121.6° | 116.3° |
| H69 | N15 | C32 | 119.2° | 121.9° |
| C38 | C37 | C39 | 110.9° | 109.6° |
| C38 | C37 | H70 | 107.8° | 109.6° |
| C37 | C38 | O9 | 121.1° | 120.4° |
| C37 | C38 | N19 | 115.1° | 119.2° |
| C39 | C37 | H70 | 107.5° | 109.6° |
| C37 | C39 | C40 | 113.3° | 109.4° |
| C37 | C39 | H71 | 108.5° | 109.5° |
| C37 | C39 | H72 | 108.5° | 109.5° |
| O9 | C38 | N19 | 123.7° | 120.4° |
| C40 | C39 | H71 | 108.5° | 109.4° |
| C40 | C39 | H72 | 108.5° | 109.5° |
| C39 | C40 | C41 | 111.9° | 109.5° |
| C39 | C40 | H73 | 108.9° | 109.5° |
| C39 | C40 | H74 | 108.9° | 109.5° |
| H71 | C39 | H72 | 109.5° | 109.5° |
| C41 | C40 | H73 | 108.8° | 109.4° |
| C41 | C40 | H74 | 108.9° | 109.5° |
| C40 | C41 | N16 | 113.4° | 109.5° |
| C40 | C41 | H75 | 108.5° | 109.5° |
| C40 | C41 | H76 | 108.5° | 109.5° |
| H73 | C40 | H74 | 109.5° | 109.4° |
| N16 | C41 | H75 | 108.5° | 109.4° |
| N16 | C41 | H76 | 108.5° | 109.5° |
| C41 | N16 | C42 | 124.1° | 120.0° |
| C41 | N16 | H77 | 118.0° | 120.0° |
| H75 | C41 | H76 | 109.5° | 109.4° |
| C42 | N16 | H77 | 117.9° | 120.0° |
| N16 | C42 | N17 | 120.2° | 120.0° |
| N16 | C42 | N18 | 120.1° | 120.0° |
| N17 | C42 | N18 | 119.7° | 120.0° |
| C42 | N17 | H78 | 120.0° | 120.0° |
| C42 | N17 | H79 | 120.0° | 119.9° |
| C42 | N18 | H80 | 120.0° | 120.0° |
| C42 | N18 | H81 | 120.0° | 120.0° |
| H78 | N17 | H79 | 120.0° | 120.0° |
| H80 | N18 | H81 | 120.0° | 120.0° |
| C43 | N19 | H82 | 118.9° | 121.6° |
| N19 | C43 | C44 | 110.4° | 109.0° |
| N19 | C43 | H83 | 109.2° | 109.6° |
| N19 | C43 | H84 | 109.2° | 109.6° |
| C43 | N19 | C38 | 122.2° | 116.9° |
| H82 | N19 | C38 | 118.9° | 121.5° |
| C44 | C43 | H83 | 109.3° | 109.5° |
| C44 | C43 | H84 | 109.3° | 109.5° |
| C43 | C44 | O10 | 120.8° | 120.5° |
| C43 | C44 | N20 | 116.0° | 119.0° |
| H83 | C43 | H84 | 109.4° | 109.7° |
| O10 | C44 | N20 | 123.1° | 120.5° |
| C45 | N20 | H85 | 118.9° | 121.9° |
| N20 | C45 | C46 | 109.4° | 108.7° |
| N20 | C45 | C47 | 112.3° | 109.6° |
| N20 | C45 | H86 | 109.3° | 109.6° |
| C45 | N20 | C44 | 122.1° | 116.3° |
| H85 | N20 | C44 | 119.0° | 121.8° |
| C46 | C45 | C47 | 109.5° | 109.6° |
| C46 | C45 | H86 | 108.3° | 109.6° |
| C45 | C46 | O11 | 121.0° | 120.4° |
| C45 | C46 | N21 | 115.7° | 119.2° |
| C47 | C45 | H86 | 107.9° | 109.7° |
| C45 | C47 | C48 | 111.1° | 109.4° |
| C45 | C47 | C49 | 111.6° | 109.5° |
| C45 | C47 | H87 | 107.6° | 109.5° |
| O11 | C46 | N21 | 123.3° | 120.3° |
| C48 | C47 | C49 | 110.4° | 109.5° |
| C48 | C47 | H87 | 108.0° | 109.5° |
| C47 | C48 | H88 | 109.5° | 109.5° |
| C47 | C48 | H89 | 109.5° | 109.5° |
| C47 | C48 | H90 | 109.5° | 109.5° |
| C49 | C47 | H87 | 108.0° | 109.4° |
| C47 | C49 | H91 | 109.5° | 109.5° |
| C47 | C49 | H92 | 109.4° | 109.5° |
| C47 | C49 | H93 | 109.5° | 109.5° |
| H88 | C48 | H89 | 109.4° | 109.4° |
| H88 | C48 | H90 | 109.5° | 109.5° |
| H89 | C48 | H90 | 109.5° | 109.5° |
| H91 | C49 | H92 | 109.5° | 109.5° |
| H91 | C49 | H93 | 109.5° | 109.4° |
| H92 | C49 | H93 | 109.5° | 109.5° |
| C50 | N21 | H94 | 118.7° | 121.6° |
| N21 | C50 | C51 | 109.1° | 108.9° |
| N21 | C50 | C52 | 111.1° | 109.6° |
| N21 | C50 | H95 | 109.5° | 109.6° |
| C50 | N21 | C46 | 122.7° | 116.8° |
| H94 | N21 | C46 | 118.6° | 121.5° |
| C51 | C50 | C52 | 110.2° | 109.6° |
| C51 | C50 | H95 | 108.6° | 109.5° |
| C50 | C51 | O12 | 121.0° | 120.4° |
| C50 | C51 | N22 | 115.9° | 119.1° |
| C52 | C50 | H95 | 108.3° | 109.6° |
| C50 | C52 | C53 | 113.7° | 109.5° |
| C50 | C52 | H96 | 108.4° | 109.5° |
| C50 | C52 | H97 | 108.4° | 109.5° |
| O12 | C51 | N22 | 123.1° | 120.5° |
| C53 | C52 | H96 | 108.4° | 109.5° |
| C53 | C52 | H97 | 108.4° | 109.5° |
| C52 | C53 | H98 | 109.5° | 109.5° |
| C52 | C53 | H99 | 109.5° | 109.5° |
| C52 | C53 | H100 | 109.5° | 109.5° |
| H96 | C52 | H97 | 109.5° | 109.5° |
| H98 | C53 | H99 | 109.5° | 109.5° |
| H98 | C53 | H100 | 109.5° | 109.4° |
| H99 | C53 | H100 | 109.5° | 109.4° |
| C54 | N22 | H101 | 119.2° | 121.9° |
| N22 | C54 | C55 | 113.7° | 108.9° |
| N22 | C54 | C56 | 111.5° | 109.6° |
| N22 | C54 | H102 | 106.1° | 109.6° |
| C54 | N22 | C51 | 121.7° | 116.3° |
| H101 | N22 | C51 | 119.2° | 121.8° |
| C55 | C54 | C56 | 114.7° | 109.6° |
| C55 | C54 | H102 | 105.1° | 109.6° |
| C54 | C55 | O13 | 122.4° | 120.4° |
| C54 | C55 | N26 | 114.6° | 119.1° |
| C56 | C54 | H102 | 104.7° | 109.6° |
| C54 | C56 | C57 | 116.9° | 109.5° |
| C54 | C56 | H103 | 107.6° | 109.5° |
| C54 | C56 | H104 | 107.6° | 109.5° |
| O13 | C55 | N26 | 123.0° | 120.4° |
| C57 | C56 | H103 | 107.6° | 109.5° |
| C57 | C56 | H104 | 107.6° | 109.5° |
| C56 | C57 | C58 | 113.8° | 109.4° |
| C56 | C57 | H105 | 108.4° | 109.5° |
| C56 | C57 | H106 | 108.4° | 109.5° |
| H103 | C56 | H104 | 109.5° | 109.5° |
| C58 | C57 | H105 | 108.4° | 109.5° |
| C58 | C57 | H106 | 108.4° | 109.5° |
| C57 | C58 | N23 | 111.7° | 109.4° |
| C57 | C58 | H107 | 108.9° | 109.5° |
| C57 | C58 | H108 | 108.9° | 109.5° |
| H105 | C57 | H106 | 109.5° | 109.5° |
| N23 | C58 | H107 | 108.9° | 109.5° |
| N23 | C58 | H108 | 108.9° | 109.5° |
| C58 | N23 | C59 | 125.1° | 120.0° |
| C58 | N23 | H109 | 117.5° | 120.0° |
| H107 | C58 | H108 | 109.4° | 109.5° |
| C59 | N23 | H109 | 117.4° | 120.0° |
| N23 | C59 | N24 | 120.5° | 120.0° |
| N23 | C59 | N25 | 119.6° | 120.0° |
| N24 | C59 | N25 | 119.9° | 120.0° |
| C59 | N24 | H110 | 120.0° | 119.9° |
| C59 | N24 | H111 | 120.0° | 120.0° |
| C59 | N25 | H112 | 120.0° | 120.0° |
| C59 | N25 | H113 | 120.0° | 120.0° |
| H110 | N24 | H111 | 120.0° | 120.0° |
| H112 | N25 | H113 | 120.0° | 120.0° |
| C60 | N26 | H114 | 118.8° | 121.5° |
| N26 | C60 | C61 | 109.3° | 108.9° |
| N26 | C60 | C62 | 111.3° | 109.6° |
| N26 | C60 | H115 | 109.0° | 109.5° |
| C60 | N26 | C55 | 122.4° | 116.8° |
| H114 | N26 | C55 | 118.8° | 121.6° |
| C61 | C60 | C62 | 110.8° | 109.6° |
| C61 | C60 | H115 | 108.2° | 109.5° |
| C60 | C61 | O14 | 122.1° | 120.5° |
| C60 | C61 | N27 | 114.2° | 119.1° |
| C62 | C60 | H115 | 108.1° | 109.6° |
| C60 | C62 | C63 | 114.2° | 109.5° |
| C60 | C62 | H116 | 108.3° | 109.4° |
| C60 | C62 | H117 | 108.3° | 109.5° |
| O14 | C61 | N27 | 123.7° | 120.5° |
| C63 | C62 | H116 | 108.3° | 109.5° |
| C63 | C62 | H117 | 108.3° | 109.5° |
| C62 | C63 | H118 | 109.5° | 109.5° |
| C62 | C63 | H119 | 109.5° | 109.4° |
| C62 | C63 | H120 | 109.5° | 109.4° |
| H116 | C62 | H117 | 109.5° | 109.5° |
| H118 | C63 | H119 | 109.4° | 109.5° |
| H118 | C63 | H120 | 109.5° | 109.5° |
| H119 | C63 | H120 | 109.5° | 109.4° |
| C64 | N27 | H121 | 118.2° | 121.9° |
| N27 | C64 | C65 | 107.4° | 108.7° |
| N27 | C64 | C66 | 112.7° | 109.6° |
| N27 | C64 | H122 | 110.4° | 109.6° |
| C64 | N27 | C61 | 123.5° | 116.2° |
| H121 | N27 | C61 | 118.3° | 121.9° |
| C65 | C64 | C66 | 107.8° | 109.6° |
| C65 | C64 | H122 | 109.4° | 109.6° |
| C64 | C65 | O15 | 121.0° | 120.4° |
| C64 | C65 | N28 | 114.9° | 119.2° |
| C66 | C64 | H122 | 109.0° | 109.7° |
| C64 | C66 | C67 | 110.9° | 109.5° |
| C64 | C66 | C68 | 112.4° | 109.5° |
| C64 | C66 | H123 | 107.1° | 109.5° |
| O15 | C65 | N28 | 124.1° | 120.3° |
| C67 | C66 | C68 | 111.7° | 109.5° |
| C67 | C66 | H123 | 107.2° | 109.4° |
| C66 | C67 | H124 | 109.5° | 109.5° |
| C66 | C67 | H125 | 109.4° | 109.4° |
| C66 | C67 | H126 | 109.5° | 109.5° |
| C68 | C66 | H123 | 107.3° | 109.5° |
| C66 | C68 | H127 | 109.5° | 109.4° |
| C66 | C68 | H128 | 109.5° | 109.5° |
| C66 | C68 | H129 | 109.5° | 109.5° |
| H124 | C67 | H125 | 109.5° | 109.5° |
| H124 | C67 | H126 | 109.4° | 109.5° |
| H125 | C67 | H126 | 109.5° | 109.5° |
| H127 | C68 | H128 | 109.5° | 109.5° |
| H127 | C68 | H129 | 109.5° | 109.5° |
| H128 | C68 | H129 | 109.5° | 109.5° |
| C69 | N28 | H130 | 118.6° | 121.6° |
| N28 | C69 | C70 | 109.7° | 109.0° |
| N28 | C69 | C71 | 110.0° | 109.6° |
| N28 | C69 | H131 | 109.6° | 109.6° |
| C69 | N28 | C65 | 122.8° | 116.9° |
| H130 | N28 | C65 | 118.6° | 121.5° |
| C70 | C69 | C71 | 111.0° | 109.6° |
| C70 | C69 | H131 | 108.4° | 109.5° |
| C69 | C70 | O16 | 121.4° | 120.5° |
| C69 | C70 | N29 | 116.2° | 119.1° |
| C71 | C69 | H131 | 108.1° | 109.6° |
| C69 | C71 | C72 | 114.6° | 109.5° |
| C69 | C71 | H132 | 108.2° | 109.5° |
| C69 | C71 | H133 | 108.2° | 109.5° |
| O16 | C70 | N29 | 122.4° | 120.4° |
| C72 | C71 | H132 | 108.1° | 109.5° |
| C72 | C71 | H133 | 108.2° | 109.4° |
| C71 | C72 | H134 | 109.5° | 109.5° |
| C71 | C72 | H135 | 109.5° | 109.4° |
| C71 | C72 | H136 | 109.5° | 109.5° |
| H132 | C71 | H133 | 109.5° | 109.5° |
| H134 | C72 | H135 | 109.5° | 109.4° |
| H134 | C72 | H136 | 109.5° | 109.5° |
| H135 | C72 | H136 | 109.4° | 109.5° |
| C73 | N29 | H137 | 118.7° | 121.9° |
| N29 | C73 | C74 | 107.3° | 108.8° |
| N29 | C73 | C75 | 111.9° | 109.6° |
| N29 | C73 | H138 | 110.4° | 109.5° |
| C73 | N29 | C70 | 122.5° | 116.3° |
| H137 | N29 | C70 | 118.7° | 121.9° |
| C74 | C73 | C75 | 108.4° | 109.6° |
| C74 | C73 | H138 | 109.5° | 109.6° |
| C73 | C74 | O17 | 120.1° | 120.4° |
| C73 | C74 | N33 | 116.6° | 119.3° |
| C75 | C73 | H138 | 109.2° | 109.7° |
| C73 | C75 | C76 | 115.7° | 109.5° |
| C73 | C75 | H139 | 107.9° | 109.5° |
| C73 | C75 | H140 | 107.9° | 109.5° |
| O17 | C74 | N33 | 123.3° | 120.3° |
| C76 | C75 | H139 | 107.9° | 109.5° |
| C76 | C75 | H140 | 107.9° | 109.4° |
| C75 | C76 | C77 | 109.6° | 109.5° |
| C75 | C76 | H141 | 109.5° | 109.5° |
| C75 | C76 | H142 | 109.4° | 109.5° |
| H139 | C75 | H140 | 109.5° | 109.4° |
| C77 | C76 | H141 | 109.4° | 109.5° |
| C77 | C76 | H142 | 109.4° | 109.4° |
| C76 | C77 | N30 | 113.1° | 109.5° |
| C76 | C77 | H143 | 108.6° | 109.5° |
| C76 | C77 | H144 | 108.5° | 109.4° |
| H141 | C76 | H142 | 109.5° | 109.5° |
| N30 | C77 | H143 | 108.6° | 109.5° |
| N30 | C77 | H144 | 108.6° | 109.5° |
| C77 | N30 | C78 | 124.1° | 120.0° |
| C77 | N30 | H145 | 118.0° | 120.0° |
| H143 | C77 | H144 | 109.5° | 109.5° |
| C78 | N30 | H145 | 118.0° | 120.1° |
| N30 | C78 | N31 | 120.0° | 120.0° |
| N30 | C78 | N32 | 120.1° | 120.0° |
| N31 | C78 | N32 | 119.9° | 120.0° |
| C78 | N31 | H146 | 120.0° | 120.0° |
| C78 | N31 | H147 | 120.0° | 120.0° |
| C78 | N32 | H148 | 120.0° | 120.0° |
| C78 | N32 | H149 | 120.0° | 120.0° |
| H146 | N31 | H147 | 120.0° | 120.0° |
| H148 | N32 | H149 | 120.0° | 120.0° |
| C79 | N33 | H150 | 119.1° | 121.6° |
| N33 | C79 | C80 | 109.7° | 109.0° |
| N33 | C79 | C81 | 110.6° | 109.6° |
| N33 | C79 | H151 | 108.7° | 109.6° |
| C79 | N33 | C74 | 121.8° | 116.8° |
| H150 | N33 | C74 | 119.1° | 121.6° |
| C80 | C79 | C81 | 112.1° | 109.4° |
| C80 | C79 | H151 | 107.9° | 109.7° |
| C79 | C80 | O18 | 121.4° | 120.5° |
| C79 | C80 | N1 | 114.8° | 119.1° |
| C81 | C79 | H151 | 107.7° | 109.6° |
| C79 | C81 | C82 | 113.0° | 109.5° |
| C79 | C81 | H152 | 108.6° | 109.4° |
| C79 | C81 | H153 | 108.6° | 109.5° |
| O18 | C80 | N1 | 123.8° | 120.4° |
| C82 | C81 | H152 | 108.6° | 109.5° |
| C82 | C81 | H153 | 108.6° | 109.5° |
| C81 | C82 | C83 | 110.8° | 109.5° |
| C81 | C82 | H154 | 109.1° | 109.5° |
| C81 | C82 | H155 | 109.2° | 109.5° |
| H152 | C81 | H153 | 109.4° | 109.5° |
| C83 | C82 | H154 | 109.2° | 109.5° |
| C83 | C82 | H155 | 109.2° | 109.5° |
| C82 | C83 | N34 | 112.7° | 109.4° |
| C82 | C83 | H156 | 108.7° | 109.4° |
| C82 | C83 | H157 | 108.6° | 109.4° |
| H154 | C82 | H155 | 109.5° | 109.4° |
| N34 | C83 | H156 | 108.7° | 109.5° |
| N34 | C83 | H157 | 108.7° | 109.5° |
| C83 | N34 | C84 | 124.5° | 120.0° |
| C83 | N34 | H158 | 117.7° | 120.0° |
| H156 | C83 | H157 | 109.5° | 109.5° |
| C84 | N34 | H158 | 117.7° | 120.0° |
| N34 | C84 | N35 | 120.4° | 120.0° |
| N34 | C84 | N36 | 119.6° | 120.0° |
| N35 | C84 | N36 | 119.9° | 120.0° |
| C84 | N35 | H159 | 120.0° | 119.9° |
| C84 | N35 | H160 | 120.0° | 120.0° |
| C84 | N36 | H161 | 120.0° | 120.0° |
| C84 | N36 | H162 | 120.0° | 120.0° |
| H159 | N35 | H160 | 120.0° | 120.0° |
| H161 | N36 | H162 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | H1 | C80 | 180.0° | 179.8° |
| N1 | C1 | C2 | H2 | 120.1° | 119.8° |
| N1 | C1 | C2 | H3 | 120.1° | 119.8° |
| N1 | C1 | H2 | H3 | 119.7° | 120.4° |
| N1 | C1 | C2 | O1 | 158.9° | 9.4° |
| C1 | N1 | C80 | C79 | 176.2° | 179.6° |
| C1 | N1 | C80 | O18 | 1.9° | 0.3° |
| N1 | C1 | C2 | N2 | 20.6° | 170.6° |
| H1 | N1 | C1 | C2 | 38.6° | 24.3° |
| H1 | N1 | C1 | H2 | 81.5° | 95.5° |
| H1 | N1 | C1 | H3 | 158.7° | 144.1° |
| H1 | N1 | C80 | C79 | 3.8° | 0.7° |
| H1 | N1 | C80 | O18 | 178.0° | 179.5° |
| C2 | C1 | H2 | H3 | 119.7° | 120.3° |
| C1 | C2 | O1 | N2 | 179.5° | 180.0° |
| C1 | C2 | N2 | C3 | 179.5° | 179.7° |
| C1 | C2 | N2 | H4 | 0.6° | 0.3° |
| C2 | C1 | N1 | C80 | 141.4° | 155.9° |
| H2 | C1 | C2 | O1 | 38.8° | 110.4° |
| H2 | C1 | N1 | C80 | 98.5° | 84.3° |
| H2 | C1 | C2 | N2 | 140.8° | 69.6° |
| H3 | C1 | C2 | O1 | 81.0° | 129.2° |
| H3 | C1 | N1 | C80 | 21.4° | 36.2° |
| H3 | C1 | C2 | N2 | 99.5° | 50.8° |
| O1 | C2 | N2 | C3 | 0.0° | 0.3° |
| O1 | C2 | N2 | H4 | 179.9° | 179.7° |
| C3 | N2 | H4 | C2 | 180.0° | 180.0° |
| N2 | C3 | C4 | C5 | 128.4° | 119.8° |
| N2 | C3 | C4 | H5 | 116.5° | 119.8° |
| N2 | C3 | C5 | H5 | 117.0° | 120.3° |
| N2 | C3 | C4 | O2 | 74.5° | 8.9° |
| N2 | C3 | C5 | C6 | 57.1° | 60.0° |
| N2 | C3 | C5 | C7 | 177.7° | 60.0° |
| N2 | C3 | C5 | H6 | 60.8° | 180.0° |
| N2 | C3 | C4 | N3 | 103.2° | 171.0° |
| H4 | N2 | C3 | C4 | 29.8° | 23.5° |
| H4 | N2 | C3 | C5 | 98.3° | 96.3° |
| H4 | N2 | C3 | H5 | 145.6° | 143.3° |
| C4 | C3 | C5 | H5 | 115.2° | 120.2° |
| C3 | C4 | O2 | N3 | 177.5° | 180.0° |
| C4 | C3 | C5 | C6 | 70.6° | 179.5° |
| C4 | C3 | C5 | C7 | 54.5° | 59.5° |
| C4 | C3 | C5 | H6 | 171.4° | 60.5° |
| C3 | C4 | N3 | C8 | 178.8° | 179.7° |
| C3 | C4 | N3 | H13 | 1.2° | 0.3° |
| C4 | C3 | N2 | C2 | 150.3° | 156.5° |
| C5 | C3 | C4 | O2 | 53.9° | 110.9° |
| C3 | C5 | C6 | C7 | 125.3° | 120.0° |
| C3 | C5 | C6 | H6 | 117.5° | 120.0° |
| C3 | C5 | C7 | H6 | 116.6° | 120.0° |
| C3 | C5 | C6 | H7 | 180.0° | 60.0° |
| C3 | C5 | C6 | H8 | 60.0° | 180.0° |
| C3 | C5 | C6 | H9 | 60.0° | 60.0° |
| C3 | C5 | C7 | H10 | 180.0° | 60.0° |
| C3 | C5 | C7 | H11 | 60.0° | 60.1° |
| C3 | C5 | C7 | H12 | 60.0° | 180.0° |
| C5 | C3 | N2 | C2 | 81.7° | 83.7° |
| C5 | C3 | C4 | N3 | 128.4° | 69.1° |
| H5 | C3 | C4 | O2 | 169.0° | 128.8° |
| H5 | C3 | C5 | C6 | 174.1° | 60.3° |
| H5 | C3 | C5 | C7 | 60.8° | 179.7° |
| H5 | C3 | C5 | H6 | 56.2° | 59.7° |
| H5 | C3 | N2 | C2 | 34.4° | 36.7° |
| H5 | C3 | C4 | N3 | 13.4° | 51.2° |
| O2 | C4 | N3 | C8 | 3.6° | 0.3° |
| O2 | C4 | N3 | H13 | 176.4° | 179.8° |
| C6 | C5 | C7 | H6 | 117.2° | 120.0° |
| C5 | C6 | H7 | H8 | 120.0° | 120.0° |
| C5 | C6 | H7 | H9 | 120.0° | 120.0° |
| C5 | C6 | H8 | H9 | 120.0° | 120.0° |
| C6 | C5 | C7 | H10 | 53.8° | 60.0° |
| C6 | C5 | C7 | H11 | 66.2° | 180.0° |
| C6 | C5 | C7 | H12 | 173.8° | 60.0° |
| C7 | C5 | C6 | H7 | 54.7° | 60.0° |
| C7 | C5 | C6 | H8 | 174.7° | 60.1° |
| C7 | C5 | C6 | H9 | 65.3° | 180.0° |
| C5 | C7 | H10 | H11 | 120.0° | 120.1° |
| C5 | C7 | H10 | H12 | 120.0° | 120.0° |
| C5 | C7 | H11 | H12 | 120.0° | 120.0° |
| H6 | C5 | C6 | H7 | 62.5° | 180.0° |
| H6 | C5 | C6 | H8 | 57.5° | 60.0° |
| H6 | C5 | C6 | H9 | 177.5° | 60.0° |
| H6 | C5 | C7 | H10 | 63.4° | 180.0° |
| H6 | C5 | C7 | H11 | 176.6° | 59.9° |
| H6 | C5 | C7 | H12 | 56.6° | 60.0° |
| H7 | C6 | H8 | H9 | 120.0° | 120.0° |
| H10 | C7 | H11 | H12 | 120.0° | 120.0° |
| C8 | N3 | H13 | C4 | 180.0° | 180.0° |
| N3 | C8 | C9 | C10 | 121.6° | 119.8° |
| N3 | C8 | C9 | H14 | 119.7° | 119.8° |
| N3 | C8 | C10 | H14 | 121.4° | 120.4° |
| N3 | C8 | C9 | O3 | 42.8° | 11.4° |
| N3 | C8 | C10 | C11 | 61.9° | 51.6° |
| N3 | C8 | C10 | H15 | 58.9° | 171.6° |
| N3 | C8 | C10 | H16 | 177.4° | 68.3° |
| N3 | C8 | C9 | N4 | 136.3° | 168.7° |
| H13 | N3 | C8 | C9 | 57.6° | 26.0° |
| H13 | N3 | C8 | C10 | 62.6° | 145.8° |
| H13 | N3 | C8 | H14 | 176.7° | 93.8° |
| C9 | C8 | C10 | H14 | 119.0° | 120.3° |
| C8 | C9 | O3 | N4 | 179.0° | 180.0° |
| C9 | C8 | C10 | C11 | 178.5° | 67.7° |
| C9 | C8 | C10 | H15 | 60.8° | 52.3° |
| C9 | C8 | C10 | H16 | 57.8° | 172.4° |
| C8 | C9 | N4 | C12 | 179.3° | 179.8° |
| C8 | C9 | N4 | H20 | 0.7° | 0.3° |
| C9 | C8 | N3 | C4 | 122.4° | 153.9° |
| C10 | C8 | C9 | O3 | 78.8° | 131.1° |
| C8 | C10 | C11 | H15 | 120.7° | 120.0° |
| C8 | C10 | C11 | H16 | 120.7° | 119.9° |
| C8 | C10 | H15 | H16 | 117.7° | 120.1° |
| C8 | C10 | C11 | H17 | 180.0° | 174.8° |
| C8 | C10 | C11 | H18 | 60.0° | 54.9° |
| C8 | C10 | C11 | H19 | 60.0° | 65.2° |
| C10 | C8 | N3 | C4 | 117.4° | 34.1° |
| C10 | C8 | C9 | N4 | 102.1° | 48.9° |
| H14 | C8 | C9 | O3 | 162.4° | 108.5° |
| H14 | C8 | C10 | C11 | 59.5° | 172.0° |
| H14 | C8 | C10 | H15 | 179.7° | 68.1° |
| H14 | C8 | C10 | H16 | 61.2° | 52.0° |
| H14 | C8 | N3 | C4 | 3.3° | 86.3° |
| H14 | C8 | C9 | N4 | 16.7° | 71.5° |
| O3 | C9 | N4 | C12 | 1.6° | 0.3° |
| O3 | C9 | N4 | H20 | 178.4° | 179.7° |
| C11 | C10 | H15 | H16 | 117.7° | 120.0° |
| C10 | C11 | H17 | H18 | 120.0° | 120.0° |
| C10 | C11 | H17 | H19 | 120.0° | 120.0° |
| C10 | C11 | H18 | H19 | 120.0° | 120.0° |
| H15 | C10 | C11 | H17 | 59.2° | 65.2° |
| H15 | C10 | C11 | H18 | 179.3° | 174.8° |
| H15 | C10 | C11 | H19 | 60.7° | 54.8° |
| H16 | C10 | C11 | H17 | 59.3° | 54.9° |
| H16 | C10 | C11 | H18 | 60.7° | 65.1° |
| H16 | C10 | C11 | H19 | 179.3° | 174.9° |
| H17 | C11 | H18 | H19 | 120.0° | 120.0° |
| C12 | N4 | H20 | C9 | 180.0° | 180.0° |
| N4 | C12 | C13 | C14 | 123.6° | 119.9° |
| N4 | C12 | C13 | H21 | 118.6° | 119.8° |
| N4 | C12 | C14 | H21 | 119.4° | 120.3° |
| N4 | C12 | C13 | O4 | 25.5° | 9.7° |
| N4 | C12 | C14 | C15 | 61.0° | 65.0° |
| N4 | C12 | C14 | H22 | 59.7° | 55.0° |
| N4 | C12 | C14 | H23 | 178.3° | 175.0° |
| N4 | C12 | C13 | N8 | 153.2° | 170.2° |
| H20 | N4 | C12 | C13 | 77.6° | 23.5° |
| H20 | N4 | C12 | C14 | 45.6° | 96.3° |
| H20 | N4 | C12 | H21 | 164.3° | 143.4° |
| C13 | C12 | C14 | H21 | 118.0° | 120.2° |
| C12 | C13 | O4 | N8 | 178.6° | 180.0° |
| C13 | C12 | C14 | C15 | 176.3° | 175.5° |
| C13 | C12 | C14 | H22 | 63.0° | 64.5° |
| C13 | C12 | C14 | H23 | 55.7° | 55.5° |
| C12 | C13 | N8 | C18 | 180.0° | 179.8° |
| C12 | C13 | N8 | H33 | 0.0° | 0.2° |
| C13 | C12 | N4 | C9 | 102.4° | 156.5° |
| C14 | C12 | C13 | O4 | 98.1° | 110.1° |
| C12 | C14 | C15 | H22 | 120.7° | 120.1° |
| C12 | C14 | C15 | H23 | 120.7° | 120.0° |
| C12 | C14 | H22 | H23 | 117.9° | 120.0° |
| C12 | C14 | C15 | C16 | 56.0° | 180.0° |
| C12 | C14 | C15 | H24 | 64.3° | 60.0° |
| C12 | C14 | C15 | H25 | 176.3° | 60.0° |
| C14 | C12 | N4 | C9 | 134.4° | 83.6° |
| C14 | C12 | C13 | N8 | 83.2° | 69.9° |
| H21 | C12 | C13 | O4 | 144.1° | 129.6° |
| H21 | C12 | C14 | C15 | 58.4° | 55.3° |
| H21 | C12 | C14 | H22 | 179.0° | 175.3° |
| H21 | C12 | C14 | H23 | 62.3° | 64.7° |
| H21 | C12 | N4 | C9 | 15.6° | 36.7° |
| H21 | C12 | C13 | N8 | 34.6° | 50.4° |
| O4 | C13 | N8 | C18 | 1.3° | 0.1° |
| O4 | C13 | N8 | H33 | 178.7° | 179.8° |
| C15 | C14 | H22 | H23 | 118.0° | 120.0° |
| C14 | C15 | C16 | H24 | 120.3° | 120.1° |
| C14 | C15 | C16 | H25 | 120.3° | 120.0° |
| C14 | C15 | H24 | H25 | 119.0° | 120.0° |
| C14 | C15 | C16 | N5 | 175.7° | 180.0° |
| C14 | C15 | C16 | H26 | 55.3° | 60.0° |
| C14 | C15 | C16 | H27 | 63.9° | 60.0° |
| H22 | C14 | C15 | C16 | 176.7° | 59.9° |
| H22 | C14 | C15 | H24 | 56.4° | 180.0° |
| H22 | C14 | C15 | H25 | 63.0° | 60.1° |
| H23 | C14 | C15 | C16 | 64.6° | 60.0° |
| H23 | C14 | C15 | H24 | 175.1° | 60.0° |
| H23 | C14 | C15 | H25 | 55.7° | 180.0° |
| C16 | C15 | H24 | H25 | 119.0° | 119.9° |
| C15 | C16 | N5 | H26 | 120.4° | 120.0° |
| C15 | C16 | N5 | H27 | 120.4° | 120.0° |
| C15 | C16 | H26 | H27 | 118.7° | 120.0° |
| C15 | C16 | N5 | C17 | 166.5° | 180.0° |
| C15 | C16 | N5 | H28 | 13.5° | 0.0° |
| H24 | C15 | C16 | N5 | 64.0° | 60.0° |
| H24 | C15 | C16 | H26 | 175.6° | 179.9° |
| H24 | C15 | C16 | H27 | 56.4° | 60.0° |
| H25 | C15 | C16 | N5 | 55.4° | 60.0° |
| H25 | C15 | C16 | H26 | 65.0° | 60.0° |
| H25 | C15 | C16 | H27 | 175.8° | 179.9° |
| N5 | C16 | H26 | H27 | 118.8° | 120.0° |
| C16 | N5 | C17 | H28 | 180.0° | 180.0° |
| C16 | N5 | C17 | N6 | 1.8° | 0.0° |
| C16 | N5 | C17 | N7 | 179.2° | 180.0° |
| H26 | C16 | N5 | C17 | 46.1° | 60.0° |
| H26 | C16 | N5 | H28 | 133.9° | 120.0° |
| H27 | C16 | N5 | C17 | 73.1° | 60.0° |
| H27 | C16 | N5 | H28 | 106.9° | 120.0° |
| N5 | C17 | N6 | N7 | 179.0° | 179.9° |
| N5 | C17 | N6 | H29 | 179.1° | 0.0° |
| N5 | C17 | N6 | H30 | 0.9° | 179.9° |
| N5 | C17 | N7 | H31 | 179.0° | 180.0° |
| N5 | C17 | N7 | H32 | 0.9° | 0.0° |
| H28 | N5 | C17 | N6 | 178.2° | 180.0° |
| H28 | N5 | C17 | N7 | 0.8° | 0.1° |
| C17 | N6 | H29 | H30 | 180.0° | 179.9° |
| N6 | C17 | N7 | H31 | 0.0° | 0.1° |
| N6 | C17 | N7 | H32 | 180.0° | 180.0° |
| N7 | C17 | N6 | H29 | 0.0° | 179.9° |
| N7 | C17 | N6 | H30 | 180.0° | 0.0° |
| C17 | N7 | H31 | H32 | 180.0° | 179.9° |
| C18 | N8 | H33 | C13 | 180.0° | 180.0° |
| N8 | C18 | C19 | C20 | 121.9° | 119.8° |
| N8 | C18 | C19 | H34 | 119.4° | 119.8° |
| N8 | C18 | C20 | H34 | 120.1° | 120.3° |
| N8 | C18 | C19 | O5 | 98.0° | 9.5° |
| N8 | C18 | C20 | C21 | 57.5° | 52.1° |
| N8 | C18 | C20 | H35 | 63.2° | 172.2° |
| N8 | C18 | C20 | H36 | 178.2° | 67.9° |
| N8 | C18 | C19 | N9 | 79.5° | 170.4° |
| H33 | N8 | C18 | C19 | 53.4° | 23.4° |
| H33 | N8 | C18 | C20 | 68.4° | 143.3° |
| H33 | N8 | C18 | H34 | 172.2° | 96.3° |
| C19 | C18 | C20 | H34 | 118.8° | 120.3° |
| C18 | C19 | O5 | N9 | 177.4° | 179.9° |
| C19 | C18 | C20 | C21 | 178.7° | 67.2° |
| C19 | C18 | C20 | H35 | 58.0° | 52.8° |
| C19 | C18 | C20 | H36 | 60.7° | 172.7° |
| C18 | C19 | N9 | C22 | 179.8° | 179.7° |
| C18 | C19 | N9 | H40 | 0.2° | 0.4° |
| C19 | C18 | N8 | C13 | 126.6° | 156.6° |
| C20 | C18 | C19 | O5 | 23.9° | 129.3° |
| C18 | C20 | C21 | H35 | 120.7° | 120.0° |
| C18 | C20 | C21 | H36 | 120.6° | 120.0° |
| C18 | C20 | H35 | H36 | 117.9° | 119.9° |
| C18 | C20 | C21 | H37 | 180.0° | 64.9° |
| C18 | C20 | C21 | H38 | 60.0° | 55.1° |
| C18 | C20 | C21 | H39 | 60.0° | 175.1° |
| C20 | C18 | N8 | C13 | 111.5° | 36.8° |
| C20 | C18 | C19 | N9 | 158.5° | 50.7° |
| H34 | C18 | C19 | O5 | 142.6° | 110.3° |
| H34 | C18 | C20 | C21 | 62.6° | 172.4° |
| H34 | C18 | C20 | H35 | 176.7° | 67.5° |
| H34 | C18 | C20 | H36 | 58.1° | 52.4° |
| H34 | C18 | N8 | C13 | 7.8° | 83.6° |
| H34 | C18 | C19 | N9 | 39.9° | 69.8° |
| O5 | C19 | N9 | C22 | 2.7° | 0.2° |
| O5 | C19 | N9 | H40 | 177.3° | 179.7° |
| C21 | C20 | H35 | H36 | 118.0° | 120.0° |
| C20 | C21 | H37 | H38 | 120.0° | 120.0° |
| C20 | C21 | H37 | H39 | 120.0° | 120.0° |
| C20 | C21 | H38 | H39 | 120.0° | 120.0° |
| H35 | C20 | C21 | H37 | 59.4° | 175.1° |
| H35 | C20 | C21 | H38 | 179.4° | 64.9° |
| H35 | C20 | C21 | H39 | 60.7° | 55.1° |
| H36 | C20 | C21 | H37 | 59.3° | 55.1° |
| H36 | C20 | C21 | H38 | 60.7° | 175.1° |
| H36 | C20 | C21 | H39 | 179.4° | 64.9° |
| H37 | C21 | H38 | H39 | 120.0° | 120.0° |
| C22 | N9 | H40 | C19 | 180.0° | 179.9° |
| N9 | C22 | C23 | C24 | 122.1° | 119.8° |
| N9 | C22 | C23 | H41 | 119.3° | 119.9° |
| N9 | C22 | C24 | H41 | 122.4° | 120.3° |
| N9 | C22 | C23 | O6 | 54.5° | 9.7° |
| N9 | C22 | C24 | C25 | 172.3° | 180.0° |
| N9 | C22 | C24 | C26 | 47.6° | 60.1° |
| N9 | C22 | C24 | H42 | 70.3° | 59.9° |
| N9 | C22 | C23 | N10 | 123.6° | 170.3° |
| H40 | N9 | C22 | C23 | 51.3° | 23.6° |
| H40 | N9 | C22 | C24 | 68.4° | 96.1° |
| H40 | N9 | C22 | H41 | 170.1° | 143.5° |
| C23 | C22 | C24 | H41 | 118.9° | 120.2° |
| C22 | C23 | O6 | N10 | 178.0° | 180.0° |
| C23 | C22 | C24 | C25 | 69.1° | 60.6° |
| C23 | C22 | C24 | C26 | 166.2° | 179.5° |
| C23 | C22 | C24 | H42 | 48.3° | 59.5° |
| C22 | C23 | N10 | C27 | 176.4° | 179.7° |
| C22 | C23 | N10 | H49 | 3.6° | 0.3° |
| C23 | C22 | N9 | C19 | 128.7° | 156.5° |
| C24 | C22 | C23 | O6 | 67.6° | 110.2° |
| C22 | C24 | C25 | C26 | 125.4° | 120.0° |
| C22 | C24 | C25 | H42 | 117.2° | 120.0° |
| C22 | C24 | C26 | H42 | 117.7° | 120.0° |
| C22 | C24 | C25 | H43 | 180.0° | 60.0° |
| C22 | C24 | C25 | H44 | 60.0° | 180.0° |
| C22 | C24 | C25 | H45 | 60.0° | 60.0° |
| C22 | C24 | C26 | H46 | 180.0° | 60.0° |
| C22 | C24 | C26 | H47 | 60.0° | 180.0° |
| C22 | C24 | C26 | H48 | 60.0° | 60.0° |
| C24 | C22 | N9 | C19 | 111.6° | 83.8° |
| C24 | C22 | C23 | N10 | 114.3° | 69.8° |
| H41 | C22 | C23 | O6 | 173.9° | 129.5° |
| H41 | C22 | C24 | C25 | 49.9° | 59.7° |
| H41 | C22 | C24 | C26 | 74.8° | 60.3° |
| H41 | C22 | C24 | H42 | 167.3° | 179.7° |
| H41 | C22 | N9 | C19 | 9.9° | 36.6° |
| H41 | C22 | C23 | N10 | 4.2° | 50.5° |
| O6 | C23 | N10 | C27 | 1.6° | 0.3° |
| O6 | C23 | N10 | H49 | 178.4° | 179.7° |
| C25 | C24 | C26 | H42 | 117.5° | 120.0° |
| C24 | C25 | H43 | H44 | 120.0° | 120.0° |
| C24 | C25 | H43 | H45 | 120.0° | 120.0° |
| C24 | C25 | H44 | H45 | 120.0° | 120.1° |
| C25 | C24 | C26 | H46 | 55.2° | 180.0° |
| C25 | C24 | C26 | H47 | 64.8° | 60.0° |
| C25 | C24 | C26 | H48 | 175.2° | 60.0° |
| C26 | C24 | C25 | H43 | 54.6° | 60.0° |
| C26 | C24 | C25 | H44 | 174.6° | 60.0° |
| C26 | C24 | C25 | H45 | 65.4° | 179.9° |
| C24 | C26 | H46 | H47 | 120.0° | 120.0° |
| C24 | C26 | H46 | H48 | 120.0° | 120.0° |
| C24 | C26 | H47 | H48 | 120.0° | 120.0° |
| H42 | C24 | C25 | H43 | 62.9° | 180.0° |
| H42 | C24 | C25 | H44 | 57.2° | 60.0° |
| H42 | C24 | C25 | H45 | 177.2° | 60.0° |
| H42 | C24 | C26 | H46 | 62.3° | 59.9° |
| H42 | C24 | C26 | H47 | 177.7° | 60.0° |
| H42 | C24 | C26 | H48 | 57.7° | 180.0° |
| H43 | C25 | H44 | H45 | 120.0° | 119.9° |
| H46 | C26 | H47 | H48 | 120.0° | 120.0° |
| C27 | N10 | H49 | C23 | 180.0° | 180.0° |
| N10 | C27 | C28 | C29 | 121.9° | 119.8° |
| N10 | C27 | C28 | H50 | 119.4° | 119.7° |
| N10 | C27 | C29 | H50 | 118.5° | 120.3° |
| N10 | C27 | C28 | O7 | 113.9° | 10.4° |
| N10 | C27 | C29 | C30 | 50.5° | 52.6° |
| N10 | C27 | C29 | H51 | 171.3° | 172.6° |
| N10 | C27 | C29 | H52 | 70.3° | 67.4° |
| N10 | C27 | C28 | N11 | 65.6° | 169.6° |
| H49 | N10 | C27 | C28 | 47.9° | 24.2° |
| H49 | N10 | C27 | C29 | 75.8° | 144.0° |
| H49 | N10 | C27 | H50 | 166.6° | 95.5° |
| C28 | C27 | C29 | H50 | 118.7° | 120.4° |
| C27 | C28 | O7 | N11 | 179.5° | 180.0° |
| C28 | C27 | C29 | C30 | 72.3° | 66.7° |
| C28 | C27 | C29 | H51 | 48.5° | 53.3° |
| C28 | C27 | C29 | H52 | 166.9° | 173.3° |
| C27 | C28 | N11 | C31 | 176.5° | 179.7° |
| C27 | C28 | N11 | H56 | 3.5° | 0.4° |
| C28 | C27 | N10 | C23 | 132.1° | 155.8° |
| C29 | C27 | C28 | O7 | 8.0° | 130.2° |
| C27 | C29 | C30 | H51 | 120.8° | 120.0° |
| C27 | C29 | C30 | H52 | 120.8° | 120.0° |
| C27 | C29 | H51 | H52 | 117.6° | 119.9° |
| C27 | C29 | C30 | H53 | 180.0° | 174.9° |
| C27 | C29 | C30 | H54 | 60.0° | 54.9° |
| C27 | C29 | C30 | H55 | 60.0° | 65.0° |
| C29 | C27 | N10 | C23 | 104.2° | 36.0° |
| C29 | C27 | C28 | N11 | 172.4° | 49.8° |
| H50 | C27 | C28 | O7 | 126.7° | 109.4° |
| H50 | C27 | C29 | C30 | 169.0° | 172.9° |
| H50 | C27 | C29 | H51 | 70.2° | 67.0° |
| H50 | C27 | C29 | H52 | 48.2° | 52.9° |
| H50 | C27 | N10 | C23 | 13.5° | 84.5° |
| H50 | C27 | C28 | N11 | 53.8° | 70.6° |
| O7 | C28 | N11 | C31 | 3.1° | 0.3° |
| O7 | C28 | N11 | H56 | 176.9° | 179.6° |
| C30 | C29 | H51 | H52 | 117.5° | 120.0° |
| C29 | C30 | H53 | H54 | 120.0° | 120.0° |
| C29 | C30 | H53 | H55 | 120.0° | 120.0° |
| C29 | C30 | H54 | H55 | 120.0° | 119.9° |
| H51 | C29 | C30 | H53 | 59.2° | 65.1° |
| H51 | C29 | C30 | H54 | 179.2° | 174.9° |
| H51 | C29 | C30 | H55 | 60.8° | 55.0° |
| H52 | C29 | C30 | H53 | 59.2° | 54.9° |
| H52 | C29 | C30 | H54 | 60.8° | 65.1° |
| H52 | C29 | C30 | H55 | 179.2° | 174.9° |
| H53 | C30 | H54 | H55 | 120.0° | 120.0° |
| C31 | N11 | H56 | C28 | 180.0° | 179.8° |
| N11 | C31 | C32 | C33 | 120.5° | 119.8° |
| N11 | C31 | C32 | H57 | 120.2° | 119.8° |
| N11 | C31 | C33 | H57 | 120.7° | 120.3° |
| N11 | C31 | C32 | O8 | 16.5° | 11.2° |
| N11 | C31 | C33 | C34 | 53.2° | 65.0° |
| N11 | C31 | C33 | H58 | 67.5° | 55.0° |
| N11 | C31 | C33 | H59 | 173.9° | 175.0° |
| N11 | C31 | C32 | N15 | 164.0° | 168.8° |
| H56 | N11 | C31 | C32 | 67.0° | 25.3° |
| H56 | N11 | C31 | C33 | 53.6° | 94.5° |
| H56 | N11 | C31 | H57 | 173.4° | 145.1° |
| C32 | C31 | C33 | H57 | 119.5° | 120.3° |
| C31 | C32 | O8 | N15 | 179.5° | 180.0° |
| C32 | C31 | C33 | C34 | 173.0° | 175.6° |
| C32 | C31 | C33 | H58 | 52.3° | 64.4° |
| C32 | C31 | C33 | H59 | 66.3° | 55.6° |
| C31 | C32 | N15 | C37 | 179.3° | 179.8° |
| C31 | C32 | N15 | H69 | 0.7° | 0.1° |
| C32 | C31 | N11 | C28 | 113.0° | 154.8° |
| C33 | C31 | C32 | O8 | 104.0° | 108.6° |
| C31 | C33 | C34 | H58 | 120.7° | 120.0° |
| C31 | C33 | C34 | H59 | 120.7° | 120.0° |
| C31 | C33 | H58 | H59 | 117.9° | 120.0° |
| C31 | C33 | C34 | C35 | 57.5° | 180.0° |
| C31 | C33 | C34 | H60 | 62.9° | 60.0° |
| C31 | C33 | C34 | H61 | 177.9° | 60.0° |
| C33 | C31 | N11 | C28 | 126.4° | 85.4° |
| C33 | C31 | C32 | N15 | 75.5° | 71.4° |
| H57 | C31 | C32 | O8 | 136.7° | 131.0° |
| H57 | C31 | C33 | C34 | 67.5° | 55.3° |
| H57 | C31 | C33 | H58 | 171.8° | 175.3° |
| H57 | C31 | C33 | H59 | 53.2° | 64.7° |
| H57 | C31 | N11 | C28 | 6.6° | 35.0° |
| H57 | C31 | C32 | N15 | 43.8° | 49.0° |
| O8 | C32 | N15 | C37 | 1.2° | 0.2° |
| O8 | C32 | N15 | H69 | 178.8° | 179.9° |
| C34 | C33 | H58 | H59 | 117.9° | 120.0° |
| C33 | C34 | C35 | H60 | 120.4° | 120.0° |
| C33 | C34 | C35 | H61 | 120.4° | 120.0° |
| C33 | C34 | H60 | H61 | 118.8° | 120.1° |
| C33 | C34 | C35 | N12 | 172.9° | 180.0° |
| C33 | C34 | C35 | H62 | 66.8° | 60.0° |
| C33 | C34 | C35 | H63 | 52.6° | 59.9° |
| H58 | C33 | C34 | C35 | 178.1° | 60.0° |
| H58 | C33 | C34 | H60 | 57.8° | 180.0° |
| H58 | C33 | C34 | H61 | 61.5° | 60.0° |
| H59 | C33 | C34 | C35 | 63.2° | 60.0° |
| H59 | C33 | C34 | H60 | 176.4° | 60.0° |
| H59 | C33 | C34 | H61 | 57.2° | 180.0° |
| C35 | C34 | H60 | H61 | 118.8° | 120.0° |
| C34 | C35 | N12 | H62 | 120.3° | 119.9° |
| C34 | C35 | N12 | H63 | 120.3° | 120.0° |
| C34 | C35 | H62 | H63 | 119.1° | 119.9° |
| C34 | C35 | N12 | C36 | 148.2° | 180.0° |
| C34 | C35 | N12 | H64 | 31.8° | 0.1° |
| H60 | C34 | C35 | N12 | 52.5° | 60.0° |
| H60 | C34 | C35 | H62 | 172.8° | 180.0° |
| H60 | C34 | C35 | H63 | 67.8° | 60.1° |
| H61 | C34 | C35 | N12 | 66.7° | 59.9° |
| H61 | C34 | C35 | H62 | 53.6° | 60.0° |
| H61 | C34 | C35 | H63 | 173.0° | 180.0° |
| N12 | C35 | H62 | H63 | 119.1° | 120.1° |
| C35 | N12 | C36 | H64 | 180.0° | 179.9° |
| C35 | N12 | C36 | N13 | 2.9° | 0.1° |
| C35 | N12 | C36 | N14 | 178.2° | 180.0° |
| H62 | C35 | N12 | C36 | 91.5° | 60.1° |
| H62 | C35 | N12 | H64 | 88.5° | 120.0° |
| H63 | C35 | N12 | C36 | 27.9° | 59.9° |
| H63 | C35 | N12 | H64 | 152.1° | 119.9° |
| N12 | C36 | N13 | N14 | 179.0° | 179.9° |
| N12 | C36 | N13 | H65 | 178.9° | 0.1° |
| N12 | C36 | N13 | H66 | 1.1° | 180.0° |
| N12 | C36 | N14 | H67 | 179.0° | 0.1° |
| N12 | C36 | N14 | H68 | 1.0° | 179.9° |
| H64 | N12 | C36 | N13 | 177.1° | 180.0° |
| H64 | N12 | C36 | N14 | 1.9° | 0.1° |
| C36 | N13 | H65 | H66 | 180.0° | 179.9° |
| N13 | C36 | N14 | H67 | 0.0° | 180.0° |
| N13 | C36 | N14 | H68 | 180.0° | 0.0° |
| N14 | C36 | N13 | H65 | 0.0° | 180.0° |
| N14 | C36 | N13 | H66 | 180.0° | 0.1° |
| C36 | N14 | H67 | H68 | 180.0° | 180.0° |
| C37 | N15 | H69 | C32 | 180.0° | 179.9° |
| N15 | C37 | C38 | C39 | 124.5° | 119.9° |
| N15 | C37 | C38 | H70 | 118.0° | 119.8° |
| N15 | C37 | C39 | H70 | 119.2° | 120.3° |
| N15 | C37 | C38 | O9 | 77.7° | 9.7° |
| N15 | C37 | C39 | C40 | 61.8° | 52.7° |
| N15 | C37 | C39 | H71 | 58.8° | 172.6° |
| N15 | C37 | C39 | H72 | 177.6° | 67.3° |
| N15 | C37 | C38 | N19 | 100.0° | 170.2° |
| H69 | N15 | C37 | C38 | 103.2° | 24.0° |
| H69 | N15 | C37 | C39 | 20.6° | 143.9° |
| H69 | N15 | C37 | H70 | 139.2° | 95.8° |
| C38 | C37 | C39 | H70 | 117.7° | 120.3° |
| C37 | C38 | O9 | N19 | 177.6° | 179.9° |
| C38 | C37 | C39 | C40 | 175.1° | 66.8° |
| C38 | C37 | C39 | H71 | 64.3° | 53.2° |
| C38 | C37 | C39 | H72 | 54.6° | 173.2° |
| C37 | C38 | N19 | C43 | 178.2° | 179.8° |
| C37 | C38 | N19 | H82 | 1.8° | 0.2° |
| C38 | C37 | N15 | C32 | 76.8° | 155.9° |
| C39 | C37 | C38 | O9 | 46.8° | 129.6° |
| C37 | C39 | C40 | H71 | 120.6° | 120.0° |
| C37 | C39 | C40 | H72 | 120.6° | 120.0° |
| C37 | C39 | H71 | H72 | 118.3° | 120.1° |
| C37 | C39 | C40 | C41 | 171.7° | 175.0° |
| C37 | C39 | C40 | H73 | 51.3° | 55.0° |
| C37 | C39 | C40 | H74 | 67.9° | 65.0° |
| C39 | C37 | N15 | C32 | 159.4° | 36.0° |
| C39 | C37 | C38 | N19 | 135.5° | 50.4° |
| H70 | C37 | C38 | O9 | 164.3° | 110.1° |
| H70 | C37 | C39 | C40 | 57.5° | 172.9° |
| H70 | C37 | C39 | H71 | 178.0° | 67.1° |
| H70 | C37 | C39 | H72 | 63.1° | 53.0° |
| H70 | C37 | N15 | C32 | 40.8° | 84.3° |
| H70 | C37 | C38 | N19 | 18.0° | 70.0° |
| O9 | C38 | N19 | C43 | 0.5° | 0.2° |
| O9 | C38 | N19 | H82 | 179.5° | 179.9° |
| C40 | C39 | H71 | H72 | 118.3° | 120.0° |
| C39 | C40 | C41 | H73 | 120.4° | 120.0° |
| C39 | C40 | C41 | H74 | 120.4° | 120.1° |
| C39 | C40 | H73 | H74 | 118.9° | 120.1° |
| C39 | C40 | C41 | N16 | 63.3° | 180.0° |
| C39 | C40 | C41 | H75 | 57.3° | 60.0° |
| C39 | C40 | C41 | H76 | 176.1° | 59.9° |
| H71 | C39 | C40 | C41 | 67.7° | 65.1° |
| H71 | C39 | C40 | H73 | 171.9° | 174.9° |
| H71 | C39 | C40 | H74 | 52.6° | 54.9° |
| H72 | C39 | C40 | C41 | 51.1° | 55.0° |
| H72 | C39 | C40 | H73 | 69.2° | 65.0° |
| H72 | C39 | C40 | H74 | 171.5° | 175.0° |
| C41 | C40 | H73 | H74 | 118.9° | 120.0° |
| C40 | C41 | N16 | H75 | 120.6° | 120.0° |
| C40 | C41 | N16 | H76 | 120.6° | 120.1° |
| C40 | C41 | H75 | H76 | 118.2° | 120.0° |
| C40 | C41 | N16 | C42 | 172.8° | 180.0° |
| C40 | C41 | N16 | H77 | 7.3° | 0.0° |
| H73 | C40 | C41 | N16 | 176.3° | 60.0° |
| H73 | C40 | C41 | H75 | 63.1° | 180.0° |
| H73 | C40 | C41 | H76 | 55.7° | 60.1° |
| H74 | C40 | C41 | N16 | 57.1° | 59.9° |
| H74 | C40 | C41 | H75 | 177.6° | 60.0° |
| H74 | C40 | C41 | H76 | 63.5° | 180.0° |
| N16 | C41 | H75 | H76 | 118.2° | 120.0° |
| C41 | N16 | C42 | H77 | 180.0° | 180.0° |
| C41 | N16 | C42 | N17 | 7.2° | 0.0° |
| C41 | N16 | C42 | N18 | 174.3° | 180.0° |
| H75 | C41 | N16 | C42 | 52.2° | 60.0° |
| H75 | C41 | N16 | H77 | 127.9° | 120.0° |
| H76 | C41 | N16 | C42 | 66.7° | 60.0° |
| H76 | C41 | N16 | H77 | 113.3° | 120.0° |
| N16 | C42 | N17 | N18 | 178.5° | 180.0° |
| N16 | C42 | N17 | H78 | 178.5° | 0.0° |
| N16 | C42 | N17 | H79 | 1.5° | 180.0° |
| N16 | C42 | N18 | H80 | 178.5° | 0.0° |
| N16 | C42 | N18 | H81 | 1.5° | 179.9° |
| H77 | N16 | C42 | N17 | 172.8° | 180.0° |
| H77 | N16 | C42 | N18 | 5.7° | 0.0° |
| C42 | N17 | H78 | H79 | 180.0° | 179.9° |
| N17 | C42 | N18 | H80 | 0.0° | 180.0° |
| N17 | C42 | N18 | H81 | 180.0° | 0.0° |
| N18 | C42 | N17 | H78 | 0.0° | 180.0° |
| N18 | C42 | N17 | H79 | 180.0° | 0.1° |
| C42 | N18 | H80 | H81 | 180.0° | 179.9° |
| C43 | N19 | H82 | C38 | 180.0° | 180.0° |
| N19 | C43 | C44 | H83 | 120.2° | 119.8° |
| N19 | C43 | C44 | H84 | 120.1° | 119.8° |
| N19 | C43 | H83 | H84 | 119.5° | 120.3° |
| N19 | C43 | C44 | O10 | 149.3° | 8.6° |
| N19 | C43 | C44 | N20 | 29.0° | 171.4° |
| H82 | N19 | C43 | C44 | 63.9° | 22.5° |
| H82 | N19 | C43 | H83 | 56.3° | 142.2° |
| H82 | N19 | C43 | H84 | 176.0° | 97.4° |
| C44 | C43 | H83 | H84 | 119.6° | 120.2° |
| C43 | C44 | O10 | N20 | 178.2° | 180.0° |
| C43 | C44 | N20 | C45 | 177.9° | 179.7° |
| C43 | C44 | N20 | H85 | 2.1° | 0.3° |
| C44 | C43 | N19 | C38 | 116.1° | 157.5° |
| H83 | C43 | C44 | O10 | 29.2° | 128.4° |
| H83 | C43 | N19 | C38 | 123.7° | 37.7° |
| H83 | C43 | C44 | N20 | 149.2° | 51.6° |
| H84 | C43 | C44 | O10 | 90.5° | 111.3° |
| H84 | C43 | N19 | C38 | 4.0° | 82.7° |
| H84 | C43 | C44 | N20 | 91.1° | 68.7° |
| O10 | C44 | N20 | C45 | 3.8° | 0.3° |
| O10 | C44 | N20 | H85 | 176.2° | 179.7° |
| C45 | N20 | H85 | C44 | 180.0° | 180.0° |
| N20 | C45 | C46 | C47 | 123.5° | 119.8° |
| N20 | C45 | C46 | H86 | 119.1° | 119.8° |
| N20 | C45 | C47 | H86 | 120.6° | 120.4° |
| N20 | C45 | C46 | O11 | 83.1° | 10.4° |
| N20 | C45 | C47 | C48 | 173.3° | 108.7° |
| N20 | C45 | C47 | C49 | 49.6° | 131.2° |
| N20 | C45 | C47 | H87 | 68.7° | 11.3° |
| N20 | C45 | C46 | N21 | 94.4° | 169.6° |
| H85 | N20 | C45 | C46 | 55.6° | 24.1° |
| H85 | N20 | C45 | C47 | 66.2° | 143.9° |
| H85 | N20 | C45 | H86 | 174.1° | 95.7° |
| C46 | C45 | C47 | H86 | 117.7° | 120.4° |
| C45 | C46 | O11 | N21 | 177.3° | 179.9° |
| C46 | C45 | C47 | C48 | 64.9° | 10.5° |
| C46 | C45 | C47 | C49 | 171.4° | 109.5° |
| C46 | C45 | C47 | H87 | 53.1° | 130.5° |
| C45 | C46 | N21 | C50 | 179.0° | 179.7° |
| C45 | C46 | N21 | H94 | 1.0° | 0.3° |
| C46 | C45 | N20 | C44 | 124.4° | 155.9° |
| C47 | C45 | C46 | O11 | 40.4° | 130.2° |
| C45 | C47 | C48 | C49 | 124.4° | 120.0° |
| C45 | C47 | C48 | H87 | 117.7° | 120.0° |
| C45 | C47 | C49 | H87 | 118.0° | 120.0° |
| C45 | C47 | C48 | H88 | 180.0° | 72.6° |
| C45 | C47 | C48 | H89 | 60.0° | 167.5° |
| C45 | C47 | C48 | H90 | 60.0° | 47.5° |
| C45 | C47 | C49 | H91 | 180.0° | 45.2° |
| C45 | C47 | C49 | H92 | 60.0° | 165.2° |
| C45 | C47 | C49 | H93 | 60.0° | 74.8° |
| C47 | C45 | N20 | C44 | 113.8° | 36.2° |
| C47 | C45 | C46 | N21 | 142.1° | 49.9° |
| H86 | C45 | C46 | O11 | 157.8° | 109.3° |
| H86 | C45 | C47 | C48 | 52.8° | 130.9° |
| H86 | C45 | C47 | C49 | 71.0° | 10.9° |
| H86 | C45 | C47 | H87 | 170.7° | 109.1° |
| H86 | C45 | N20 | C44 | 6.0° | 84.3° |
| H86 | C45 | C46 | N21 | 24.7° | 70.6° |
| O11 | C46 | N21 | C50 | 3.5° | 0.4° |
| O11 | C46 | N21 | H94 | 176.5° | 179.6° |
| C48 | C47 | C49 | H87 | 117.8° | 120.0° |
| C47 | C48 | H88 | H89 | 120.0° | 120.0° |
| C47 | C48 | H88 | H90 | 120.0° | 120.1° |
| C47 | C48 | H89 | H90 | 120.0° | 120.1° |
| C48 | C47 | C49 | H91 | 55.9° | 165.2° |
| C48 | C47 | C49 | H92 | 64.1° | 74.8° |
| C48 | C47 | C49 | H93 | 175.9° | 45.2° |
| C49 | C47 | C48 | H88 | 55.6° | 47.4° |
| C49 | C47 | C48 | H89 | 175.6° | 72.5° |
| C49 | C47 | C48 | H90 | 64.5° | 167.5° |
| C47 | C49 | H91 | H92 | 120.0° | 120.0° |
| C47 | C49 | H91 | H93 | 120.0° | 120.0° |
| C47 | C49 | H92 | H93 | 120.0° | 120.0° |
| H87 | C47 | C48 | H88 | 62.3° | 167.4° |
| H87 | C47 | C48 | H89 | 57.7° | 47.5° |
| H87 | C47 | C48 | H90 | 177.7° | 72.5° |
| H87 | C47 | C49 | H91 | 62.0° | 74.8° |
| H87 | C47 | C49 | H92 | 178.0° | 45.2° |
| H87 | C47 | C49 | H93 | 58.1° | 165.3° |
| H88 | C48 | H89 | H90 | 120.0° | 120.0° |
| H91 | C49 | H92 | H93 | 120.0° | 119.9° |
| C50 | N21 | H94 | C46 | 180.0° | 180.0° |
| N21 | C50 | C51 | C52 | 122.2° | 119.9° |
| N21 | C50 | C51 | H95 | 119.3° | 119.8° |
| N21 | C50 | C52 | H95 | 120.3° | 120.3° |
| N21 | C50 | C51 | O12 | 21.6° | 11.4° |
| N21 | C50 | C52 | C53 | 67.4° | 65.0° |
| N21 | C50 | C52 | H96 | 53.2° | 55.0° |
| N21 | C50 | C52 | H97 | 172.0° | 175.0° |
| N21 | C50 | C51 | N22 | 157.5° | 168.6° |
| H94 | N21 | C50 | C51 | 70.4° | 25.7° |
| H94 | N21 | C50 | C52 | 51.2° | 94.2° |
| H94 | N21 | C50 | H95 | 170.8° | 145.5° |
| C51 | C50 | C52 | H95 | 118.7° | 120.2° |
| C50 | C51 | O12 | N22 | 179.0° | 180.0° |
| C51 | C50 | C52 | C53 | 171.7° | 175.5° |
| C51 | C50 | C52 | H96 | 67.7° | 64.5° |
| C51 | C50 | C52 | H97 | 51.0° | 55.5° |
| C50 | C51 | N22 | C54 | 176.8° | 179.8° |
| C50 | C51 | N22 | H101 | 3.2° | 0.1° |
| C51 | C50 | N21 | C46 | 109.6° | 154.3° |
| C52 | C50 | C51 | O12 | 100.6° | 108.5° |
| C50 | C52 | C53 | H96 | 120.6° | 120.0° |
| C50 | C52 | C53 | H97 | 120.6° | 120.0° |
| C50 | C52 | H96 | H97 | 118.1° | 120.0° |
| C50 | C52 | C53 | H98 | 180.0° | 60.0° |
| C50 | C52 | C53 | H99 | 60.0° | 60.0° |
| C50 | C52 | C53 | H100 | 60.0° | 180.0° |
| C52 | C50 | N21 | C46 | 128.8° | 85.8° |
| C52 | C50 | C51 | N22 | 80.3° | 71.5° |
| H95 | C50 | C51 | O12 | 140.9° | 131.3° |
| H95 | C50 | C52 | C53 | 53.0° | 55.3° |
| H95 | C50 | C52 | H96 | 173.6° | 175.3° |
| H95 | C50 | C52 | H97 | 67.7° | 64.7° |
| H95 | C50 | N21 | C46 | 9.2° | 34.5° |
| H95 | C50 | C51 | N22 | 38.2° | 48.8° |
| O12 | C51 | N22 | C54 | 2.3° | 0.2° |
| O12 | C51 | N22 | H101 | 177.7° | 179.9° |
| C53 | C52 | H96 | H97 | 118.0° | 120.0° |
| C52 | C53 | H98 | H99 | 120.0° | 120.0° |
| C52 | C53 | H98 | H100 | 120.0° | 120.0° |
| C52 | C53 | H99 | H100 | 120.0° | 120.0° |
| H96 | C52 | C53 | H98 | 59.4° | 180.0° |
| H96 | C52 | C53 | H99 | 179.4° | 60.0° |
| H96 | C52 | C53 | H100 | 60.6° | 60.0° |
| H97 | C52 | C53 | H98 | 59.3° | 60.0° |
| H97 | C52 | C53 | H99 | 60.7° | 180.0° |
| H97 | C52 | C53 | H100 | 179.3° | 60.0° |
| H98 | C53 | H99 | H100 | 120.0° | 119.9° |
| C54 | N22 | H101 | C51 | 180.0° | 179.9° |
| N22 | C54 | C55 | C56 | 130.0° | 119.8° |
| N22 | C54 | C55 | H102 | 115.5° | 119.8° |
| N22 | C54 | C56 | H102 | 114.3° | 120.3° |
| N22 | C54 | C55 | O13 | 86.5° | 10.0° |
| N22 | C54 | C56 | C57 | 48.7° | 52.2° |
| N22 | C54 | C56 | H103 | 169.7° | 172.2° |
| N22 | C54 | C56 | H104 | 72.4° | 67.8° |
| N22 | C54 | C55 | N26 | 93.6° | 169.9° |
| H101 | N22 | C54 | C55 | 100.0° | 24.1° |
| H101 | N22 | C54 | C56 | 31.6° | 144.0° |
| H101 | N22 | C54 | H102 | 145.0° | 95.7° |
| C55 | C54 | C56 | H102 | 114.6° | 120.3° |
| C54 | C55 | O13 | N26 | 179.9° | 179.9° |
| C55 | C54 | C56 | C57 | 82.4° | 67.2° |
| C55 | C54 | C56 | H103 | 38.6° | 52.8° |
| C55 | C54 | C56 | H104 | 156.5° | 172.8° |
| C54 | C55 | N26 | C60 | 176.2° | 179.8° |
| C54 | C55 | N26 | H114 | 3.8° | 0.3° |
| C55 | C54 | N22 | C51 | 80.0° | 155.8° |
| C56 | C54 | C55 | O13 | 43.5° | 129.8° |
| C54 | C56 | C57 | H103 | 121.1° | 120.0° |
| C54 | C56 | C57 | H104 | 121.1° | 120.0° |
| C54 | C56 | H103 | H104 | 116.7° | 120.0° |
| C54 | C56 | C57 | C58 | 86.7° | 175.0° |
| C54 | C56 | C57 | H105 | 152.6° | 55.0° |
| C54 | C56 | C57 | H106 | 33.9° | 65.0° |
| C56 | C54 | N22 | C51 | 148.4° | 36.0° |
| C56 | C54 | C55 | N26 | 136.4° | 50.1° |
| H102 | C54 | C55 | O13 | 157.9° | 109.8° |
| H102 | C54 | C56 | C57 | 162.9° | 172.5° |
| H102 | C54 | C56 | H103 | 76.0° | 67.5° |
| H102 | C54 | C56 | H104 | 41.9° | 52.4° |
| H102 | C54 | N22 | C51 | 35.0° | 84.3° |
| H102 | C54 | C55 | N26 | 22.0° | 70.2° |
| O13 | C55 | N26 | C60 | 3.8° | 0.1° |
| O13 | C55 | N26 | H114 | 176.2° | 179.8° |
| C57 | C56 | H103 | H104 | 116.6° | 120.0° |
| C56 | C57 | C58 | H105 | 120.6° | 120.0° |
| C56 | C57 | C58 | H106 | 120.6° | 120.0° |
| C56 | C57 | H105 | H106 | 118.1° | 120.0° |
| C56 | C57 | C58 | N23 | 65.5° | 180.0° |
| C56 | C57 | C58 | H107 | 174.1° | 60.0° |
| C56 | C57 | C58 | H108 | 54.8° | 60.0° |
| H103 | C56 | C57 | C58 | 34.3° | 65.0° |
| H103 | C56 | C57 | H105 | 86.3° | 175.0° |
| H103 | C56 | C57 | H106 | 155.0° | 55.0° |
| H104 | C56 | C57 | C58 | 152.2° | 55.0° |
| H104 | C56 | C57 | H105 | 31.6° | 65.0° |
| H104 | C56 | C57 | H106 | 87.2° | 175.0° |
| C58 | C57 | H105 | H106 | 118.0° | 120.0° |
| C57 | C58 | N23 | H107 | 120.3° | 120.0° |
| C57 | C58 | N23 | H108 | 120.3° | 120.0° |
| C57 | C58 | H107 | H108 | 119.0° | 120.0° |
| C57 | C58 | N23 | C59 | 177.3° | 180.0° |
| C57 | C58 | N23 | H109 | 2.7° | 0.1° |
| H105 | C57 | C58 | N23 | 55.1° | 60.0° |
| H105 | C57 | C58 | H107 | 65.2° | 180.0° |
| H105 | C57 | C58 | H108 | 175.5° | 60.0° |
| H106 | C57 | C58 | N23 | 173.8° | 60.0° |
| H106 | C57 | C58 | H107 | 53.5° | 60.0° |
| H106 | C57 | C58 | H108 | 65.8° | 180.0° |
| N23 | C58 | H107 | H108 | 119.0° | 120.0° |
| C58 | N23 | C59 | H109 | 180.0° | 179.9° |
| C58 | N23 | C59 | N24 | 0.7° | 0.0° |
| C58 | N23 | C59 | N25 | 178.5° | 180.0° |
| H107 | C58 | N23 | C59 | 57.0° | 60.0° |
| H107 | C58 | N23 | H109 | 123.1° | 120.1° |
| H108 | C58 | N23 | C59 | 62.3° | 60.0° |
| H108 | C58 | N23 | H109 | 117.6° | 119.9° |
| N23 | C59 | N24 | N25 | 179.1° | 180.0° |
| N23 | C59 | N24 | H110 | 179.1° | 0.0° |
| N23 | C59 | N24 | H111 | 0.9° | 179.9° |
| N23 | C59 | N25 | H112 | 179.1° | 179.9° |
| N23 | C59 | N25 | H113 | 0.9° | 0.0° |
| H109 | N23 | C59 | N24 | 179.3° | 179.9° |
| H109 | N23 | C59 | N25 | 1.6° | 0.1° |
| C59 | N24 | H110 | H111 | 180.0° | 180.0° |
| N24 | C59 | N25 | H112 | 0.0° | 0.0° |
| N24 | C59 | N25 | H113 | 180.0° | 180.0° |
| N25 | C59 | N24 | H110 | 0.0° | 180.0° |
| N25 | C59 | N24 | H111 | 180.0° | 0.0° |
| C59 | N25 | H112 | H113 | 180.0° | 179.9° |
| C60 | N26 | H114 | C55 | 180.0° | 179.9° |
| N26 | C60 | C61 | C62 | 123.0° | 119.9° |
| N26 | C60 | C61 | H115 | 118.6° | 119.8° |
| N26 | C60 | C62 | H115 | 119.7° | 120.3° |
| N26 | C60 | C61 | O14 | 155.4° | 8.8° |
| N26 | C60 | C62 | C63 | 61.5° | 65.0° |
| N26 | C60 | C62 | H116 | 59.2° | 55.0° |
| N26 | C60 | C62 | H117 | 177.8° | 175.0° |
| N26 | C60 | C61 | N27 | 24.1° | 171.2° |
| H114 | N26 | C60 | C61 | 75.2° | 22.6° |
| H114 | N26 | C60 | C62 | 47.6° | 97.2° |
| H114 | N26 | C60 | H115 | 166.7° | 142.4° |
| C61 | C60 | C62 | H115 | 118.4° | 120.2° |
| C60 | C61 | O14 | N27 | 179.5° | 179.9° |
| C61 | C60 | C62 | C63 | 176.6° | 175.5° |
| C61 | C60 | C62 | H116 | 62.7° | 64.5° |
| C61 | C60 | C62 | H117 | 55.9° | 55.5° |
| C60 | C61 | N27 | C64 | 179.3° | 179.7° |
| C60 | C61 | N27 | H121 | 0.7° | 0.3° |
| C61 | C60 | N26 | C55 | 104.8° | 157.5° |
| C62 | C60 | C61 | O14 | 32.4° | 111.1° |
| C60 | C62 | C63 | H116 | 120.7° | 120.0° |
| C60 | C62 | C63 | H117 | 120.7° | 120.0° |
| C60 | C62 | H116 | H117 | 117.8° | 120.0° |
| C60 | C62 | C63 | H118 | 180.0° | 60.0° |
| C60 | C62 | C63 | H119 | 60.0° | 60.0° |
| C60 | C62 | C63 | H120 | 60.0° | 179.9° |
| C62 | C60 | N26 | C55 | 132.4° | 82.7° |
| C62 | C60 | C61 | N27 | 147.2° | 68.9° |
| H115 | C60 | C61 | O14 | 86.0° | 128.6° |
| H115 | C60 | C62 | C63 | 58.2° | 55.3° |
| H115 | C60 | C62 | H116 | 178.8° | 175.3° |
| H115 | C60 | C62 | H117 | 62.6° | 64.7° |
| H115 | C60 | N26 | C55 | 13.3° | 37.7° |
| H115 | C60 | C61 | N27 | 94.5° | 51.4° |
| O14 | C61 | N27 | C64 | 1.2° | 0.3° |
| O14 | C61 | N27 | H121 | 178.8° | 179.7° |
| C63 | C62 | H116 | H117 | 117.8° | 120.0° |
| C62 | C63 | H118 | H119 | 120.0° | 120.0° |
| C62 | C63 | H118 | H120 | 120.0° | 120.0° |
| C62 | C63 | H119 | H120 | 120.0° | 119.9° |
| H116 | C62 | C63 | H118 | 59.3° | 180.0° |
| H116 | C62 | C63 | H119 | 179.3° | 59.9° |
| H116 | C62 | C63 | H120 | 60.7° | 60.0° |
| H117 | C62 | C63 | H118 | 59.3° | 60.0° |
| H117 | C62 | C63 | H119 | 60.7° | 180.0° |
| H117 | C62 | C63 | H120 | 179.3° | 60.1° |
| H118 | C63 | H119 | H120 | 120.0° | 120.0° |
| C64 | N27 | H121 | C61 | 180.0° | 180.0° |
| N27 | C64 | C65 | C66 | 121.8° | 119.8° |
| N27 | C64 | C65 | H122 | 119.8° | 119.8° |
| N27 | C64 | C66 | H122 | 122.9° | 120.4° |
| N27 | C64 | C65 | O15 | 72.0° | 10.4° |
| N27 | C64 | C66 | C67 | 174.2° | 56.8° |
| N27 | C64 | C66 | C68 | 48.4° | 176.8° |
| N27 | C64 | C66 | H123 | 69.2° | 63.2° |
| N27 | C64 | C65 | N28 | 107.2° | 169.7° |
| H121 | N27 | C64 | C65 | 62.0° | 23.9° |
| H121 | N27 | C64 | C66 | 56.6° | 143.6° |
| H121 | N27 | C64 | H122 | 178.7° | 95.9° |
| C65 | C64 | C66 | H122 | 118.7° | 120.4° |
| C64 | C65 | O15 | N28 | 179.0° | 179.9° |
| C65 | C64 | C66 | C67 | 67.4° | 62.4° |
| C65 | C64 | C66 | C68 | 166.8° | 57.6° |
| C65 | C64 | C66 | H123 | 49.3° | 177.6° |
| C64 | C65 | N28 | C69 | 177.0° | 179.8° |
| C64 | C65 | N28 | H130 | 3.0° | 0.2° |
| C65 | C64 | N27 | C61 | 118.0° | 156.1° |
| C66 | C64 | C65 | O15 | 49.8° | 130.1° |
| C64 | C66 | C67 | C68 | 126.2° | 120.0° |
| C64 | C66 | C67 | H123 | 116.6° | 120.0° |
| C64 | C66 | C68 | H123 | 117.5° | 120.0° |
| C64 | C66 | C67 | H124 | 180.0° | 55.1° |
| C64 | C66 | C67 | H125 | 60.0° | 175.1° |
| C64 | C66 | C67 | H126 | 60.0° | 64.9° |
| C64 | C66 | C68 | H127 | 180.0° | 34.8° |
| C64 | C66 | C68 | H128 | 60.0° | 154.8° |
| C64 | C66 | C68 | H129 | 60.0° | 85.2° |
| C66 | C64 | N27 | C61 | 123.4° | 36.4° |
| C66 | C64 | C65 | N28 | 131.1° | 49.9° |
| H122 | C64 | C65 | O15 | 168.2° | 109.4° |
| H122 | C64 | C66 | C67 | 51.4° | 177.2° |
| H122 | C64 | C66 | C68 | 74.5° | 62.8° |
| H122 | C64 | C66 | H123 | 168.0° | 57.2° |
| H122 | C64 | N27 | C61 | 1.3° | 84.1° |
| H122 | C64 | C65 | N28 | 12.7° | 70.5° |
| O15 | C65 | N28 | C69 | 2.1° | 0.3° |
| O15 | C65 | N28 | H130 | 177.9° | 179.7° |
| C67 | C66 | C68 | H123 | 117.1° | 120.0° |
| C66 | C67 | H124 | H125 | 120.0° | 120.0° |
| C66 | C67 | H124 | H126 | 120.0° | 120.0° |
| C66 | C67 | H125 | H126 | 120.0° | 120.0° |
| C67 | C66 | C68 | H127 | 54.6° | 154.8° |
| C67 | C66 | C68 | H128 | 65.4° | 85.2° |
| C67 | C66 | C68 | H129 | 174.6° | 34.8° |
| C68 | C66 | C67 | H124 | 53.8° | 64.9° |
| C68 | C66 | C67 | H125 | 173.8° | 55.1° |
| C68 | C66 | C67 | H126 | 66.2° | 175.1° |
| C66 | C68 | H127 | H128 | 120.0° | 120.0° |
| C66 | C68 | H127 | H129 | 120.0° | 120.0° |
| C66 | C68 | H128 | H129 | 120.0° | 120.0° |
| H123 | C66 | C67 | H124 | 63.4° | 175.1° |
| H123 | C66 | C67 | H125 | 56.6° | 65.0° |
| H123 | C66 | C67 | H126 | 176.6° | 55.1° |
| H123 | C66 | C68 | H127 | 62.5° | 85.2° |
| H123 | C66 | C68 | H128 | 177.5° | 34.8° |
| H123 | C66 | C68 | H129 | 57.5° | 154.8° |
| H124 | C67 | H125 | H126 | 119.9° | 120.0° |
| H127 | C68 | H128 | H129 | 120.0° | 120.0° |
| C69 | N28 | H130 | C65 | 180.0° | 180.0° |
| N28 | C69 | C70 | C71 | 121.8° | 119.9° |
| N28 | C69 | C70 | H131 | 119.6° | 119.8° |
| N28 | C69 | C71 | H131 | 119.7° | 120.3° |
| N28 | C69 | C70 | O16 | 87.1° | 9.9° |
| N28 | C69 | C71 | C72 | 175.8° | 65.0° |
| N28 | C69 | C71 | H132 | 55.1° | 55.0° |
| N28 | C69 | C71 | H133 | 63.5° | 175.0° |
| N28 | C69 | C70 | N29 | 90.4° | 170.2° |
| H130 | N28 | C69 | C70 | 30.8° | 23.9° |
| H130 | N28 | C69 | C71 | 91.5° | 96.0° |
| H130 | N28 | C69 | H131 | 149.7° | 143.6° |
| C70 | C69 | C71 | H131 | 118.8° | 120.2° |
| C69 | C70 | O16 | N29 | 177.3° | 179.9° |
| C70 | C69 | C71 | C72 | 62.6° | 175.5° |
| C70 | C69 | C71 | H132 | 176.6° | 64.5° |
| C70 | C69 | C71 | H133 | 58.1° | 55.5° |
| C69 | C70 | N29 | C73 | 176.0° | 179.7° |
| C69 | C70 | N29 | H137 | 4.1° | 0.2° |
| C70 | C69 | N28 | C65 | 149.2° | 156.1° |
| C71 | C69 | C70 | O16 | 34.7° | 110.0° |
| C69 | C71 | C72 | H132 | 120.7° | 120.0° |
| C69 | C71 | C72 | H133 | 120.8° | 120.0° |
| C69 | C71 | H132 | H133 | 117.7° | 120.0° |
| C69 | C71 | C72 | H134 | 180.0° | 60.0° |
| C69 | C71 | C72 | H135 | 60.0° | 60.0° |
| C69 | C71 | C72 | H136 | 60.0° | 180.0° |
| C71 | C69 | N28 | C65 | 88.5° | 84.0° |
| C71 | C69 | C70 | N29 | 147.8° | 69.9° |
| H131 | C69 | C70 | O16 | 153.3° | 129.7° |
| H131 | C69 | C71 | C72 | 56.1° | 55.3° |
| H131 | C69 | C71 | H132 | 64.6° | 175.3° |
| H131 | C69 | C71 | H133 | 176.9° | 64.7° |
| H131 | C69 | N28 | C65 | 30.3° | 36.3° |
| H131 | C69 | C70 | N29 | 29.2° | 50.4° |
| O16 | C70 | N29 | C73 | 6.6° | 0.4° |
| O16 | C70 | N29 | H137 | 173.4° | 179.7° |
| C72 | C71 | H132 | H133 | 117.6° | 120.0° |
| C71 | C72 | H134 | H135 | 120.0° | 120.0° |
| C71 | C72 | H134 | H136 | 120.0° | 120.1° |
| C71 | C72 | H135 | H136 | 120.0° | 120.0° |
| H132 | C71 | C72 | H134 | 59.2° | 180.0° |
| H132 | C71 | C72 | H135 | 179.3° | 60.0° |
| H132 | C71 | C72 | H136 | 60.8° | 60.0° |
| H133 | C71 | C72 | H134 | 59.3° | 60.0° |
| H133 | C71 | C72 | H135 | 60.8° | NaN° |
| H133 | C71 | C72 | H136 | 179.3° | 60.0° |
| H134 | C72 | H135 | H136 | 120.0° | 120.0° |
| C73 | N29 | H137 | C70 | 180.0° | 179.9° |
| N29 | C73 | C74 | C75 | 121.0° | 119.8° |
| N29 | C73 | C74 | H138 | 119.9° | 119.8° |
| N29 | C73 | C75 | H138 | 122.6° | 120.3° |
| N29 | C73 | C74 | O17 | 24.2° | 11.6° |
| N29 | C73 | C75 | C76 | 63.4° | 51.7° |
| N29 | C73 | C75 | H139 | 57.5° | 171.7° |
| N29 | C73 | C75 | H140 | 175.7° | 68.3° |
| N29 | C73 | C74 | N33 | 156.8° | 168.4° |
| H137 | N29 | C73 | C74 | 64.4° | 25.7° |
| H137 | N29 | C73 | C75 | 54.4° | 145.5° |
| H137 | N29 | C73 | H138 | 176.3° | 94.1° |
| C74 | C73 | C75 | H138 | 119.3° | 120.3° |
| C73 | C74 | O17 | N33 | 178.9° | 180.0° |
| C74 | C73 | C75 | C76 | 178.4° | 67.7° |
| C74 | C73 | C75 | H139 | 60.7° | 52.4° |
| C74 | C73 | C75 | H140 | 57.6° | 172.4° |
| C73 | C74 | N33 | C79 | 179.3° | 179.8° |
| C73 | C74 | N33 | H150 | 0.7° | 0.2° |
| C74 | C73 | N29 | C70 | 115.7° | 154.2° |
| C75 | C73 | C74 | O17 | 96.8° | 131.4° |
| C73 | C75 | C76 | H139 | 120.9° | 120.0° |
| C73 | C75 | C76 | H140 | 120.9° | 120.0° |
| C73 | C75 | H139 | H140 | 117.2° | 120.1° |
| C73 | C75 | C76 | C77 | 174.2° | 175.0° |
| C73 | C75 | C76 | H141 | 54.2° | 55.0° |
| C73 | C75 | C76 | H142 | 65.8° | 65.1° |
| C75 | C73 | N29 | C70 | 125.5° | 34.4° |
| C75 | C73 | C74 | N33 | 82.1° | 48.6° |
| H138 | C73 | C74 | O17 | 144.1° | 108.2° |
| H138 | C73 | C75 | C76 | 59.2° | 172.0° |
| H138 | C73 | C75 | H139 | 179.9° | 68.0° |
| H138 | C73 | C75 | H140 | 61.7° | 52.0° |
| H138 | C73 | N29 | C70 | 3.7° | 86.0° |
| H138 | C73 | C74 | N33 | 36.9° | 71.8° |
| O17 | C74 | N33 | C79 | 1.8° | 0.2° |
| O17 | C74 | N33 | H150 | 178.2° | 179.8° |
| C76 | C75 | H139 | H140 | 117.2° | 119.9° |
| C75 | C76 | C77 | H141 | 120.0° | 120.0° |
| C75 | C76 | C77 | H142 | 120.0° | 120.0° |
| C75 | C76 | H141 | H142 | 119.9° | 120.0° |
| C75 | C76 | C77 | N30 | 177.4° | 180.0° |
| C75 | C76 | C77 | H143 | 62.0° | 60.0° |
| C75 | C76 | C77 | H144 | 56.9° | 60.0° |
| H139 | C75 | C76 | C77 | 64.9° | 65.0° |
| H139 | C75 | C76 | H141 | 175.1° | 175.0° |
| H139 | C75 | C76 | H142 | 55.1° | 55.0° |
| H140 | C75 | C76 | C77 | 53.3° | 54.9° |
| H140 | C75 | C76 | H141 | 66.7° | 65.1° |
| H140 | C75 | C76 | H142 | 173.3° | 174.9° |
| C77 | C76 | H141 | H142 | 119.9° | 120.0° |
| C76 | C77 | N30 | H143 | 120.6° | 120.0° |
| C76 | C77 | N30 | H144 | 120.5° | 120.0° |
| C76 | C77 | H143 | H144 | 118.3° | 120.0° |
| C76 | C77 | N30 | C78 | 173.1° | 180.0° |
| C76 | C77 | N30 | H145 | 6.9° | 0.0° |
| H141 | C76 | C77 | N30 | 57.4° | 60.0° |
| H141 | C76 | C77 | H143 | 177.9° | 180.0° |
| H141 | C76 | C77 | H144 | 63.2° | 60.0° |
| H142 | C76 | C77 | N30 | 62.6° | 60.0° |
| H142 | C76 | C77 | H143 | 58.0° | 60.0° |
| H142 | C76 | C77 | H144 | 176.9° | NaN° |
| N30 | C77 | H143 | H144 | 118.4° | 120.0° |
| C77 | N30 | C78 | H145 | 180.0° | 180.0° |
| C77 | N30 | C78 | N31 | 1.0° | 0.0° |
| C77 | N30 | C78 | N32 | 179.4° | 179.9° |
| H143 | C77 | N30 | C78 | 52.6° | 60.0° |
| H143 | C77 | N30 | H145 | 127.4° | 120.0° |
| H144 | C77 | N30 | C78 | 66.3° | 60.0° |
| H144 | C77 | N30 | H145 | 113.7° | 120.0° |
| N30 | C78 | N31 | N32 | 179.6° | 179.9° |
| N30 | C78 | N31 | H146 | 179.5° | 0.1° |
| N30 | C78 | N31 | H147 | 0.4° | 180.0° |
| N30 | C78 | N32 | H148 | 179.6° | 0.1° |
| N30 | C78 | N32 | H149 | 0.4° | 180.0° |
| H145 | N30 | C78 | N31 | 179.0° | 180.0° |
| H145 | N30 | C78 | N32 | 0.6° | 0.0° |
| C78 | N31 | H146 | H147 | 180.0° | 179.9° |
| N31 | C78 | N32 | H148 | 0.0° | 180.0° |
| N31 | C78 | N32 | H149 | 180.0° | 0.1° |
| N32 | C78 | N31 | H146 | 0.0° | 180.0° |
| N32 | C78 | N31 | H147 | 180.0° | 0.1° |
| C78 | N32 | H148 | H149 | 180.0° | 179.9° |
| C79 | N33 | H150 | C74 | 180.0° | 179.9° |
| N33 | C79 | C80 | C81 | 123.3° | 119.8° |
| N33 | C79 | C80 | H151 | 118.3° | 120.0° |
| N33 | C79 | C81 | H151 | 118.7° | 120.3° |
| N33 | C79 | C80 | O18 | 93.4° | 9.1° |
| N33 | C79 | C81 | C82 | 56.3° | 65.0° |
| N33 | C79 | C81 | H152 | 64.2° | 55.0° |
| N33 | C79 | C81 | H153 | 176.9° | 175.0° |
| N33 | C79 | C80 | N1 | 84.8° | 170.7° |
| H150 | N33 | C79 | C80 | 102.5° | 23.2° |
| H150 | N33 | C79 | C81 | 21.7° | 96.5° |
| H150 | N33 | C79 | H151 | 139.7° | 143.2° |
| C80 | C79 | C81 | H151 | 118.6° | 120.3° |
| C79 | C80 | O18 | N1 | 178.1° | 179.8° |
| C80 | C79 | C81 | C82 | 179.1° | 175.6° |
| C80 | C79 | C81 | H152 | 58.5° | 64.5° |
| C80 | C79 | C81 | H153 | 60.4° | 55.5° |
| C80 | C79 | N33 | C74 | 77.5° | 156.7° |
| C81 | C79 | C80 | O18 | 29.9° | 110.7° |
| C79 | C81 | C82 | H152 | 120.5° | 119.9° |
| C79 | C81 | C82 | H153 | 120.5° | 120.0° |
| C79 | C81 | H152 | H153 | 118.4° | 120.0° |
| C79 | C81 | C82 | C83 | 56.8° | 179.9° |
| C79 | C81 | C82 | H154 | 63.4° | 60.0° |
| C79 | C81 | C82 | H155 | 177.0° | 60.0° |
| C81 | C79 | C80 | N1 | 151.9° | 69.5° |
| C81 | C79 | N33 | C74 | 158.3° | 83.6° |
| H151 | C79 | C80 | O18 | 148.3° | 129.1° |
| H151 | C79 | C81 | C82 | 62.3° | 55.3° |
| H151 | C79 | C81 | H152 | 177.1° | 175.3° |
| H151 | C79 | C81 | H153 | 58.2° | 64.7° |
| H151 | C79 | C80 | N1 | 33.5° | 50.7° |
| H151 | C79 | N33 | C74 | 40.3° | 36.7° |
| C82 | C81 | H152 | H153 | 118.4° | 120.0° |
| C81 | C82 | C83 | H154 | 120.2° | 120.1° |
| C81 | C82 | C83 | H155 | 120.2° | 120.0° |
| C81 | C82 | H154 | H155 | 119.4° | 120.0° |
| C81 | C82 | C83 | N34 | 174.2° | 180.0° |
| C81 | C82 | C83 | H156 | 65.4° | 60.0° |
| C81 | C82 | C83 | H157 | 53.7° | 60.0° |
| H152 | C81 | C82 | C83 | 177.4° | 60.0° |
| H152 | C81 | C82 | H154 | 57.2° | 179.9° |
| H152 | C81 | C82 | H155 | 62.4° | 60.0° |
| H153 | C81 | C82 | C83 | 63.7° | 60.0° |
| H153 | C81 | C82 | H154 | 176.1° | 60.0° |
| H153 | C81 | C82 | H155 | 56.5° | 180.0° |
| C83 | C82 | H154 | H155 | 119.4° | 120.0° |
| C82 | C83 | N34 | H156 | 120.5° | 120.0° |
| C82 | C83 | N34 | H157 | 120.5° | 120.0° |
| C82 | C83 | H156 | H157 | 118.5° | 119.9° |
| C82 | C83 | N34 | C84 | 179.1° | 180.0° |
| C82 | C83 | N34 | H158 | 1.0° | 0.0° |
| H154 | C82 | C83 | N34 | 54.0° | 59.9° |
| H154 | C82 | C83 | H156 | 174.5° | 180.0° |
| H154 | C82 | C83 | H157 | 66.5° | 60.1° |
| H155 | C82 | C83 | N34 | 65.6° | 60.0° |
| H155 | C82 | C83 | H156 | 54.9° | 60.0° |
| H155 | C82 | C83 | H157 | 173.9° | 180.0° |
| N34 | C83 | H156 | H157 | 118.5° | 120.1° |
| C83 | N34 | C84 | H158 | 180.0° | 180.0° |
| C83 | N34 | C84 | N35 | 1.3° | 0.1° |
| C83 | N34 | C84 | N36 | 177.6° | 180.0° |
| H156 | C83 | N34 | C84 | 58.6° | 60.0° |
| H156 | C83 | N34 | H158 | 121.4° | 120.0° |
| H157 | C83 | N34 | C84 | 60.5° | 60.0° |
| H157 | C83 | N34 | H158 | 119.5° | 120.0° |
| N34 | C84 | N35 | N36 | 178.9° | 179.9° |
| N34 | C84 | N35 | H159 | 178.9° | 0.1° |
| N34 | C84 | N35 | H160 | 1.1° | 180.0° |
| N34 | C84 | N36 | H161 | 178.9° | 180.0° |
| N34 | C84 | N36 | H162 | 1.1° | 0.0° |
| H158 | N34 | C84 | N35 | 178.8° | 180.0° |
| H158 | N34 | C84 | N36 | 2.3° | 0.0° |
| C84 | N35 | H159 | H160 | 180.0° | 179.9° |
| N35 | C84 | N36 | H161 | 0.0° | 0.1° |
| N35 | C84 | N36 | H162 | 180.0° | 180.0° |
| N36 | C84 | N35 | H159 | 0.0° | 180.0° |
| N36 | C84 | N35 | H160 | 180.0° | 0.0° |
| C84 | N36 | H161 | H162 | 180.0° | 180.0° |
