A1IHM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C38 | O17 | sing | 1.43Å | 1.40Å | |
| C38 | C37 | sing | 1.53Å | 1.53Å | |
| N3 | C26 | sing | 1.47Å | 1.45Å | |
| O19 | C36 | sing | 1.43Å | 1.41Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C37 | O18 | sing | 1.43Å | 1.40Å | |
| O12 | C21 | doub | 1.21Å | 1.19Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C26 | C25 | sing | 1.53Å | 1.56Å | |
| O26 | C40 | doub | 1.21Å | 1.27Å | |
| C36 | C35 | sing | 1.53Å | 1.52Å | |
| O11 | C17 | sing | 1.43Å | 1.40Å | |
| O27 | C40 | sing | 1.34Å | 1.26Å | |
| O23 | C29 | sing | 1.43Å | 1.38Å | |
| C40 | C23 | sing | 1.51Å | 1.53Å | |
| C27 | O14 | sing | 1.43Å | 1.39Å | |
| C27 | C28 | sing | 1.53Å | 1.57Å | |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C21 | N1 | sing | 1.35Å | 1.46Å | |
| C25 | O25 | sing | 1.43Å | 1.36Å | |
| C25 | C24 | sing | 1.53Å | 1.56Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| O14 | C23 | sing | 1.43Å | 1.38Å | |
| C35 | O16 | sing | 1.43Å | 1.44Å | |
| C35 | C34 | sing | 1.53Å | 1.52Å | |
| C16 | N1 | sing | 1.47Å | 1.44Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| O16 | C31 | sing | 1.43Å | 1.41Å | |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C28 | O24 | sing | 1.43Å | 1.38Å | |
| C23 | C24 | sing | 1.53Å | 1.51Å | |
| C23 | O13 | sing | 1.43Å | 1.46Å | |
| C29 | C30 | sing | 1.53Å | 1.56Å | |
| O22 | C39 | doub | 1.21Å | 1.25Å | |
| O20 | C33 | sing | 1.43Å | 1.42Å | |
| O10 | C18 | sing | 1.43Å | 1.41Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C34 | C33 | sing | 1.53Å | 1.51Å | |
| C34 | N2 | sing | 1.47Å | 1.46Å | |
| C15 | O7 | sing | 1.43Å | 1.41Å | |
| C15 | O8 | sing | 1.43Å | 1.39Å | |
| C30 | O15 | sing | 1.43Å | 1.44Å | |
| C31 | C39 | sing | 1.51Å | 1.53Å | |
| C31 | O15 | sing | 1.43Å | 1.44Å | |
| C31 | C32 | sing | 1.53Å | 1.50Å | |
| C39 | O21 | sing | 1.34Å | 1.25Å | |
| C33 | C32 | sing | 1.53Å | 1.51Å | |
| O13 | C11 | sing | 1.43Å | 1.42Å | |
| O7 | C12 | sing | 1.43Å | 1.44Å | |
| O9 | C20 | sing | 1.43Å | 1.40Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C19 | O8 | sing | 1.43Å | 1.40Å | |
| C19 | C20 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| O28 | C10 | sing | 1.43Å | 1.37Å | |
| C10 | C9 | sing | 1.53Å | 1.56Å | |
| C13 | O5 | sing | 1.43Å | 1.38Å | |
| C13 | C14 | sing | 1.53Å | 1.55Å | |
| O5 | C9 | sing | 1.43Å | 1.36Å | |
| C9 | O4 | sing | 1.43Å | 1.42Å | |
| C14 | O6 | sing | 1.43Å | 1.40Å | |
| O4 | C6 | sing | 1.43Å | 1.44Å | |
| O3 | C8 | sing | 1.43Å | 1.40Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| O29 | C5 | sing | 1.43Å | 1.40Å | |
| C7 | O2 | sing | 1.43Å | 1.41Å | |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | O30 | sing | 1.43Å | 1.39Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| O2 | C3 | sing | 1.43Å | 1.39Å | |
| C3 | O1 | sing | 1.43Å | 1.42Å | |
| O1 | C2 | sing | 1.43Å | 1.42Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| N1 | H32 | sing | 0.97Å | 1.00Å | |
| N3 | H68 | sing | 1.01Å | 1.00Å | |
| N3 | H62 | sing | 1.01Å | 1.00Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C22 | H34 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C24 | H37 | sing | 1.09Å | 1.10Å | |
| C26 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H41 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.09Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C25 | H38 | sing | 1.09Å | 1.10Å | |
| C27 | H40 | sing | 1.09Å | 1.10Å | |
| C29 | H42 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C30 | H43 | sing | 1.09Å | 1.10Å | |
| C30 | H44 | sing | 1.09Å | 1.10Å | |
| C32 | H46 | sing | 1.09Å | 1.10Å | |
| C32 | H45 | sing | 1.09Å | 1.10Å | |
| C33 | H47 | sing | 1.09Å | 1.10Å | |
| C34 | H48 | sing | 1.09Å | 1.10Å | |
| C35 | H49 | sing | 1.09Å | 1.10Å | |
| C36 | H50 | sing | 1.09Å | 1.10Å | |
| C37 | H51 | sing | 1.09Å | 1.10Å | |
| C38 | H53 | sing | 1.09Å | 1.10Å | |
| C38 | H52 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| N2 | H69 | sing | 1.01Å | 1.00Å | |
| N2 | H57 | sing | 1.01Å | 1.00Å | |
| O10 | H30 | sing | 0.97Å | 0.95Å | |
| O11 | H31 | sing | 0.97Å | 0.95Å | |
| O17 | H54 | sing | 0.97Å | 0.95Å | |
| O18 | H55 | sing | 0.97Å | 0.95Å | |
| O19 | H56 | sing | 0.97Å | 0.95Å | |
| O20 | H59 | sing | 0.97Å | 0.95Å | |
| O21 | H70 | sing | 0.97Å | 0.95Å | |
| O23 | H60 | sing | 0.97Å | 0.95Å | |
| O24 | H61 | sing | 0.97Å | 0.95Å | |
| O25 | H64 | sing | 0.97Å | 0.95Å | |
| O27 | H71 | sing | 0.97Å | 0.95Å | |
| O28 | H65 | sing | 0.97Å | 0.95Å | |
| O29 | H66 | sing | 0.97Å | 0.95Å | |
| O3 | H13 | sing | 0.97Å | 0.95Å | |
| O30 | H67 | sing | 0.97Å | 0.95Å | |
| O6 | H21 | sing | 0.97Å | 0.95Å | |
| O9 | H29 | sing | 0.97Å | 0.95Å | |
| C1 | N4 | sing | 1.46Å | 284.15Å | |
| C1 | C43 | sing | 1.53Å | 284.15Å | |
| N4 | C41 | sing | 1.35Å | 0.00Å | |
| C41 | O31 | doub | 1.21Å | 0.00Å | |
| C41 | C44 | sing | 1.51Å | 0.00Å | |
| C44 | C42 | sing | 1.53Å | 0.00Å | |
| C42 | C45 | sing | 1.53Å | 0.00Å | |
| C45 | C46 | sing | 1.53Å | 0.00Å | |
| C46 | C47 | sing | 1.53Å | 0.00Å | |
| C47 | C48 | sing | 1.53Å | 0.00Å | |
| C48 | C49 | sing | 1.53Å | 0.00Å | |
| C49 | C51 | sing | 1.53Å | 0.00Å | |
| C51 | C52 | sing | 1.53Å | 0.00Å | |
| C52 | C53 | sing | 1.53Å | 0.00Å | |
| C53 | C54 | sing | 1.53Å | 0.00Å | |
| C54 | C55 | sing | 1.53Å | 0.00Å | |
| C55 | C56 | sing | 1.53Å | 0.00Å | |
| C56 | C50 | sing | 1.53Å | 0.00Å | |
| C50 | C57 | sing | 1.53Å | 0.00Å | |
| C57 | C58 | sing | 1.53Å | 0.00Å | |
| C58 | C59 | sing | 1.53Å | 0.00Å | |
| C43 | C60 | sing | 1.51Å | 0.00Å | |
| C43 | O32 | sing | 1.43Å | 0.00Å | |
| C60 | C61 | doub | 1.31Å | 0.00Å | |
| C61 | C62 | sing | 1.51Å | 0.00Å | |
| C62 | C63 | sing | 1.53Å | 0.00Å | |
| C63 | C64 | sing | 1.53Å | 0.00Å | |
| C64 | C65 | sing | 1.53Å | 0.00Å | |
| C65 | C66 | sing | 1.53Å | 0.00Å | |
| C66 | C67 | sing | 1.53Å | 0.00Å | |
| C67 | C68 | sing | 1.53Å | 0.00Å | |
| C68 | C69 | sing | 1.53Å | 0.00Å | |
| C69 | C70 | sing | 1.53Å | 0.00Å | |
| C70 | C71 | sing | 1.53Å | 0.00Å | |
| C71 | C72 | sing | 1.53Å | 0.00Å | |
| C72 | C73 | sing | 1.53Å | 0.00Å | |
| C73 | C74 | sing | 1.53Å | 0.00Å | |
| N4 | H1 | sing | 0.97Å | 0.00Å | |
| C43 | H2 | sing | 1.09Å | 0.00Å | |
| C44 | H58 | sing | 1.09Å | 0.00Å | |
| C44 | H63 | sing | 1.09Å | 0.00Å | |
| C42 | H72 | sing | 1.09Å | 0.00Å | |
| C42 | H73 | sing | 1.09Å | 0.00Å | |
| C45 | H74 | sing | 1.09Å | 0.00Å | |
| C45 | H75 | sing | 1.09Å | 0.00Å | |
| C46 | H76 | sing | 1.09Å | 0.00Å | |
| C46 | H77 | sing | 1.09Å | 0.00Å | |
| C47 | H78 | sing | 1.09Å | 0.00Å | |
| C47 | H79 | sing | 1.09Å | 0.00Å | |
| C48 | H80 | sing | 1.09Å | 0.00Å | |
| C48 | H81 | sing | 1.09Å | 0.00Å | |
| C49 | H82 | sing | 1.09Å | 0.00Å | |
| C49 | H83 | sing | 1.09Å | 0.00Å | |
| C51 | H84 | sing | 1.09Å | 0.00Å | |
| C51 | H85 | sing | 1.09Å | 0.00Å | |
| C52 | H86 | sing | 1.09Å | 0.00Å | |
| C52 | H87 | sing | 1.09Å | 0.00Å | |
| C53 | H88 | sing | 1.09Å | 0.00Å | |
| C53 | H89 | sing | 1.09Å | 0.00Å | |
| C54 | H90 | sing | 1.09Å | 0.00Å | |
| C54 | H91 | sing | 1.09Å | 0.00Å | |
| C55 | H92 | sing | 1.09Å | 0.00Å | |
| C55 | H93 | sing | 1.09Å | 0.00Å | |
| C56 | H94 | sing | 1.09Å | 0.00Å | |
| C56 | H95 | sing | 1.09Å | 0.00Å | |
| C50 | H96 | sing | 1.09Å | 0.00Å | |
| C50 | H97 | sing | 1.09Å | 0.00Å | |
| C57 | H98 | sing | 1.09Å | 0.00Å | |
| C57 | H99 | sing | 1.09Å | 0.00Å | |
| C58 | H100 | sing | 1.09Å | 0.00Å | |
| C58 | H101 | sing | 1.09Å | 0.00Å | |
| C59 | H102 | sing | 1.09Å | 0.00Å | |
| C59 | H103 | sing | 1.09Å | 0.00Å | |
| C59 | H104 | sing | 1.09Å | 0.00Å | |
| C60 | H105 | sing | 1.08Å | 0.00Å | |
| O32 | H106 | sing | 0.97Å | 0.00Å | |
| C61 | H107 | sing | 1.08Å | 0.00Å | |
| C62 | H108 | sing | 1.09Å | 0.00Å | |
| C62 | H109 | sing | 1.09Å | 0.00Å | |
| C63 | H110 | sing | 1.09Å | 0.00Å | |
| C63 | H111 | sing | 1.09Å | 0.00Å | |
| C64 | H113 | sing | 1.09Å | 0.00Å | |
| C64 | H112 | sing | 1.09Å | 0.00Å | |
| C65 | H114 | sing | 1.09Å | 0.00Å | |
| C65 | H115 | sing | 1.09Å | 0.00Å | |
| C66 | H116 | sing | 1.09Å | 0.00Å | |
| C66 | H117 | sing | 1.09Å | 0.00Å | |
| C67 | H118 | sing | 1.09Å | 0.00Å | |
| C67 | H121 | sing | 1.09Å | 0.00Å | |
| C68 | H120 | sing | 1.09Å | 0.00Å | |
| C68 | H119 | sing | 1.09Å | 0.00Å | |
| C69 | H123 | sing | 1.09Å | 0.00Å | |
| C69 | H122 | sing | 1.09Å | 0.00Å | |
| C70 | H124 | sing | 1.09Å | 0.00Å | |
| C70 | H125 | sing | 1.09Å | 0.00Å | |
| C71 | H127 | sing | 1.09Å | 0.00Å | |
| C71 | H126 | sing | 1.09Å | 0.00Å | |
| C72 | H128 | sing | 1.09Å | 0.00Å | |
| C72 | H129 | sing | 1.09Å | 0.00Å | |
| C73 | H130 | sing | 1.09Å | 0.00Å | |
| C73 | H131 | sing | 1.09Å | 0.00Å | |
| C74 | H132 | sing | 1.09Å | 0.00Å | |
| C74 | H134 | sing | 1.09Å | 0.00Å | |
| C74 | H133 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O17 | C38 | C37 | 108.7° | 109.5° |
| O17 | C38 | H53 | 109.7° | 109.5° |
| O17 | C38 | H52 | 109.7° | 109.5° |
| C38 | O17 | H54 | 109.5° | 114.0° |
| C38 | C37 | C36 | 112.2° | 109.5° |
| C38 | C37 | O18 | 107.7° | 109.5° |
| C38 | C37 | H51 | 107.7° | 109.5° |
| C37 | C38 | H53 | 109.7° | 109.5° |
| C37 | C38 | H52 | 109.7° | 109.5° |
| N3 | C26 | C27 | 114.7° | 109.5° |
| N3 | C26 | C25 | 109.5° | 109.5° |
| C26 | N3 | H68 | 109.5° | 111.0° |
| C26 | N3 | H62 | 109.4° | 111.0° |
| N3 | C26 | H39 | 108.6° | 109.5° |
| O19 | C36 | C37 | 112.3° | 109.4° |
| O19 | C36 | C35 | 108.7° | 109.5° |
| O19 | C36 | H50 | 109.1° | 109.5° |
| C36 | O19 | H56 | 109.5° | 114.0° |
| C36 | C37 | O18 | 112.1° | 109.5° |
| C37 | C36 | C35 | 111.5° | 109.5° |
| C37 | C36 | H50 | 107.4° | 109.4° |
| C36 | C37 | H51 | 107.6° | 109.4° |
| O18 | C37 | H51 | 109.4° | 109.5° |
| C37 | O18 | H55 | 109.5° | 114.0° |
| O12 | C21 | C22 | 119.7° | 120.0° |
| O12 | C21 | N1 | 120.8° | 120.0° |
| C27 | C26 | C25 | 109.1° | 109.1° |
| C26 | C27 | O14 | 109.8° | 109.4° |
| C26 | C27 | C28 | 113.2° | 109.5° |
| C27 | C26 | H39 | 107.5° | 109.5° |
| C26 | C27 | H40 | 108.0° | 109.5° |
| C26 | C25 | O25 | 109.2° | 109.6° |
| C26 | C25 | C24 | 110.7° | 109.0° |
| C25 | C26 | H39 | 107.2° | 109.6° |
| C26 | C25 | H38 | 108.3° | 109.6° |
| O26 | C40 | O27 | 119.9° | 120.0° |
| O26 | C40 | C23 | 119.8° | 120.0° |
| C36 | C35 | O16 | 108.5° | 109.5° |
| C36 | C35 | C34 | 111.4° | 109.5° |
| C36 | C35 | H49 | 108.6° | 109.5° |
| C35 | C36 | H50 | 107.7° | 109.5° |
| O11 | C17 | C16 | 109.7° | 109.5° |
| O11 | C17 | C18 | 108.9° | 109.6° |
| O11 | C17 | H24 | 110.1° | 109.6° |
| C17 | O11 | H31 | 109.5° | 114.0° |
| O27 | C40 | C23 | 120.2° | 120.0° |
| C40 | O27 | H71 | 109.5° | 117.0° |
| O23 | C29 | C28 | 109.2° | 109.5° |
| O23 | C29 | C30 | 107.8° | 109.5° |
| O23 | C29 | H42 | 111.2° | 109.4° |
| C29 | O23 | H60 | 109.5° | 113.9° |
| C40 | C23 | O14 | 110.9° | 109.5° |
| C40 | C23 | C24 | 109.7° | 109.5° |
| C40 | C23 | O13 | 106.1° | 109.5° |
| O14 | C27 | C28 | 108.3° | 109.5° |
| C27 | O14 | C23 | 127.2° | 114.1° |
| O14 | C27 | H40 | 109.9° | 109.5° |
| C27 | C28 | C29 | 110.7° | 109.5° |
| C27 | C28 | O24 | 108.7° | 109.5° |
| C27 | C28 | H41 | 108.3° | 109.4° |
| C28 | C27 | H40 | 107.6° | 109.5° |
| C22 | C21 | N1 | 119.5° | 120.0° |
| C21 | C22 | H35 | 109.5° | 109.4° |
| C21 | C22 | H33 | 109.5° | 109.5° |
| C21 | C22 | H34 | 109.4° | 109.4° |
| C21 | N1 | C16 | 122.0° | 120.0° |
| C21 | N1 | H32 | 119.0° | 120.0° |
| O25 | C25 | C24 | 109.2° | 109.5° |
| O25 | C25 | H38 | 111.1° | 109.6° |
| C25 | O25 | H64 | 109.5° | 114.1° |
| C25 | C24 | C23 | 116.2° | 109.2° |
| C25 | C24 | H36 | 107.7° | 109.5° |
| C25 | C24 | H37 | 107.8° | 109.5° |
| C24 | C25 | H38 | 108.3° | 109.5° |
| C16 | C17 | C18 | 111.5° | 109.0° |
| C17 | C16 | N1 | 108.0° | 109.5° |
| C17 | C16 | C15 | 111.0° | 109.2° |
| C16 | C17 | H24 | 108.2° | 109.5° |
| C17 | C16 | H23 | 109.7° | 109.5° |
| C17 | C18 | O10 | 109.4° | 109.5° |
| C17 | C18 | C19 | 109.6° | 109.2° |
| C18 | C17 | H24 | 108.4° | 109.5° |
| C17 | C18 | H25 | 109.1° | 109.5° |
| O14 | C23 | C24 | 108.5° | 109.4° |
| O14 | C23 | O13 | 113.3° | 109.5° |
| O16 | C35 | C34 | 110.1° | 109.4° |
| C35 | O16 | C31 | 116.3° | 114.1° |
| O16 | C35 | H49 | 109.7° | 109.4° |
| C35 | C34 | C33 | 109.6° | 109.2° |
| C35 | C34 | N2 | 108.6° | 109.5° |
| C35 | C34 | H48 | 109.4° | 109.6° |
| C34 | C35 | H49 | 108.5° | 109.5° |
| N1 | C16 | C15 | 107.4° | 109.5° |
| C16 | N1 | H32 | 119.0° | 120.0° |
| N1 | C16 | H23 | 111.1° | 109.6° |
| C16 | C15 | O7 | 107.3° | 109.5° |
| C16 | C15 | O8 | 105.4° | 109.4° |
| C16 | C15 | H22 | 109.1° | 109.5° |
| C15 | C16 | H23 | 109.6° | 109.6° |
| O16 | C31 | C39 | 110.8° | 109.5° |
| O16 | C31 | O15 | 109.1° | 109.5° |
| O16 | C31 | C32 | 108.0° | 109.4° |
| C29 | C28 | O24 | 109.5° | 109.5° |
| C28 | C29 | C30 | 111.2° | 109.5° |
| C29 | C28 | H41 | 108.7° | 109.5° |
| C28 | C29 | H42 | 108.9° | 109.5° |
| O24 | C28 | H41 | 111.0° | 109.5° |
| C28 | O24 | H61 | 109.5° | 114.0° |
| C24 | C23 | O13 | 108.3° | 109.5° |
| C23 | C24 | H36 | 107.8° | 109.5° |
| C23 | C24 | H37 | 107.7° | 109.5° |
| C23 | O13 | C11 | 115.0° | 114.0° |
| C29 | C30 | O15 | 111.5° | 109.5° |
| C30 | C29 | H42 | 108.6° | 109.5° |
| C29 | C30 | H43 | 109.0° | 109.4° |
| C29 | C30 | H44 | 109.0° | 109.5° |
| O22 | C39 | C31 | 120.1° | 120.0° |
| O22 | C39 | O21 | 119.8° | 120.0° |
| O20 | C33 | C34 | 108.9° | 109.6° |
| O20 | C33 | C32 | 110.4° | 109.5° |
| O20 | C33 | H47 | 110.5° | 109.5° |
| C33 | O20 | H59 | 109.5° | 114.0° |
| O10 | C18 | C19 | 108.7° | 109.5° |
| O10 | C18 | H25 | 110.7° | 109.6° |
| C18 | O10 | H30 | 109.5° | 114.0° |
| C18 | C19 | O8 | 108.7° | 109.4° |
| C18 | C19 | C20 | 110.2° | 109.4° |
| C19 | C18 | H25 | 109.3° | 109.6° |
| C18 | C19 | H26 | 109.0° | 109.5° |
| C33 | C34 | N2 | 109.4° | 109.5° |
| C34 | C33 | C32 | 109.0° | 109.1° |
| C34 | C33 | H47 | 109.1° | 109.6° |
| C33 | C34 | H48 | 109.5° | 109.5° |
| N2 | C34 | H48 | 110.2° | 109.5° |
| C34 | N2 | H69 | 109.5° | 111.0° |
| C34 | N2 | H57 | 109.5° | 111.0° |
| O7 | C15 | O8 | 112.6° | 109.5° |
| C15 | O7 | C12 | 120.2° | 114.0° |
| O7 | C15 | H22 | 110.9° | 109.5° |
| C15 | O8 | C19 | 120.8° | 114.1° |
| O8 | C15 | H22 | 111.2° | 109.5° |
| C30 | O15 | C31 | 120.3° | 114.0° |
| O15 | C30 | H43 | 109.0° | 109.5° |
| O15 | C30 | H44 | 109.0° | 109.5° |
| C39 | C31 | O15 | 112.3° | 109.5° |
| C39 | C31 | C32 | 106.3° | 109.4° |
| C31 | C39 | O21 | 120.0° | 120.0° |
| O15 | C31 | C32 | 110.2° | 109.5° |
| C31 | C32 | C33 | 113.1° | 109.1° |
| C31 | C32 | H46 | 108.5° | 109.5° |
| C31 | C32 | H45 | 108.6° | 109.5° |
| C39 | O21 | H70 | 109.5° | 117.0° |
| C33 | C32 | H46 | 108.6° | 109.5° |
| C33 | C32 | H45 | 108.5° | 109.6° |
| C32 | C33 | H47 | 109.1° | 109.5° |
| O13 | C11 | C12 | 111.9° | 109.5° |
| O13 | C11 | C10 | 107.9° | 109.6° |
| O13 | C11 | H16 | 110.9° | 109.7° |
| O7 | C12 | C11 | 112.9° | 109.5° |
| O7 | C12 | C13 | 114.9° | 109.5° |
| O7 | C12 | H17 | 107.4° | 109.5° |
| O9 | C20 | C19 | 109.7° | 109.4° |
| O9 | C20 | H28 | 109.4° | 109.5° |
| O9 | C20 | H27 | 109.4° | 109.5° |
| C20 | O9 | H29 | 109.5° | 114.0° |
| C12 | C11 | C10 | 107.9° | 109.0° |
| C11 | C12 | C13 | 108.3° | 109.2° |
| C12 | C11 | H16 | 109.1° | 109.5° |
| C11 | C12 | H17 | 106.2° | 109.5° |
| C11 | C10 | O28 | 109.7° | 109.6° |
| C11 | C10 | C9 | 109.5° | 109.2° |
| C11 | C10 | H15 | 108.8° | 109.5° |
| C10 | C11 | H16 | 109.0° | 109.6° |
| O8 | C19 | C20 | 109.6° | 109.5° |
| O8 | C19 | H26 | 110.6° | 109.5° |
| C19 | C20 | H28 | 109.4° | 109.5° |
| C19 | C20 | H27 | 109.4° | 109.5° |
| C20 | C19 | H26 | 108.7° | 109.5° |
| C12 | C13 | O5 | 110.3° | 109.4° |
| C12 | C13 | C14 | 112.2° | 109.5° |
| C12 | C13 | H18 | 108.3° | 109.5° |
| C13 | C12 | H17 | 106.5° | 109.6° |
| O28 | C10 | C9 | 108.7° | 109.5° |
| O28 | C10 | H15 | 111.4° | 109.5° |
| C10 | O28 | H65 | 109.5° | 114.0° |
| C10 | C9 | O5 | 106.9° | 109.4° |
| C10 | C9 | O4 | 111.7° | 109.5° |
| C9 | C10 | H15 | 108.7° | 109.5° |
| C10 | C9 | H14 | 107.6° | 109.5° |
| O5 | C13 | C14 | 108.0° | 109.5° |
| C13 | O5 | C9 | 116.0° | 114.1° |
| O5 | C13 | H18 | 110.2° | 109.5° |
| C13 | C14 | O6 | 111.2° | 109.5° |
| C14 | C13 | H18 | 107.9° | 109.4° |
| C13 | C14 | H20 | 109.0° | 109.5° |
| C13 | C14 | H19 | 109.0° | 109.5° |
| O5 | C9 | O4 | 110.9° | 109.5° |
| O5 | C9 | H14 | 110.2° | 109.5° |
| C9 | O4 | C6 | 115.1° | 114.0° |
| O4 | C9 | H14 | 109.4° | 109.4° |
| O6 | C14 | H20 | 109.1° | 109.5° |
| O6 | C14 | H19 | 109.0° | 109.4° |
| C14 | O6 | H21 | 109.5° | 114.0° |
| O4 | C6 | C7 | 107.7° | 109.5° |
| O4 | C6 | C5 | 113.6° | 109.5° |
| O4 | C6 | H9 | 109.8° | 109.6° |
| O3 | C8 | C7 | 109.6° | 109.5° |
| O3 | C8 | H11 | 109.4° | 109.4° |
| O3 | C8 | H12 | 109.4° | 109.4° |
| C8 | O3 | H13 | 109.5° | 114.1° |
| C7 | C6 | C5 | 108.6° | 109.2° |
| C6 | C7 | C8 | 110.6° | 109.5° |
| C6 | C7 | O2 | 110.7° | 109.4° |
| C7 | C6 | H9 | 108.6° | 109.5° |
| C6 | C7 | H10 | 108.4° | 109.5° |
| C6 | C5 | O29 | 113.4° | 109.6° |
| C6 | C5 | C4 | 108.8° | 109.0° |
| C6 | C5 | H8 | 108.1° | 109.5° |
| C5 | C6 | H9 | 108.5° | 109.5° |
| C8 | C7 | O2 | 108.8° | 109.5° |
| C8 | C7 | H10 | 108.3° | 109.5° |
| C7 | C8 | H11 | 109.5° | 109.5° |
| C7 | C8 | H12 | 109.4° | 109.5° |
| O29 | C5 | C4 | 108.6° | 109.6° |
| O29 | C5 | H8 | 109.9° | 109.5° |
| C5 | O29 | H66 | 109.5° | 114.0° |
| C7 | O2 | C3 | 123.4° | 114.1° |
| O2 | C7 | H10 | 110.0° | 109.5° |
| C5 | C4 | O30 | 109.8° | 109.5° |
| C5 | C4 | C3 | 108.0° | 109.2° |
| C5 | C4 | H7 | 109.0° | 109.6° |
| C4 | C5 | H8 | 108.0° | 109.6° |
| O30 | C4 | C3 | 109.8° | 109.5° |
| O30 | C4 | H7 | 111.0° | 109.6° |
| C4 | O30 | H67 | 109.5° | 114.0° |
| C4 | C3 | O2 | 108.8° | 109.4° |
| C4 | C3 | O1 | 108.6° | 109.5° |
| C3 | C4 | H7 | 109.2° | 109.5° |
| C4 | C3 | H6 | 109.0° | 109.5° |
| O2 | C3 | O1 | 109.0° | 109.5° |
| O2 | C3 | H6 | 110.9° | 109.5° |
| C3 | O1 | C2 | 119.3° | 113.9° |
| O1 | C3 | H6 | 110.4° | 109.5° |
| O1 | C2 | C1 | 108.6° | 109.4° |
| O1 | C2 | H4 | 109.7° | 109.5° |
| O1 | C2 | H5 | 109.7° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C1 | C2 | H4 | 109.7° | 109.5° |
| C1 | C2 | H5 | 109.7° | 109.5° |
| C2 | C1 | N4 | 37.8° | 109.5° |
| C2 | C1 | C43 | 37.8° | 109.5° |
| H68 | N3 | H62 | 109.5° | 111.0° |
| H11 | C8 | H12 | 109.5° | 109.5° |
| H28 | C20 | H27 | 109.5° | 109.5° |
| H35 | C22 | H33 | 109.5° | 109.5° |
| H35 | C22 | H34 | 109.5° | 109.5° |
| H33 | C22 | H34 | 109.5° | 109.5° |
| H36 | C24 | H37 | 109.5° | 109.5° |
| H3 | C1 | N4 | 122.5° | 109.5° |
| H3 | C1 | C43 | 122.5° | 109.4° |
| H20 | C14 | H19 | 109.5° | 109.4° |
| H4 | C2 | H5 | 109.5° | 109.5° |
| H43 | C30 | H44 | 109.5° | 109.5° |
| H46 | C32 | H45 | 109.5° | 109.5° |
| H53 | C38 | H52 | 109.5° | 109.5° |
| H69 | N2 | H57 | 109.4° | 111.0° |
| N4 | C1 | C43 | 0.0° | 109.5° |
| C1 | N4 | C41 | 90.0° | 120.0° |
| C1 | N4 | H1 | 90.0° | 120.0° |
| C1 | C43 | C60 | 90.0° | 109.5° |
| C1 | C43 | O32 | 90.0° | 109.4° |
| C1 | C43 | H2 | 90.0° | 109.5° |
| N4 | C41 | O31 | 90.0° | 120.0° |
| N4 | C41 | C44 | 90.0° | 120.0° |
| C41 | N4 | H1 | 90.0° | 120.0° |
| O31 | C41 | C44 | 90.0° | 120.0° |
| C41 | C44 | C42 | 90.0° | 109.5° |
| C41 | C44 | H58 | 90.0° | 109.5° |
| C41 | C44 | H63 | 90.0° | 109.5° |
| C44 | C42 | C45 | 90.0° | 109.5° |
| C42 | C44 | H58 | 90.0° | 109.5° |
| C42 | C44 | H63 | 90.0° | 109.4° |
| C44 | C42 | H72 | 90.0° | 109.5° |
| C44 | C42 | H73 | 90.0° | 109.4° |
| C42 | C45 | C46 | 90.0° | 109.4° |
| C45 | C42 | H72 | 90.0° | 109.5° |
| C45 | C42 | H73 | 90.0° | 109.5° |
| C42 | C45 | H74 | 90.0° | 109.5° |
| C42 | C45 | H75 | 90.0° | 109.5° |
| C45 | C46 | C47 | 90.0° | 109.4° |
| C46 | C45 | H74 | 90.0° | 109.5° |
| C46 | C45 | H75 | 90.0° | 109.5° |
| C45 | C46 | H76 | 90.0° | 109.5° |
| C45 | C46 | H77 | 90.0° | 109.5° |
| C46 | C47 | C48 | 90.0° | 109.5° |
| C47 | C46 | H76 | 90.0° | 109.5° |
| C47 | C46 | H77 | 90.0° | 109.4° |
| C46 | C47 | H78 | 90.0° | 109.5° |
| C46 | C47 | H79 | 90.0° | 109.5° |
| C47 | C48 | C49 | 90.0° | 109.5° |
| C48 | C47 | H78 | 90.0° | 109.5° |
| C48 | C47 | H79 | 90.0° | 109.4° |
| C47 | C48 | H80 | 90.0° | 109.5° |
| C47 | C48 | H81 | 90.0° | 109.5° |
| C48 | C49 | C51 | 90.0° | 109.5° |
| C49 | C48 | H80 | 90.0° | 109.5° |
| C49 | C48 | H81 | 90.0° | 109.4° |
| C48 | C49 | H82 | 90.0° | 109.5° |
| C48 | C49 | H83 | 90.0° | 109.5° |
| C49 | C51 | C52 | 90.0° | 109.5° |
| C51 | C49 | H82 | 90.0° | 109.5° |
| C51 | C49 | H83 | 90.0° | 109.4° |
| C49 | C51 | H84 | 90.0° | 109.5° |
| C49 | C51 | H85 | 90.0° | 109.5° |
| C51 | C52 | C53 | 90.0° | 109.5° |
| C52 | C51 | H84 | 90.0° | 109.4° |
| C52 | C51 | H85 | 90.0° | 109.4° |
| C51 | C52 | H86 | 90.0° | 109.5° |
| C51 | C52 | H87 | 90.0° | 109.5° |
| C52 | C53 | C54 | 90.0° | 109.5° |
| C53 | C52 | H86 | 90.0° | 109.4° |
| C53 | C52 | H87 | 90.0° | 109.5° |
| C52 | C53 | H88 | 90.0° | 109.4° |
| C52 | C53 | H89 | 90.0° | 109.5° |
| C53 | C54 | C55 | 90.0° | 109.5° |
| C54 | C53 | H88 | 90.0° | 109.5° |
| C54 | C53 | H89 | 90.0° | 109.5° |
| C53 | C54 | H90 | 90.0° | 109.5° |
| C53 | C54 | H91 | 90.0° | 109.5° |
| C54 | C55 | C56 | 90.0° | 109.5° |
| C55 | C54 | H90 | 90.0° | 109.5° |
| C55 | C54 | H91 | 90.0° | 109.5° |
| C54 | C55 | H92 | 90.0° | 109.5° |
| C54 | C55 | H93 | 90.0° | 109.4° |
| C55 | C56 | C50 | 90.0° | 109.4° |
| C56 | C55 | H92 | 90.0° | 109.5° |
| C56 | C55 | H93 | 90.0° | 109.5° |
| C55 | C56 | H94 | 90.0° | 109.5° |
| C55 | C56 | H95 | 90.0° | 109.4° |
| C56 | C50 | C57 | 90.0° | 109.4° |
| C50 | C56 | H94 | 90.0° | 109.5° |
| C50 | C56 | H95 | 90.0° | 109.5° |
| C56 | C50 | H96 | 90.0° | 109.5° |
| C56 | C50 | H97 | 90.0° | 109.5° |
| C50 | C57 | C58 | 90.0° | 109.5° |
| C57 | C50 | H96 | 90.0° | 109.5° |
| C57 | C50 | H97 | 90.0° | 109.5° |
| C50 | C57 | H98 | 90.0° | 109.5° |
| C50 | C57 | H99 | 90.0° | 109.5° |
| C57 | C58 | C59 | 90.0° | 109.5° |
| C58 | C57 | H98 | 90.0° | 109.5° |
| C58 | C57 | H99 | 90.0° | 109.4° |
| C57 | C58 | H100 | 90.0° | 109.5° |
| C57 | C58 | H101 | 90.0° | 109.4° |
| C59 | C58 | H100 | 90.0° | 109.5° |
| C59 | C58 | H101 | 90.0° | 109.5° |
| C58 | C59 | H102 | 90.0° | 109.5° |
| C58 | C59 | H103 | 90.0° | 109.5° |
| C58 | C59 | H104 | 90.0° | 109.5° |
| C60 | C43 | O32 | 90.0° | 109.5° |
| C43 | C60 | C61 | 90.0° | 120.0° |
| C60 | C43 | H2 | 90.0° | 109.5° |
| C43 | C60 | H105 | 90.0° | 120.0° |
| O32 | C43 | H2 | 90.0° | 109.5° |
| C43 | O32 | H106 | 90.0° | 114.0° |
| C60 | C61 | C62 | 90.0° | 120.0° |
| C61 | C60 | H105 | 90.0° | 120.0° |
| C60 | C61 | H107 | 90.0° | 120.0° |
| C61 | C62 | C63 | 90.0° | 109.5° |
| C62 | C61 | H107 | 90.0° | 120.0° |
| C61 | C62 | H108 | 90.0° | 109.5° |
| C61 | C62 | H109 | 90.0° | 109.5° |
| C62 | C63 | C64 | 90.0° | 109.5° |
| C63 | C62 | H108 | 90.0° | 109.5° |
| C63 | C62 | H109 | 90.0° | 109.4° |
| C62 | C63 | H110 | 90.0° | 109.5° |
| C62 | C63 | H111 | 90.0° | 109.4° |
| C63 | C64 | C65 | 90.0° | 109.5° |
| C64 | C63 | H110 | 90.0° | 109.5° |
| C64 | C63 | H111 | 90.0° | 109.5° |
| C63 | C64 | H113 | 90.0° | 109.5° |
| C63 | C64 | H112 | 90.0° | 109.5° |
| C64 | C65 | C66 | 90.0° | 109.5° |
| C65 | C64 | H113 | 90.0° | 109.5° |
| C65 | C64 | H112 | 90.0° | 109.4° |
| C64 | C65 | H114 | 90.0° | 109.5° |
| C64 | C65 | H115 | 90.0° | 109.4° |
| C65 | C66 | C67 | 90.0° | 109.5° |
| C66 | C65 | H114 | 90.0° | 109.5° |
| C66 | C65 | H115 | 90.0° | 109.5° |
| C65 | C66 | H116 | 90.0° | 109.5° |
| C65 | C66 | H117 | 90.0° | 109.5° |
| C66 | C67 | C68 | 90.0° | 109.5° |
| C67 | C66 | H116 | 90.0° | 109.5° |
| C67 | C66 | H117 | 90.0° | 109.5° |
| C66 | C67 | H118 | 90.0° | 109.5° |
| C66 | C67 | H121 | 90.0° | 109.5° |
| C67 | C68 | C69 | 90.0° | 109.5° |
| C68 | C67 | H118 | 90.0° | 109.5° |
| C68 | C67 | H121 | 90.0° | 109.5° |
| C67 | C68 | H120 | 90.0° | 109.5° |
| C67 | C68 | H119 | 90.0° | 109.4° |
| C68 | C69 | C70 | 90.0° | 109.5° |
| C69 | C68 | H120 | 90.0° | 109.5° |
| C69 | C68 | H119 | 90.0° | 109.5° |
| C68 | C69 | H123 | 90.0° | 109.5° |
| C68 | C69 | H122 | 90.0° | 109.5° |
| C69 | C70 | C71 | 90.0° | 109.5° |
| C70 | C69 | H123 | 90.0° | 109.5° |
| C70 | C69 | H122 | 90.0° | 109.5° |
| C69 | C70 | H124 | 90.0° | 109.5° |
| C69 | C70 | H125 | 90.0° | 109.4° |
| C70 | C71 | C72 | 90.0° | 109.5° |
| C71 | C70 | H124 | 90.0° | 109.5° |
| C71 | C70 | H125 | 90.0° | 109.5° |
| C70 | C71 | H127 | 90.0° | 109.5° |
| C70 | C71 | H126 | 90.0° | 109.5° |
| C71 | C72 | C73 | 90.0° | 109.5° |
| C72 | C71 | H127 | 90.0° | 109.5° |
| C72 | C71 | H126 | 90.0° | 109.5° |
| C71 | C72 | H128 | 90.0° | 109.5° |
| C71 | C72 | H129 | 90.0° | 109.5° |
| C72 | C73 | C74 | 90.0° | 109.4° |
| C73 | C72 | H128 | 90.0° | 109.5° |
| C73 | C72 | H129 | 90.0° | 109.5° |
| C72 | C73 | H130 | 90.0° | 109.4° |
| C72 | C73 | H131 | 90.0° | 109.5° |
| C74 | C73 | H130 | 90.0° | 109.5° |
| C74 | C73 | H131 | 90.0° | 109.5° |
| C73 | C74 | H132 | 90.0° | 109.4° |
| C73 | C74 | H134 | 90.0° | 109.5° |
| C73 | C74 | H133 | 90.0° | 109.5° |
| H58 | C44 | H63 | 90.0° | 109.5° |
| H72 | C42 | H73 | 90.0° | 109.5° |
| H74 | C45 | H75 | 90.0° | 109.5° |
| H76 | C46 | H77 | 90.0° | 109.5° |
| H78 | C47 | H79 | 90.0° | 109.5° |
| H80 | C48 | H81 | 90.0° | 109.5° |
| H82 | C49 | H83 | 90.0° | 109.4° |
| H84 | C51 | H85 | 90.0° | 109.5° |
| H86 | C52 | H87 | 90.0° | 109.4° |
| H88 | C53 | H89 | 90.0° | 109.5° |
| H90 | C54 | H91 | 90.0° | 109.4° |
| H92 | C55 | H93 | 90.0° | 109.4° |
| H94 | C56 | H95 | 90.0° | 109.5° |
| H96 | C50 | H97 | 90.0° | 109.5° |
| H98 | C57 | H99 | 90.0° | 109.5° |
| H100 | C58 | H101 | 90.0° | 109.4° |
| H102 | C59 | H103 | 90.0° | 109.5° |
| H102 | C59 | H104 | 90.0° | 109.5° |
| H103 | C59 | H104 | 90.0° | 109.4° |
| H108 | C62 | H109 | 90.0° | 109.5° |
| H110 | C63 | H111 | 90.0° | 109.5° |
| H113 | C64 | H112 | 90.0° | 109.5° |
| H114 | C65 | H115 | 90.0° | 109.5° |
| H116 | C66 | H117 | 90.0° | 109.5° |
| H118 | C67 | H121 | 90.0° | 109.4° |
| H120 | C68 | H119 | 90.0° | 109.4° |
| H123 | C69 | H122 | 90.0° | 109.4° |
| H124 | C70 | H125 | 90.0° | 109.5° |
| H127 | C71 | H126 | 90.0° | 109.5° |
| H128 | C72 | H129 | 90.0° | 109.5° |
| H130 | C73 | H131 | 90.0° | 109.5° |
| H132 | C74 | H134 | 90.0° | 109.4° |
| H132 | C74 | H133 | 90.0° | 109.5° |
| H134 | C74 | H133 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O17 | C38 | C37 | H53 | 119.9° | 120.0° |
| O17 | C38 | C37 | H52 | 119.9° | 120.0° |
| O17 | C38 | C37 | C36 | 165.3° | 175.0° |
| O17 | C38 | C37 | O18 | 41.5° | 65.0° |
| O17 | C38 | C37 | H51 | 76.5° | 55.0° |
| O17 | C38 | H53 | H52 | 120.4° | 120.0° |
| C38 | C37 | C36 | O19 | 5.3° | 55.0° |
| C38 | C37 | C36 | O18 | 121.4° | 120.0° |
| C38 | C37 | C36 | H51 | 118.3° | 120.0° |
| C38 | C37 | O18 | H51 | 116.9° | 120.0° |
| C38 | C37 | C36 | C35 | 127.6° | 175.0° |
| C38 | C37 | C36 | H50 | 114.6° | 65.0° |
| C37 | C38 | H53 | H52 | 120.4° | 120.0° |
| C37 | C38 | O17 | H54 | 180.0° | 180.0° |
| C38 | C37 | O18 | H55 | 180.0° | 60.0° |
| N3 | C26 | C27 | C25 | 123.2° | 119.9° |
| N3 | C26 | C27 | H39 | 120.9° | 120.1° |
| N3 | C26 | C25 | H39 | 117.6° | 120.2° |
| N3 | C26 | C27 | O14 | 180.0° | 62.3° |
| N3 | C26 | C27 | C28 | 58.8° | 57.7° |
| N3 | C26 | C25 | O25 | 49.4° | 56.9° |
| N3 | C26 | C25 | C24 | 169.7° | 62.9° |
| C26 | N3 | H68 | H62 | 120.0° | 123.9° |
| N3 | C26 | C25 | H38 | 71.7° | 177.2° |
| N3 | C26 | C27 | H40 | 60.2° | 177.7° |
| O19 | C36 | C37 | C35 | 122.2° | 120.0° |
| O19 | C36 | C37 | H50 | 120.0° | 120.0° |
| O19 | C36 | C37 | O18 | 116.1° | 65.0° |
| O19 | C36 | C35 | H50 | 118.1° | 120.0° |
| O19 | C36 | C35 | O16 | 69.4° | 173.9° |
| O19 | C36 | C35 | C34 | 52.0° | 66.1° |
| O19 | C36 | C35 | H49 | 171.5° | 53.9° |
| O19 | C36 | C37 | H51 | 123.6° | 175.0° |
| C36 | C37 | O18 | H51 | 119.3° | 119.9° |
| C37 | C36 | C35 | H50 | 117.6° | 120.0° |
| C37 | C36 | C35 | O16 | 166.3° | 53.9° |
| C37 | C36 | C35 | C34 | 72.3° | 173.9° |
| C37 | C36 | C35 | H49 | 47.1° | 66.1° |
| C36 | C37 | C38 | H53 | 74.8° | 65.0° |
| C36 | C37 | C38 | H52 | 45.5° | 55.0° |
| C36 | C37 | O18 | H55 | 56.1° | 60.0° |
| C37 | C36 | O19 | H56 | 180.0° | 60.1° |
| O18 | C37 | C36 | C35 | 6.2° | 55.0° |
| O18 | C37 | C36 | H50 | 124.0° | 175.0° |
| O18 | C37 | C38 | H53 | 161.4° | 55.0° |
| O18 | C37 | C38 | H52 | 78.4° | 175.0° |
| O12 | C21 | C22 | N1 | 179.9° | 180.0° |
| O12 | C21 | N1 | C16 | 0.1° | 0.3° |
| O12 | C21 | N1 | H32 | 179.9° | 180.0° |
| O12 | C21 | C22 | H35 | 0.0° | 180.0° |
| O12 | C21 | C22 | H33 | 120.0° | 60.0° |
| O12 | C21 | C22 | H34 | 120.0° | 60.0° |
| C27 | C26 | C25 | H39 | 116.1° | 119.9° |
| C26 | C27 | O14 | C28 | 124.1° | 120.0° |
| C26 | C27 | O14 | H40 | 118.6° | 120.0° |
| C26 | C27 | C28 | H40 | 119.3° | 120.0° |
| C27 | C26 | C25 | O25 | 76.9° | 176.8° |
| C27 | C26 | C25 | C24 | 43.4° | 56.9° |
| C26 | C27 | O14 | C23 | 16.1° | 61.2° |
| C26 | C27 | C28 | C29 | 147.3° | 65.7° |
| C26 | C27 | C28 | O24 | 92.5° | 174.3° |
| C27 | C26 | N3 | H68 | 180.0° | 174.6° |
| C27 | C26 | N3 | H62 | 60.0° | 61.6° |
| C26 | C27 | C28 | H41 | 28.2° | 54.3° |
| C27 | C26 | C25 | H38 | 162.0° | 62.9° |
| C25 | C26 | C27 | O14 | 56.7° | 57.6° |
| C25 | C26 | C27 | C28 | 64.4° | 177.6° |
| C26 | C25 | O25 | C24 | 121.2° | 119.5° |
| C26 | C25 | O25 | H38 | 119.4° | 120.3° |
| C26 | C25 | C24 | H38 | 118.6° | 119.9° |
| C26 | C25 | C24 | C23 | 7.2° | 57.0° |
| C25 | C26 | N3 | H68 | 57.0° | 54.9° |
| C25 | C26 | N3 | H62 | 177.0° | 178.8° |
| C26 | C25 | C24 | H36 | 128.2° | 62.9° |
| C26 | C25 | C24 | H37 | 113.7° | 176.9° |
| C25 | C26 | C27 | H40 | 176.5° | 62.4° |
| C26 | C25 | O25 | H64 | 180.0° | 180.0° |
| O26 | C40 | O27 | C23 | 179.3° | 179.9° |
| O26 | C40 | C23 | O14 | 116.3° | 115.1° |
| O26 | C40 | C23 | C24 | 3.6° | 125.0° |
| O26 | C40 | C23 | O13 | 120.3° | 5.0° |
| O26 | C40 | O27 | H71 | 0.0° | 0.0° |
| C36 | C35 | O16 | C34 | 122.1° | 120.0° |
| C36 | C35 | O16 | H49 | 118.5° | 120.0° |
| C36 | C35 | C34 | H49 | 119.5° | 120.1° |
| C36 | C35 | O16 | C31 | 178.8° | 178.8° |
| C36 | C35 | C34 | C33 | 119.6° | 177.6° |
| C36 | C35 | C34 | N2 | 120.8° | 62.5° |
| C36 | C35 | C34 | H48 | 0.4° | 57.7° |
| C35 | C36 | C37 | H51 | 114.1° | 65.0° |
| C35 | C36 | O19 | H56 | 56.2° | 60.0° |
| O11 | C17 | C16 | C18 | 120.7° | 119.9° |
| O11 | C17 | C16 | H24 | 120.2° | 120.2° |
| O11 | C17 | C18 | H24 | 119.8° | 120.2° |
| O11 | C17 | C16 | N1 | 98.6° | 63.3° |
| O11 | C17 | C16 | C15 | 143.9° | 176.9° |
| O11 | C17 | C18 | O10 | 59.6° | 63.2° |
| O11 | C17 | C18 | C19 | 178.6° | 176.9° |
| O11 | C17 | C16 | H23 | 22.5° | 56.9° |
| O11 | C17 | C18 | H25 | 61.7° | 56.9° |
| O27 | C40 | C23 | O14 | 63.1° | 65.0° |
| O27 | C40 | C23 | C24 | 177.1° | 54.9° |
| O27 | C40 | C23 | O13 | 60.3° | 175.0° |
| O23 | C29 | C28 | C27 | 67.8° | 65.8° |
| O23 | C29 | C28 | C30 | 118.8° | 120.1° |
| O23 | C29 | C28 | H42 | 121.6° | 119.9° |
| O23 | C29 | C28 | O24 | 172.4° | 174.2° |
| O23 | C29 | C30 | H42 | 120.6° | 120.0° |
| O23 | C29 | C30 | O15 | 85.0° | 65.0° |
| O23 | C29 | C28 | H41 | 51.0° | 54.2° |
| O23 | C29 | C30 | H43 | 154.7° | 175.0° |
| O23 | C29 | C30 | H44 | 35.3° | 55.0° |
| C40 | C23 | O14 | C27 | 84.9° | 58.8° |
| C40 | C23 | C24 | C25 | 75.2° | 62.3° |
| C40 | C23 | O14 | C24 | 120.5° | 120.0° |
| C40 | C23 | O14 | O13 | 119.2° | 120.0° |
| C40 | C23 | C24 | O13 | 115.4° | 120.0° |
| C40 | C23 | O13 | C11 | 103.3° | 67.4° |
| C40 | C23 | C24 | H36 | 45.8° | 177.7° |
| C40 | C23 | C24 | H37 | 163.8° | 57.6° |
| C23 | C40 | O27 | H71 | 179.3° | 180.0° |
| O14 | C27 | C28 | H40 | 118.8° | 120.0° |
| O14 | C27 | C28 | C29 | 90.8° | 174.4° |
| O14 | C27 | C28 | O24 | 29.5° | 54.3° |
| C27 | O14 | C23 | C24 | 35.6° | 61.2° |
| C27 | O14 | C23 | O13 | 155.9° | 178.8° |
| O14 | C27 | C26 | H39 | 59.2° | 177.6° |
| O14 | C27 | C28 | H41 | 150.2° | 65.7° |
| C28 | C27 | O14 | C23 | 107.9° | 178.9° |
| C27 | C28 | C29 | O24 | 119.8° | 120.0° |
| C27 | C28 | C29 | H41 | 118.8° | 120.0° |
| C27 | C28 | O24 | H41 | 119.0° | 120.0° |
| C27 | C28 | C29 | C30 | 173.4° | 174.2° |
| C28 | C27 | C26 | H39 | 179.7° | 62.4° |
| C27 | C28 | C29 | H42 | 53.8° | 54.1° |
| C27 | C28 | O24 | H61 | 180.0° | 60.0° |
| C22 | C21 | N1 | C16 | 180.0° | 179.7° |
| C22 | C21 | N1 | H32 | 0.0° | 0.0° |
| C21 | C22 | H35 | H33 | 120.0° | 120.0° |
| C21 | C22 | H35 | H34 | 120.0° | 120.0° |
| C21 | C22 | H33 | H34 | 120.0° | 120.0° |
| C21 | N1 | C16 | C17 | 116.4° | 155.3° |
| C21 | N1 | C16 | H32 | 180.0° | 179.7° |
| C21 | N1 | C16 | C15 | 123.8° | 85.0° |
| N1 | C21 | C22 | H35 | 179.9° | 0.0° |
| N1 | C21 | C22 | H33 | 60.1° | 120.0° |
| N1 | C21 | C22 | H34 | 59.9° | 120.0° |
| C21 | N1 | C16 | H23 | 3.9° | 35.1° |
| O25 | C25 | C24 | H38 | 121.1° | 120.3° |
| O25 | C25 | C24 | C23 | 127.5° | 176.9° |
| O25 | C25 | C24 | H36 | 111.5° | 57.0° |
| O25 | C25 | C24 | H37 | 6.6° | 63.2° |
| O25 | C25 | C26 | H39 | 167.0° | 63.3° |
| C25 | C24 | C23 | O14 | 46.1° | 57.6° |
| C25 | C24 | C23 | H36 | 121.0° | 119.9° |
| C25 | C24 | C23 | H37 | 121.0° | 119.9° |
| C25 | C24 | C23 | O13 | 169.4° | 177.6° |
| C25 | C24 | H36 | H37 | 117.0° | 120.2° |
| C24 | C25 | C26 | H39 | 72.7° | 176.9° |
| C24 | C25 | O25 | H64 | 58.8° | 60.4° |
| C16 | C17 | C18 | H24 | 119.0° | 119.9° |
| C17 | C16 | N1 | C15 | 119.8° | 119.7° |
| C17 | C16 | N1 | H23 | 120.3° | 120.2° |
| C17 | C16 | C15 | H23 | 121.3° | 119.9° |
| C16 | C17 | C18 | O10 | 179.2° | 176.9° |
| C16 | C17 | C18 | C19 | 60.1° | 57.0° |
| C17 | C16 | C15 | O7 | 155.1° | 62.3° |
| C17 | C16 | C15 | O8 | 34.8° | 57.6° |
| C17 | C16 | N1 | H32 | 63.5° | 25.0° |
| C17 | C16 | C15 | H22 | 84.7° | 177.6° |
| C16 | C17 | C18 | H25 | 59.5° | 62.9° |
| C16 | C17 | O11 | H31 | 180.0° | 180.0° |
| C18 | C17 | C16 | N1 | 140.7° | 176.9° |
| C18 | C17 | C16 | C15 | 23.2° | 57.0° |
| C17 | C18 | O10 | C19 | 119.7° | 119.7° |
| C17 | C18 | O10 | H25 | 120.3° | 120.1° |
| C17 | C18 | C19 | H25 | 119.5° | 119.8° |
| C17 | C18 | C19 | O8 | 33.5° | 57.6° |
| C17 | C18 | C19 | C20 | 153.7° | 177.6° |
| C18 | C17 | C16 | H23 | 98.2° | 63.0° |
| C17 | C18 | C19 | H26 | 87.1° | 62.4° |
| C17 | C18 | O10 | H30 | 180.0° | 180.0° |
| C18 | C17 | O11 | H31 | 57.7° | 60.4° |
| O14 | C23 | C24 | O13 | 123.3° | 120.0° |
| O14 | C23 | O13 | C11 | 18.6° | 52.6° |
| O14 | C23 | C24 | H36 | 167.1° | 62.3° |
| O14 | C23 | C24 | H37 | 74.9° | 177.6° |
| C23 | O14 | C27 | H40 | 134.8° | 58.9° |
| O16 | C35 | C34 | H49 | 120.1° | 119.9° |
| O16 | C35 | C34 | C33 | 0.8° | 57.6° |
| O16 | C35 | C34 | N2 | 118.7° | 177.5° |
| C35 | O16 | C31 | C39 | 173.2° | 178.9° |
| C35 | O16 | C31 | O15 | 62.6° | 58.8° |
| C35 | O16 | C31 | C32 | 57.2° | 61.2° |
| O16 | C35 | C34 | H48 | 120.9° | 62.3° |
| O16 | C35 | C36 | H50 | 48.7° | 66.1° |
| C34 | C35 | O16 | C31 | 59.1° | 61.1° |
| C35 | C34 | C33 | O20 | 66.9° | 176.9° |
| C35 | C34 | C33 | N2 | 119.1° | 120.0° |
| C35 | C34 | C33 | H48 | 120.0° | 120.0° |
| C35 | C34 | N2 | H48 | 119.8° | 120.2° |
| C35 | C34 | C33 | C32 | 53.5° | 57.0° |
| C35 | C34 | C33 | H47 | 172.5° | 62.9° |
| C34 | C35 | C36 | H50 | 170.1° | 53.9° |
| C35 | C34 | N2 | H69 | 180.0° | 169.6° |
| C35 | C34 | N2 | H57 | 60.0° | 66.4° |
| N1 | C16 | C15 | H23 | 120.8° | 120.2° |
| N1 | C16 | C15 | O7 | 37.3° | 57.6° |
| N1 | C16 | C15 | O8 | 83.0° | 177.5° |
| N1 | C16 | C15 | H22 | 157.5° | 62.5° |
| N1 | C16 | C17 | H24 | 21.5° | 57.0° |
| C16 | C15 | O7 | O8 | 115.6° | 119.9° |
| C16 | C15 | O7 | H22 | 119.0° | 120.1° |
| C16 | C15 | O8 | H22 | 118.1° | 120.0° |
| C16 | C15 | O7 | C12 | 174.2° | 169.3° |
| C16 | C15 | O8 | C19 | 70.6° | 61.2° |
| C15 | C16 | N1 | H32 | 56.2° | 94.7° |
| C15 | C16 | C17 | H24 | 96.0° | 62.9° |
| O16 | C31 | C39 | O22 | 2.0° | 117.1° |
| O16 | C31 | O15 | C30 | 68.4° | 53.5° |
| O16 | C31 | C39 | O15 | 122.4° | 120.1° |
| O16 | C31 | C39 | C32 | 117.1° | 119.9° |
| O16 | C31 | O15 | C32 | 118.4° | 120.0° |
| O16 | C31 | C39 | O21 | 178.7° | 62.9° |
| O16 | C31 | C32 | C33 | 2.7° | 57.6° |
| O16 | C31 | C32 | H46 | 117.8° | 177.5° |
| O16 | C31 | C32 | H45 | 123.3° | 62.4° |
| C31 | O16 | C35 | H49 | 60.3° | 58.8° |
| C29 | C28 | O24 | H41 | 120.0° | 120.0° |
| C28 | C29 | C30 | H42 | 119.8° | 120.0° |
| C28 | C29 | C30 | O15 | 155.4° | 175.0° |
| C29 | C28 | C27 | H40 | 28.0° | 54.3° |
| C28 | C29 | C30 | H43 | 35.1° | 55.0° |
| C28 | C29 | C30 | H44 | 84.3° | 65.0° |
| C28 | C29 | O23 | H60 | 180.0° | 60.1° |
| C29 | C28 | O24 | H61 | 59.0° | 60.0° |
| O24 | C28 | C29 | C30 | 53.6° | 54.1° |
| O24 | C28 | C27 | H40 | 148.3° | 65.7° |
| O24 | C28 | C29 | H42 | 66.0° | 65.9° |
| C24 | C23 | O13 | C11 | 139.0° | 172.5° |
| C23 | C24 | H36 | H37 | 116.9° | 120.1° |
| C23 | C24 | C25 | H38 | 111.4° | 62.8° |
| C23 | O13 | C11 | C12 | 143.7° | 140.8° |
| C23 | O13 | C11 | C10 | 97.7° | 99.7° |
| O13 | C23 | C24 | H36 | 69.6° | 57.7° |
| O13 | C23 | C24 | H37 | 48.5° | 62.4° |
| C23 | O13 | C11 | H16 | 21.6° | 20.6° |
| C29 | C30 | O15 | H43 | 120.3° | 120.0° |
| C29 | C30 | O15 | H44 | 120.3° | 120.0° |
| C29 | C30 | O15 | C31 | 95.7° | 176.0° |
| C30 | C29 | C28 | H41 | 67.8° | 65.9° |
| C29 | C30 | H43 | H44 | 119.1° | 120.0° |
| C30 | C29 | O23 | H60 | 59.2° | 60.0° |
| O22 | C39 | C31 | O21 | 179.3° | 180.0° |
| O22 | C39 | C31 | O15 | 120.3° | 3.0° |
| O22 | C39 | C31 | C32 | 119.1° | 123.0° |
| O22 | C39 | O21 | H70 | 0.0° | 0.0° |
| O20 | C33 | C34 | C32 | 120.4° | 119.9° |
| O20 | C33 | C34 | H47 | 120.6° | 120.2° |
| O20 | C33 | C34 | N2 | 174.0° | 63.1° |
| O20 | C33 | C32 | C31 | 63.2° | 176.9° |
| O20 | C33 | C32 | H47 | 121.5° | 120.1° |
| O20 | C33 | C32 | H46 | 176.2° | 63.1° |
| O20 | C33 | C32 | H45 | 57.3° | 57.0° |
| O20 | C33 | C34 | H48 | 53.1° | 56.9° |
| O10 | C18 | C19 | H25 | 121.0° | 120.2° |
| O10 | C18 | C19 | O8 | 153.0° | 177.5° |
| O10 | C18 | C19 | C20 | 86.8° | 62.5° |
| O10 | C18 | C17 | H24 | 60.2° | 57.0° |
| O10 | C18 | C19 | H26 | 32.4° | 57.5° |
| C18 | C19 | O8 | C15 | 33.3° | 61.2° |
| C18 | C19 | C20 | O9 | 35.3° | 175.0° |
| C18 | C19 | O8 | C20 | 120.5° | 119.9° |
| C18 | C19 | O8 | H26 | 119.6° | 120.0° |
| C18 | C19 | C20 | H26 | 119.4° | 120.0° |
| C19 | C18 | C17 | H24 | 58.9° | 62.9° |
| C18 | C19 | C20 | H28 | 155.3° | 55.0° |
| C18 | C19 | C20 | H27 | 84.8° | 65.0° |
| C19 | C18 | O10 | H30 | 60.3° | 60.3° |
| C33 | C34 | N2 | H48 | 120.5° | 120.1° |
| C34 | C33 | C32 | C31 | 56.3° | 57.0° |
| C34 | C33 | C32 | H47 | 119.0° | 119.9° |
| C34 | C33 | C32 | H46 | 64.2° | 176.9° |
| C34 | C33 | C32 | H45 | 176.9° | 62.9° |
| C33 | C34 | C35 | H49 | 120.9° | 62.4° |
| C33 | C34 | N2 | H69 | 60.3° | 49.9° |
| C33 | C34 | N2 | H57 | 179.7° | 173.9° |
| C34 | C33 | O20 | H59 | 180.0° | 179.6° |
| N2 | C34 | C33 | C32 | 65.5° | 176.9° |
| N2 | C34 | C33 | H47 | 53.4° | 57.0° |
| N2 | C34 | C35 | H49 | 1.3° | 57.6° |
| C34 | N2 | H69 | H57 | 120.0° | 124.0° |
| O7 | C15 | O8 | H22 | 125.2° | 120.0° |
| C15 | O7 | C12 | C11 | 88.3° | 147.6° |
| O7 | C15 | O8 | C19 | 172.6° | 58.8° |
| C15 | O7 | C12 | C13 | 36.6° | 92.7° |
| C15 | O7 | C12 | H17 | 154.8° | 27.4° |
| O7 | C15 | C16 | H23 | 83.6° | 177.7° |
| O8 | C15 | O7 | C12 | 70.2° | 70.8° |
| C15 | O8 | C19 | C20 | 87.2° | 178.9° |
| O8 | C15 | C16 | H23 | 156.2° | 62.3° |
| C15 | O8 | C19 | H26 | 153.0° | 58.8° |
| C30 | O15 | C31 | C39 | 55.0° | 66.5° |
| C30 | O15 | C31 | C32 | 173.2° | 173.5° |
| O15 | C30 | C29 | H42 | 35.7° | 55.0° |
| O15 | C30 | H43 | H44 | 119.1° | 120.0° |
| C39 | C31 | O15 | C32 | 118.3° | 120.0° |
| C39 | C31 | C32 | C33 | 116.2° | 177.6° |
| C39 | C31 | C32 | H46 | 123.2° | 62.5° |
| C39 | C31 | C32 | H45 | 4.3° | 57.6° |
| C31 | C39 | O21 | H70 | 179.3° | 180.0° |
| O15 | C31 | C39 | O21 | 59.0° | 177.0° |
| O15 | C31 | C32 | C33 | 121.9° | 62.4° |
| C31 | O15 | C30 | H43 | 144.0° | 64.0° |
| C31 | O15 | C30 | H44 | 24.6° | 56.0° |
| O15 | C31 | C32 | H46 | 1.3° | 57.5° |
| O15 | C31 | C32 | H45 | 117.6° | 177.6° |
| C32 | C31 | C39 | O21 | 61.6° | 57.0° |
| C31 | C32 | C33 | H46 | 120.5° | 119.9° |
| C31 | C32 | C33 | H45 | 120.5° | 119.9° |
| C31 | C32 | H46 | H45 | 118.3° | 120.1° |
| C31 | C32 | C33 | H47 | 175.3° | 62.9° |
| C33 | C32 | H46 | H45 | 118.3° | 120.2° |
| C32 | C33 | C34 | H48 | 173.5° | 63.0° |
| C32 | C33 | O20 | H59 | 60.4° | 60.0° |
| O13 | C11 | C12 | O7 | 73.4° | 57.0° |
| O13 | C11 | C12 | C10 | 118.6° | 119.8° |
| O13 | C11 | C12 | H16 | 123.1° | 120.3° |
| O13 | C11 | C10 | H16 | 120.5° | 120.3° |
| O13 | C11 | C12 | C13 | 55.0° | 62.9° |
| O13 | C11 | C10 | O28 | 22.0° | 57.1° |
| O13 | C11 | C10 | C9 | 97.1° | 62.9° |
| O13 | C11 | C10 | H15 | 144.2° | 177.2° |
| O13 | C11 | C12 | H17 | 169.1° | 177.2° |
| O7 | C12 | C11 | C13 | 128.4° | 119.9° |
| O7 | C12 | C11 | H17 | 117.5° | 120.1° |
| O7 | C12 | C11 | C10 | 168.0° | 176.9° |
| O7 | C12 | C13 | H17 | 118.8° | 120.2° |
| O7 | C12 | C13 | O5 | 165.0° | 177.5° |
| O7 | C12 | C13 | C14 | 74.6° | 62.5° |
| O7 | C12 | C13 | H18 | 44.4° | 57.5° |
| C12 | O7 | C15 | H22 | 55.1° | 49.3° |
| O7 | C12 | C11 | H16 | 49.7° | 63.2° |
| O9 | C20 | C19 | O8 | 154.9° | 65.1° |
| O9 | C20 | C19 | H28 | 120.0° | 120.0° |
| O9 | C20 | C19 | H27 | 120.0° | 120.0° |
| O9 | C20 | H28 | H27 | 119.9° | 120.0° |
| O9 | C20 | C19 | H26 | 84.1° | 55.0° |
| C12 | C11 | C10 | H16 | 118.4° | 119.8° |
| C11 | C12 | C13 | H17 | 113.9° | 119.9° |
| C12 | C11 | C10 | O28 | 143.2° | 176.9° |
| C12 | C11 | C10 | C9 | 24.0° | 57.0° |
| C11 | C12 | C13 | O5 | 37.7° | 57.6° |
| C11 | C12 | C13 | C14 | 158.1° | 177.6° |
| C12 | C11 | C10 | H15 | 94.7° | 63.0° |
| C11 | C12 | C13 | H18 | 82.9° | 62.4° |
| C10 | C11 | C12 | C13 | 63.6° | 57.0° |
| C11 | C10 | O28 | C9 | 119.6° | 119.7° |
| C11 | C10 | O28 | H15 | 120.6° | 120.1° |
| C11 | C10 | C9 | H15 | 118.8° | 119.9° |
| C11 | C10 | C9 | O5 | 38.9° | 57.6° |
| C11 | C10 | C9 | O4 | 160.5° | 62.4° |
| C10 | C11 | C12 | H17 | 50.5° | 63.0° |
| C11 | C10 | C9 | H14 | 79.5° | 177.6° |
| C11 | C10 | O28 | H65 | 180.0° | 179.7° |
| O8 | C19 | C20 | H26 | 121.0° | 120.1° |
| C19 | O8 | C15 | H22 | 47.5° | 178.8° |
| O8 | C19 | C20 | H28 | 85.1° | 174.9° |
| O8 | C19 | C20 | H27 | 34.9° | 54.9° |
| O8 | C19 | C18 | H25 | 86.0° | 62.2° |
| C19 | C20 | H28 | H27 | 119.9° | 120.0° |
| C20 | C19 | C18 | H25 | 34.1° | 57.7° |
| C19 | C20 | O9 | H29 | 180.0° | 180.0° |
| C12 | C13 | O5 | C14 | 122.9° | 120.0° |
| C12 | C13 | O5 | H18 | 119.4° | 120.0° |
| C12 | C13 | C14 | H18 | 119.2° | 120.0° |
| C12 | C13 | O5 | C9 | 32.1° | 61.1° |
| C12 | C13 | C14 | O6 | 25.9° | 178.3° |
| C13 | C12 | C11 | H16 | 178.1° | 176.8° |
| C12 | C13 | C14 | H20 | 94.4° | 61.7° |
| C12 | C13 | C14 | H19 | 146.1° | 58.3° |
| O28 | C10 | C9 | H15 | 121.4° | 120.1° |
| O28 | C10 | C9 | O5 | 80.9° | 177.6° |
| O28 | C10 | C9 | O4 | 40.7° | 57.6° |
| O28 | C10 | C11 | H16 | 98.5° | 63.3° |
| O28 | C10 | C9 | H14 | 160.7° | 62.4° |
| C10 | C9 | O5 | C13 | 73.8° | 61.1° |
| C10 | C9 | O5 | O4 | 122.1° | 120.0° |
| C10 | C9 | O5 | H14 | 116.6° | 120.1° |
| C10 | C9 | O4 | H14 | 119.0° | 120.0° |
| C10 | C9 | O4 | C6 | 161.3° | 175.0° |
| C9 | C10 | C11 | H16 | 142.4° | 176.8° |
| C9 | C10 | O28 | H65 | 60.4° | 60.0° |
| O5 | C13 | C14 | H18 | 119.1° | 120.0° |
| C13 | O5 | C9 | O4 | 164.1° | 58.8° |
| O5 | C13 | C14 | O6 | 95.8° | 61.8° |
| O5 | C13 | C12 | H17 | 76.2° | 62.3° |
| O5 | C13 | C14 | H20 | 143.9° | 58.2° |
| O5 | C13 | C14 | H19 | 24.5° | 178.2° |
| C13 | O5 | C9 | H14 | 42.8° | 178.8° |
| C14 | C13 | O5 | C9 | 90.8° | 178.9° |
| C13 | C14 | O6 | H20 | 120.3° | 120.1° |
| C13 | C14 | O6 | H19 | 120.2° | 120.0° |
| C14 | C13 | C12 | H17 | 44.2° | 57.7° |
| C13 | C14 | H20 | H19 | 119.2° | 120.0° |
| C13 | C14 | O6 | H21 | 180.0° | 180.0° |
| O5 | C9 | O4 | H14 | 121.8° | 120.0° |
| O5 | C9 | O4 | C6 | 42.1° | 65.1° |
| O5 | C9 | C10 | H15 | 157.7° | 62.3° |
| C9 | O5 | C13 | H18 | 151.5° | 58.9° |
| C9 | O4 | C6 | C7 | 165.4° | 150.0° |
| C9 | O4 | C6 | C5 | 74.3° | 90.3° |
| C9 | O4 | C6 | H9 | 47.4° | 29.8° |
| O4 | C9 | C10 | H15 | 80.7° | 177.7° |
| O6 | C14 | C13 | H18 | 145.1° | 58.2° |
| O6 | C14 | H20 | H19 | 119.2° | 119.9° |
| O4 | C6 | C7 | C5 | 123.4° | 119.9° |
| O4 | C6 | C7 | H9 | 118.8° | 120.2° |
| O4 | C6 | C5 | H9 | 122.4° | 120.2° |
| O4 | C6 | C7 | C8 | 7.5° | 57.7° |
| O4 | C6 | C5 | O29 | 52.4° | 57.0° |
| O4 | C6 | C7 | O2 | 128.2° | 62.3° |
| O4 | C6 | C5 | C4 | 68.5° | 62.9° |
| O4 | C6 | C5 | H8 | 174.5° | 177.2° |
| O4 | C6 | C7 | H10 | 111.1° | 177.7° |
| C6 | O4 | C9 | H14 | 79.7° | 55.0° |
| O3 | C8 | C7 | C6 | 60.6° | 175.0° |
| O3 | C8 | C7 | H11 | 120.0° | 120.0° |
| O3 | C8 | C7 | H12 | 120.0° | 120.0° |
| O3 | C8 | C7 | O2 | 177.6° | 65.1° |
| O3 | C8 | C7 | H10 | 58.0° | 55.0° |
| O3 | C8 | H11 | H12 | 119.9° | 120.0° |
| C7 | C6 | C5 | H9 | 117.9° | 119.9° |
| C6 | C7 | C8 | O2 | 121.8° | 119.9° |
| C6 | C7 | C8 | H10 | 118.6° | 120.0° |
| C7 | C6 | C5 | O29 | 172.2° | 176.9° |
| C6 | C7 | O2 | H10 | 119.7° | 120.0° |
| C7 | C6 | C5 | C4 | 51.2° | 57.0° |
| C6 | C7 | O2 | C3 | 56.3° | 61.2° |
| C7 | C6 | C5 | H8 | 65.8° | 62.9° |
| C6 | C7 | C8 | H11 | 179.4° | 55.0° |
| C6 | C7 | C8 | H12 | 59.4° | 65.0° |
| C5 | C6 | C7 | C8 | 115.9° | 177.6° |
| C6 | C5 | O29 | C4 | 121.0° | 119.6° |
| C6 | C5 | O29 | H8 | 121.1° | 120.2° |
| C5 | C6 | C7 | O2 | 4.8° | 57.6° |
| C6 | C5 | C4 | H8 | 117.1° | 119.9° |
| C6 | C5 | C4 | O30 | 171.8° | 176.9° |
| C6 | C5 | C4 | C3 | 68.5° | 57.0° |
| C6 | C5 | C4 | H7 | 50.0° | 62.9° |
| C5 | C6 | C7 | H10 | 125.5° | 62.4° |
| C6 | C5 | O29 | H66 | 180.0° | 179.6° |
| C8 | C7 | O2 | H10 | 118.5° | 120.0° |
| C8 | C7 | O2 | C3 | 65.4° | 178.9° |
| C8 | C7 | C6 | H9 | 126.3° | 62.5° |
| C7 | C8 | H11 | H12 | 120.0° | 120.0° |
| C7 | C8 | O3 | H13 | 180.0° | 180.0° |
| O29 | C5 | C4 | H8 | 119.1° | 120.2° |
| O29 | C5 | C4 | O30 | 48.0° | 63.2° |
| O29 | C5 | C4 | C3 | 167.7° | 176.9° |
| O29 | C5 | C4 | H7 | 73.8° | 57.0° |
| O29 | C5 | C6 | H9 | 70.0° | 63.2° |
| C7 | O2 | C3 | C4 | 39.0° | 61.2° |
| C7 | O2 | C3 | O1 | 157.3° | 58.8° |
| O2 | C7 | C6 | H9 | 113.0° | 177.5° |
| O2 | C7 | C8 | H11 | 57.6° | 175.0° |
| O2 | C7 | C8 | H12 | 62.4° | 54.9° |
| C7 | O2 | C3 | H6 | 80.9° | 178.8° |
| C5 | C4 | O30 | C3 | 118.6° | 119.6° |
| C5 | C4 | O30 | H7 | 120.6° | 120.2° |
| C5 | C4 | C3 | H7 | 118.3° | 120.0° |
| C5 | C4 | C3 | O2 | 24.1° | 57.7° |
| C5 | C4 | C3 | O1 | 94.5° | 62.3° |
| C4 | C5 | C6 | H9 | 169.1° | 176.9° |
| C5 | C4 | C3 | H6 | 145.2° | 177.7° |
| C4 | C5 | O29 | H66 | 59.0° | 60.0° |
| C5 | C4 | O30 | H67 | 180.0° | 179.7° |
| O30 | C4 | C3 | H7 | 121.9° | 120.2° |
| O30 | C4 | C3 | O2 | 143.9° | 177.5° |
| O30 | C4 | C3 | O1 | 25.3° | 57.5° |
| O30 | C4 | C5 | H8 | 71.1° | 57.0° |
| O30 | C4 | C3 | H6 | 95.1° | 62.5° |
| C4 | C3 | O2 | O1 | 118.3° | 120.0° |
| C4 | C3 | O2 | H6 | 119.8° | 120.0° |
| C4 | C3 | O1 | H6 | 119.5° | 120.0° |
| C4 | C3 | O1 | C2 | 131.2° | 170.0° |
| C3 | C4 | C5 | H8 | 48.6° | 62.9° |
| C3 | C4 | O30 | H67 | 61.4° | 60.0° |
| O2 | C3 | O1 | H6 | 122.1° | 120.0° |
| O2 | C3 | O1 | C2 | 110.4° | 70.0° |
| O2 | C3 | C4 | H7 | 94.2° | 62.3° |
| C3 | O2 | C7 | H10 | 176.0° | 58.9° |
| C3 | O1 | C2 | C1 | 123.4° | 180.0° |
| O1 | C3 | C4 | H7 | 147.2° | 177.7° |
| C3 | O1 | C2 | H4 | 116.8° | 60.0° |
| C3 | O1 | C2 | H5 | 3.6° | 60.0° |
| O1 | C2 | C1 | H4 | 119.8° | 120.0° |
| O1 | C2 | C1 | H5 | 119.9° | 120.0° |
| O1 | C2 | C1 | H3 | 133.7° | 175.0° |
| O1 | C2 | H4 | H5 | 120.4° | 120.0° |
| C2 | O1 | C3 | H6 | 11.7° | 50.0° |
| O1 | C2 | C1 | N4 | 107.9° | 65.0° |
| O1 | C2 | C1 | C43 | 107.9° | 55.0° |
| C2 | C1 | H3 | N4 | 39.8° | 120.0° |
| C2 | C1 | H3 | C43 | 39.8° | 120.0° |
| C1 | C2 | H4 | H5 | 120.4° | 120.0° |
| C2 | C1 | N4 | C43 | 90.0° | 120.0° |
| C2 | C1 | N4 | C41 | 90.0° | 155.0° |
| C2 | C1 | C43 | C60 | 90.0° | 175.0° |
| C2 | C1 | C43 | O32 | 90.0° | 55.0° |
| C2 | C1 | N4 | H1 | 90.0° | 25.0° |
| C2 | C1 | C43 | H2 | 90.0° | 64.9° |
| H32 | N1 | C16 | H23 | 176.2° | 145.2° |
| H68 | N3 | C26 | H39 | 59.7° | 65.3° |
| H62 | N3 | C26 | H39 | 60.3° | 58.6° |
| H7 | C4 | C5 | H8 | 167.1° | 177.2° |
| H7 | C4 | C3 | H6 | 26.8° | 57.6° |
| H7 | C4 | O30 | H67 | 59.4° | 60.1° |
| H8 | C5 | C6 | H9 | 52.1° | 57.0° |
| H8 | C5 | O29 | H66 | 58.9° | 60.2° |
| H9 | C6 | C7 | H10 | 7.7° | 57.5° |
| H10 | C7 | C8 | H11 | 62.0° | 65.0° |
| H10 | C7 | C8 | H12 | 178.1° | 174.9° |
| H11 | C8 | O3 | H13 | 59.9° | 60.0° |
| H12 | C8 | O3 | H13 | 60.0° | 60.0° |
| H15 | C10 | C11 | H16 | 23.7° | 56.9° |
| H15 | C10 | C9 | H14 | 39.3° | 57.7° |
| H15 | C10 | O28 | H65 | 59.4° | 60.1° |
| H18 | C13 | C12 | H17 | 163.2° | 177.7° |
| H18 | C13 | C14 | H20 | 24.8° | 178.3° |
| H18 | C13 | C14 | H19 | 94.7° | 61.8° |
| H22 | C15 | C16 | H23 | 36.6° | 57.7° |
| H24 | C17 | C16 | H23 | 142.7° | 177.2° |
| H24 | C17 | C18 | H25 | 178.5° | 177.2° |
| H24 | C17 | O11 | H31 | 61.0° | 59.8° |
| H28 | C20 | C19 | H26 | 35.9° | 65.0° |
| H28 | C20 | O9 | H29 | 59.9° | 60.0° |
| H27 | C20 | C19 | H26 | 155.9° | 175.0° |
| H27 | C20 | O9 | H29 | 60.0° | 60.0° |
| H35 | C22 | H33 | H34 | 120.0° | 120.1° |
| H36 | C24 | C25 | H38 | 9.6° | 177.2° |
| H37 | C24 | C25 | H38 | 127.7° | 57.1° |
| H39 | C26 | C25 | H38 | 45.9° | 57.0° |
| H39 | C26 | C27 | H40 | 60.7° | 57.6° |
| H41 | C28 | C27 | H40 | 91.1° | 174.3° |
| H41 | C28 | C29 | H42 | 172.6° | 174.1° |
| H41 | C28 | O24 | H61 | 61.0° | 180.0° |
| H3 | C1 | C2 | H4 | 13.9° | 65.0° |
| H3 | C1 | C2 | H5 | 106.4° | 55.0° |
| H3 | C1 | N4 | C43 | 90.0° | 120.0° |
| H3 | C1 | N4 | C41 | 90.0° | 35.0° |
| H3 | C1 | C43 | C60 | 90.0° | 65.0° |
| H3 | C1 | C43 | O32 | 90.0° | 175.0° |
| H3 | C1 | N4 | H1 | 90.0° | 145.0° |
| H3 | C1 | C43 | H2 | 90.0° | 55.0° |
| H16 | C11 | C12 | H17 | 67.8° | 56.9° |
| H20 | C14 | O6 | H21 | 59.7° | 59.9° |
| H19 | C14 | O6 | H21 | 59.8° | 60.0° |
| H25 | C18 | C19 | H26 | 153.3° | 177.8° |
| H25 | C18 | O10 | H30 | 59.7° | 59.9° |
| H4 | C2 | C1 | N4 | 132.2° | 55.0° |
| H4 | C2 | C1 | C43 | 132.2° | 175.0° |
| H5 | C2 | C1 | N4 | 11.9° | 175.0° |
| H5 | C2 | C1 | C43 | 11.9° | 64.9° |
| H38 | C25 | O25 | H64 | 60.6° | 59.8° |
| H42 | C29 | C30 | H43 | 84.7° | 65.0° |
| H42 | C29 | C30 | H44 | 156.0° | 175.0° |
| H42 | C29 | O23 | H60 | 59.8° | 180.0° |
| H46 | C32 | C33 | H47 | 54.7° | 57.0° |
| H45 | C32 | C33 | H47 | 64.2° | 177.2° |
| H47 | C33 | C34 | H48 | 67.5° | 177.1° |
| H47 | C33 | O20 | H59 | 60.3° | 60.1° |
| H48 | C34 | C35 | H49 | 119.0° | 177.7° |
| H48 | C34 | N2 | H69 | 60.1° | 70.2° |
| H48 | C34 | N2 | H57 | 59.8° | 53.8° |
| H49 | C35 | C36 | H50 | 70.5° | 173.9° |
| H50 | C36 | C37 | H51 | 3.6° | 55.1° |
| H50 | C36 | O19 | H56 | 61.0° | 180.0° |
| H51 | C37 | C38 | H53 | 43.4° | 175.0° |
| H51 | C37 | C38 | H52 | 163.7° | 65.0° |
| H51 | C37 | O18 | H55 | 63.2° | 179.9° |
| H53 | C38 | O17 | H54 | 60.1° | 60.0° |
| H52 | C38 | O17 | H54 | 60.1° | 60.0° |
| C1 | N4 | C41 | H1 | 90.0° | 180.0° |
| C1 | N4 | C41 | O31 | 90.0° | 0.1° |
| C1 | N4 | C41 | C44 | 90.0° | 180.0° |
| N4 | C1 | C43 | C60 | 90.0° | 55.0° |
| N4 | C1 | C43 | O32 | 90.0° | 65.0° |
| N4 | C1 | C43 | H2 | 90.0° | 175.0° |
| C43 | C1 | N4 | C41 | 90.0° | 85.0° |
| C1 | C43 | C60 | O32 | 90.0° | 120.0° |
| C1 | C43 | C60 | H2 | 90.0° | 120.0° |
| C1 | C43 | O32 | H2 | 90.0° | 120.0° |
| C1 | C43 | C60 | C61 | 90.0° | 124.9° |
| C43 | C1 | N4 | H1 | 90.0° | 95.1° |
| C1 | C43 | C60 | H105 | 90.0° | 55.0° |
| C1 | C43 | O32 | H106 | 90.0° | 59.9° |
| N4 | C41 | O31 | C44 | 90.0° | 179.9° |
| N4 | C41 | C44 | C42 | 90.0° | 180.0° |
| N4 | C41 | C44 | H58 | 90.0° | 59.9° |
| N4 | C41 | C44 | H63 | 90.0° | 60.1° |
| O31 | C41 | C44 | C42 | 90.0° | 0.1° |
| O31 | C41 | N4 | H1 | 90.0° | 179.9° |
| O31 | C41 | C44 | H58 | 90.0° | 120.0° |
| O31 | C41 | C44 | H63 | 90.0° | 120.0° |
| C41 | C44 | C42 | H58 | 90.0° | 120.1° |
| C41 | C44 | C42 | H63 | 90.0° | 120.0° |
| C41 | C44 | C42 | C45 | 90.0° | 180.0° |
| C44 | C41 | N4 | H1 | 90.0° | 0.0° |
| C41 | C44 | H58 | H63 | 90.0° | 120.0° |
| C41 | C44 | C42 | H72 | 90.0° | 59.9° |
| C41 | C44 | C42 | H73 | 90.0° | 60.0° |
| C44 | C42 | C45 | H72 | 90.0° | 120.0° |
| C44 | C42 | C45 | H73 | 90.0° | 120.0° |
| C44 | C42 | C45 | C46 | 90.0° | 180.0° |
| C42 | C44 | H58 | H63 | 90.0° | 120.0° |
| C44 | C42 | H72 | H73 | 90.0° | 120.0° |
| C44 | C42 | C45 | H74 | 90.0° | 60.0° |
| C44 | C42 | C45 | H75 | 90.0° | 60.0° |
| C42 | C45 | C46 | H74 | 90.0° | 120.0° |
| C42 | C45 | C46 | H75 | 90.0° | 120.0° |
| C42 | C45 | C46 | C47 | 90.0° | 180.0° |
| C45 | C42 | C44 | H58 | 90.0° | 60.0° |
| C45 | C42 | C44 | H63 | 90.0° | 60.0° |
| C45 | C42 | H72 | H73 | 90.0° | 120.0° |
| C42 | C45 | H74 | H75 | 90.0° | 120.0° |
| C42 | C45 | C46 | H76 | 90.0° | 60.0° |
| C42 | C45 | C46 | H77 | 90.0° | 60.0° |
| C45 | C46 | C47 | H76 | 90.0° | 120.0° |
| C45 | C46 | C47 | H77 | 90.0° | 120.0° |
| C45 | C46 | C47 | C48 | 90.0° | 180.0° |
| C46 | C45 | C42 | H72 | 90.0° | 60.0° |
| C46 | C45 | C42 | H73 | 90.0° | 60.0° |
| C46 | C45 | H74 | H75 | 90.0° | 120.0° |
| C45 | C46 | H76 | H77 | 90.0° | 120.1° |
| C45 | C46 | C47 | H78 | 90.0° | 60.0° |
| C45 | C46 | C47 | H79 | 90.0° | 60.0° |
| C46 | C47 | C48 | H78 | 90.0° | 120.0° |
| C46 | C47 | C48 | H79 | 90.0° | 120.0° |
| C46 | C47 | C48 | C49 | 90.0° | 180.0° |
| C47 | C46 | C45 | H74 | 90.0° | 60.0° |
| C47 | C46 | C45 | H75 | 90.0° | 60.0° |
| C47 | C46 | H76 | H77 | 90.0° | 120.0° |
| C46 | C47 | H78 | H79 | 90.0° | 120.1° |
| C46 | C47 | C48 | H80 | 90.0° | 60.0° |
| C46 | C47 | C48 | H81 | 90.0° | 60.0° |
| C47 | C48 | C49 | H80 | 90.0° | 120.1° |
| C47 | C48 | C49 | H81 | 90.0° | 120.0° |
| C47 | C48 | C49 | C51 | 90.0° | 180.0° |
| C48 | C47 | C46 | H76 | 90.0° | 60.0° |
| C48 | C47 | C46 | H77 | 90.0° | 60.0° |
| C48 | C47 | H78 | H79 | 90.0° | 120.0° |
| C47 | C48 | H80 | H81 | 90.0° | 120.0° |
| C47 | C48 | C49 | H82 | 90.0° | 60.0° |
| C47 | C48 | C49 | H83 | 90.0° | 60.0° |
| C48 | C49 | C51 | H82 | 90.0° | 120.1° |
| C48 | C49 | C51 | H83 | 90.0° | 120.0° |
| C48 | C49 | C51 | C52 | 90.0° | 180.0° |
| C49 | C48 | C47 | H78 | 90.0° | 60.0° |
| C49 | C48 | C47 | H79 | 90.0° | 60.0° |
| C49 | C48 | H80 | H81 | 90.0° | 119.9° |
| C48 | C49 | H82 | H83 | 90.0° | 120.0° |
| C48 | C49 | C51 | H84 | 90.0° | 60.0° |
| C48 | C49 | C51 | H85 | 90.0° | 60.1° |
| C49 | C51 | C52 | H84 | 90.0° | 120.0° |
| C49 | C51 | C52 | H85 | 90.0° | 120.0° |
| C49 | C51 | C52 | C53 | 90.0° | 179.9° |
| C51 | C49 | C48 | H80 | 90.0° | 59.9° |
| C51 | C49 | C48 | H81 | 90.0° | 60.0° |
| C51 | C49 | H82 | H83 | 90.0° | 119.9° |
| C49 | C51 | H84 | H85 | 90.0° | 120.0° |
| C49 | C51 | C52 | H86 | 90.0° | 60.0° |
| C49 | C51 | C52 | H87 | 90.0° | 60.0° |
| C51 | C52 | C53 | H86 | 90.0° | 120.0° |
| C51 | C52 | C53 | H87 | 90.0° | 120.1° |
| C51 | C52 | C53 | C54 | 90.0° | 180.0° |
| C52 | C51 | C49 | H82 | 90.0° | 60.0° |
| C52 | C51 | C49 | H83 | 90.0° | 60.0° |
| C52 | C51 | H84 | H85 | 90.0° | 120.0° |
| C51 | C52 | H86 | H87 | 90.0° | 120.0° |
| C51 | C52 | C53 | H88 | 90.0° | 60.0° |
| C51 | C52 | C53 | H89 | 90.0° | 59.9° |
| C52 | C53 | C54 | H88 | 90.0° | 119.9° |
| C52 | C53 | C54 | H89 | 90.0° | 120.1° |
| C52 | C53 | C54 | C55 | 90.0° | 180.0° |
| C53 | C52 | C51 | H84 | 90.0° | 60.1° |
| C53 | C52 | C51 | H85 | 90.0° | 59.9° |
| C53 | C52 | H86 | H87 | 90.0° | 120.0° |
| C52 | C53 | H88 | H89 | 90.0° | 119.9° |
| C52 | C53 | C54 | H90 | 90.0° | 60.0° |
| C52 | C53 | C54 | H91 | 90.0° | 59.9° |
| C53 | C54 | C55 | H90 | 90.0° | 120.0° |
| C53 | C54 | C55 | H91 | 90.0° | 120.1° |
| C53 | C54 | C55 | C56 | 90.0° | 180.0° |
| C54 | C53 | C52 | H86 | 90.0° | 60.0° |
| C54 | C53 | C52 | H87 | 90.0° | 59.9° |
| C54 | C53 | H88 | H89 | 90.0° | 120.1° |
| C53 | C54 | H90 | H91 | 90.0° | 120.0° |
| C53 | C54 | C55 | H92 | 90.0° | 60.0° |
| C53 | C54 | C55 | H93 | 90.0° | 59.9° |
| C54 | C55 | C56 | H92 | 90.0° | 120.0° |
| C54 | C55 | C56 | H93 | 90.0° | 120.0° |
| C54 | C55 | C56 | C50 | 90.0° | 180.0° |
| C55 | C54 | C53 | H88 | 90.0° | 60.1° |
| C55 | C54 | C53 | H89 | 90.0° | 60.0° |
| C55 | C54 | H90 | H91 | 90.0° | 120.0° |
| C54 | C55 | H92 | H93 | 90.0° | 119.9° |
| C54 | C55 | C56 | H94 | 90.0° | 60.0° |
| C54 | C55 | C56 | H95 | 90.0° | 60.0° |
| C55 | C56 | C50 | H94 | 90.0° | 120.0° |
| C55 | C56 | C50 | H95 | 90.0° | 120.0° |
| C55 | C56 | C50 | C57 | 90.0° | 180.0° |
| C56 | C55 | C54 | H90 | 90.0° | 60.0° |
| C56 | C55 | C54 | H91 | 90.0° | 60.0° |
| C56 | C55 | H92 | H93 | 90.0° | 120.0° |
| C55 | C56 | H94 | H95 | 90.0° | 120.0° |
| C55 | C56 | C50 | H96 | 90.0° | 60.0° |
| C55 | C56 | C50 | H97 | 90.0° | 59.9° |
| C56 | C50 | C57 | H96 | 90.0° | 120.0° |
| C56 | C50 | C57 | H97 | 90.0° | 120.0° |
| C56 | C50 | C57 | C58 | 90.0° | 180.0° |
| C50 | C56 | C55 | H92 | 90.0° | 60.0° |
| C50 | C56 | C55 | H93 | 90.0° | 60.0° |
| C50 | C56 | H94 | H95 | 90.0° | 120.1° |
| C56 | C50 | H96 | H97 | 90.0° | 120.0° |
| C56 | C50 | C57 | H98 | 90.0° | 60.0° |
| C56 | C50 | C57 | H99 | 90.0° | 60.0° |
| C50 | C57 | C58 | H98 | 90.0° | 120.0° |
| C50 | C57 | C58 | H99 | 90.0° | 120.0° |
| C50 | C57 | C58 | C59 | 90.0° | 180.0° |
| C57 | C50 | C56 | H94 | 90.0° | 60.0° |
| C57 | C50 | C56 | H95 | 90.0° | 60.0° |
| C57 | C50 | H96 | H97 | 90.0° | 120.1° |
| C50 | C57 | H98 | H99 | 90.0° | 120.0° |
| C50 | C57 | C58 | H100 | 90.0° | 60.0° |
| C50 | C57 | C58 | H101 | 90.0° | 60.0° |
| C57 | C58 | C59 | H100 | 90.0° | 120.1° |
| C57 | C58 | C59 | H101 | 90.0° | 120.0° |
| C58 | C57 | C50 | H96 | 90.0° | 60.0° |
| C58 | C57 | C50 | H97 | 90.0° | 60.0° |
| C58 | C57 | H98 | H99 | 90.0° | 120.0° |
| C57 | C58 | H100 | H101 | 90.0° | 119.9° |
| C57 | C58 | C59 | H102 | 90.0° | 59.9° |
| C57 | C58 | C59 | H103 | 90.0° | 60.1° |
| C57 | C58 | C59 | H104 | 90.0° | 180.0° |
| C59 | C58 | C57 | H98 | 90.0° | 60.0° |
| C59 | C58 | C57 | H99 | 90.0° | 60.0° |
| C59 | C58 | H100 | H101 | 90.0° | 120.0° |
| C58 | C59 | H102 | H103 | 90.0° | 120.0° |
| C58 | C59 | H102 | H104 | 90.0° | 120.0° |
| C58 | C59 | H103 | H104 | 90.0° | 120.0° |
| C60 | C43 | O32 | H2 | 90.0° | 120.0° |
| C43 | C60 | C61 | H105 | 90.0° | 180.0° |
| C43 | C60 | C61 | C62 | 90.0° | 180.0° |
| C60 | C43 | O32 | H106 | 90.0° | 60.0° |
| C43 | C60 | C61 | H107 | 90.0° | 0.0° |
| O32 | C43 | C60 | C61 | 90.0° | 5.0° |
| O32 | C43 | C60 | H105 | 90.0° | 175.0° |
| C60 | C61 | C62 | H107 | 90.0° | 180.0° |
| C60 | C61 | C62 | C63 | 90.0° | 125.0° |
| C61 | C60 | C43 | H2 | 90.0° | 115.0° |
| C60 | C61 | C62 | H108 | 90.0° | 115.0° |
| C60 | C61 | C62 | H109 | 90.0° | 5.0° |
| C61 | C62 | C63 | H108 | 90.0° | 120.0° |
| C61 | C62 | C63 | H109 | 90.0° | 120.0° |
| C61 | C62 | C63 | C64 | 90.0° | 180.0° |
| C62 | C61 | C60 | H105 | 90.0° | 0.0° |
| C61 | C62 | H108 | H109 | 90.0° | 120.0° |
| C61 | C62 | C63 | H110 | 90.0° | 60.0° |
| C61 | C62 | C63 | H111 | 90.0° | 60.0° |
| C62 | C63 | C64 | H110 | 90.0° | 120.0° |
| C62 | C63 | C64 | H111 | 90.0° | 120.0° |
| C62 | C63 | C64 | C65 | 90.0° | NaN° |
| C63 | C62 | C61 | H107 | 90.0° | 55.0° |
| C63 | C62 | H108 | H109 | 90.0° | 120.0° |
| C62 | C63 | H110 | H111 | 90.0° | 120.0° |
| C62 | C63 | C64 | H113 | 90.0° | 60.0° |
| C62 | C63 | C64 | H112 | 90.0° | 60.0° |
| C63 | C64 | C65 | H113 | 90.0° | 120.0° |
| C63 | C64 | C65 | H112 | 90.0° | 120.0° |
| C63 | C64 | C65 | C66 | 90.0° | 179.9° |
| C64 | C63 | C62 | H108 | 90.0° | 59.9° |
| C64 | C63 | C62 | H109 | 90.0° | 60.0° |
| C64 | C63 | H110 | H111 | 90.0° | 120.0° |
| C63 | C64 | H113 | H112 | 90.0° | 120.0° |
| C63 | C64 | C65 | H114 | 90.0° | 59.9° |
| C63 | C64 | C65 | H115 | 90.0° | 60.0° |
| C64 | C65 | C66 | H114 | 90.0° | 120.0° |
| C64 | C65 | C66 | H115 | 90.0° | 120.0° |
| C64 | C65 | C66 | C67 | 90.0° | 180.0° |
| C65 | C64 | C63 | H110 | 90.0° | 60.0° |
| C65 | C64 | C63 | H111 | 90.0° | 60.0° |
| C65 | C64 | H113 | H112 | 90.0° | 120.0° |
| C64 | C65 | H114 | H115 | 90.0° | 119.9° |
| C64 | C65 | C66 | H116 | 90.0° | 60.0° |
| C64 | C65 | C66 | H117 | 90.0° | 60.0° |
| C65 | C66 | C67 | H116 | 90.0° | 120.0° |
| C65 | C66 | C67 | H117 | 90.0° | 120.0° |
| C65 | C66 | C67 | C68 | 90.0° | 180.0° |
| C66 | C65 | C64 | H113 | 90.0° | 60.0° |
| C66 | C65 | C64 | H112 | 90.0° | 60.0° |
| C66 | C65 | H114 | H115 | 90.0° | 120.1° |
| C65 | C66 | H116 | H117 | 90.0° | 120.0° |
| C65 | C66 | C67 | H118 | 90.0° | 60.0° |
| C65 | C66 | C67 | H121 | 90.0° | 60.0° |
| C66 | C67 | C68 | H118 | 90.0° | 120.0° |
| C66 | C67 | C68 | H121 | 90.0° | 120.0° |
| C66 | C67 | C68 | C69 | 90.0° | 180.0° |
| C67 | C66 | C65 | H114 | 90.0° | 60.0° |
| C67 | C66 | C65 | H115 | 90.0° | 60.0° |
| C67 | C66 | H116 | H117 | 90.0° | 120.0° |
| C66 | C67 | H118 | H121 | 90.0° | 120.0° |
| C66 | C67 | C68 | H120 | 90.0° | 60.0° |
| C66 | C67 | C68 | H119 | 90.0° | 59.9° |
| C67 | C68 | C69 | H120 | 90.0° | 120.0° |
| C67 | C68 | C69 | H119 | 90.0° | 120.0° |
| C67 | C68 | C69 | C70 | 90.0° | 180.0° |
| C68 | C67 | C66 | H116 | 90.0° | 60.0° |
| C68 | C67 | C66 | H117 | 90.0° | 60.0° |
| C68 | C67 | H118 | H121 | 90.0° | 120.0° |
| C67 | C68 | H120 | H119 | 90.0° | 119.9° |
| C67 | C68 | C69 | H123 | 90.0° | 60.0° |
| C67 | C68 | C69 | H122 | 90.0° | 59.9° |
| C68 | C69 | C70 | H123 | 90.0° | 120.0° |
| C68 | C69 | C70 | H122 | 90.0° | 120.1° |
| C68 | C69 | C70 | C71 | 90.0° | 180.0° |
| C69 | C68 | C67 | H118 | 90.0° | 60.0° |
| C69 | C68 | C67 | H121 | 90.0° | 60.0° |
| C69 | C68 | H120 | H119 | 90.0° | 120.0° |
| C68 | C69 | H123 | H122 | 90.0° | 120.0° |
| C68 | C69 | C70 | H124 | 90.0° | 60.0° |
| C68 | C69 | C70 | H125 | 90.0° | 60.0° |
| C69 | C70 | C71 | H124 | 90.0° | 120.0° |
| C69 | C70 | C71 | H125 | 90.0° | 120.0° |
| C69 | C70 | C71 | C72 | 90.0° | 180.0° |
| C70 | C69 | C68 | H120 | 90.0° | 60.0° |
| C70 | C69 | C68 | H119 | 90.0° | 60.0° |
| C70 | C69 | H123 | H122 | 90.0° | 120.0° |
| C69 | C70 | H124 | H125 | 90.0° | 120.0° |
| C69 | C70 | C71 | H127 | 90.0° | 60.0° |
| C69 | C70 | C71 | H126 | 90.0° | 60.0° |
| C70 | C71 | C72 | H127 | 90.0° | 120.0° |
| C70 | C71 | C72 | H126 | 90.0° | 120.0° |
| C70 | C71 | C72 | C73 | 90.0° | 180.0° |
| C71 | C70 | C69 | H123 | 90.0° | 60.0° |
| C71 | C70 | C69 | H122 | 90.0° | 60.0° |
| C71 | C70 | H124 | H125 | 90.0° | 120.0° |
| C70 | C71 | H127 | H126 | 90.0° | 120.0° |
| C70 | C71 | C72 | H128 | 90.0° | 60.0° |
| C70 | C71 | C72 | H129 | 90.0° | 60.0° |
| C71 | C72 | C73 | H128 | 90.0° | 120.0° |
| C71 | C72 | C73 | H129 | 90.0° | 120.0° |
| C71 | C72 | C73 | C74 | 90.0° | 180.0° |
| C72 | C71 | C70 | H124 | 90.0° | 60.0° |
| C72 | C71 | C70 | H125 | 90.0° | 60.0° |
| C72 | C71 | H127 | H126 | 90.0° | 120.0° |
| C71 | C72 | H128 | H129 | 90.0° | 120.0° |
| C71 | C72 | C73 | H130 | 90.0° | 60.1° |
| C71 | C72 | C73 | H131 | 90.0° | 60.0° |
| C72 | C73 | C74 | H130 | 90.0° | 119.9° |
| C72 | C73 | C74 | H131 | 90.0° | 120.0° |
| C73 | C72 | C71 | H127 | 90.0° | 60.0° |
| C73 | C72 | C71 | H126 | 90.0° | 60.0° |
| C73 | C72 | H128 | H129 | 90.0° | 120.0° |
| C72 | C73 | H130 | H131 | 90.0° | 120.0° |
| C72 | C73 | C74 | H132 | 90.0° | 180.0° |
| C72 | C73 | C74 | H134 | 90.0° | 60.1° |
| C72 | C73 | C74 | H133 | 90.0° | 60.0° |
| C74 | C73 | C72 | H128 | 90.0° | 60.0° |
| C74 | C73 | C72 | H129 | 90.0° | 60.0° |
| C74 | C73 | H130 | H131 | 90.0° | 120.0° |
| C73 | C74 | H132 | H134 | 90.0° | 120.0° |
| C73 | C74 | H132 | H133 | 90.0° | 120.0° |
| C73 | C74 | H134 | H133 | 90.0° | 120.1° |
| H2 | C43 | C60 | H105 | 90.0° | 65.0° |
| H2 | C43 | O32 | H106 | 90.0° | 179.9° |
| H58 | C44 | C42 | H72 | 90.0° | 180.0° |
| H58 | C44 | C42 | H73 | 90.0° | 60.0° |
| H63 | C44 | C42 | H72 | 90.0° | 60.0° |
| H63 | C44 | C42 | H73 | 90.0° | 180.0° |
| H72 | C42 | C45 | H74 | 90.0° | 180.0° |
| H72 | C42 | C45 | H75 | 90.0° | 60.0° |
| H73 | C42 | C45 | H74 | 90.0° | 59.9° |
| H73 | C42 | C45 | H75 | 90.0° | 180.0° |
| H74 | C45 | C46 | H76 | 90.0° | 180.0° |
| H74 | C45 | C46 | H77 | 90.0° | 59.9° |
| H75 | C45 | C46 | H76 | 90.0° | 60.0° |
| H75 | C45 | C46 | H77 | 90.0° | 180.0° |
| H76 | C46 | C47 | H78 | 90.0° | 180.0° |
| H76 | C46 | C47 | H79 | 90.0° | 60.0° |
| H77 | C46 | C47 | H78 | 90.0° | 60.0° |
| H77 | C46 | C47 | H79 | 90.0° | 180.0° |
| H78 | C47 | C48 | H80 | 90.0° | 180.0° |
| H78 | C47 | C48 | H81 | 90.0° | 60.0° |
| H79 | C47 | C48 | H80 | 90.0° | 60.1° |
| H79 | C47 | C48 | H81 | 90.0° | 179.9° |
| H80 | C48 | C49 | H82 | 90.0° | 180.0° |
| H80 | C48 | C49 | H83 | 90.0° | 60.0° |
| H81 | C48 | C49 | H82 | 90.0° | 60.0° |
| H81 | C48 | C49 | H83 | 90.0° | 180.0° |
| H82 | C49 | C51 | H84 | 90.0° | 179.9° |
| H82 | C49 | C51 | H85 | 90.0° | 60.0° |
| H83 | C49 | C51 | H84 | 90.0° | 60.0° |
| H83 | C49 | C51 | H85 | 90.0° | 179.9° |
| H84 | C51 | C52 | H86 | 90.0° | 180.0° |
| H84 | C51 | C52 | H87 | 90.0° | 60.0° |
| H85 | C51 | C52 | H86 | 90.0° | 60.0° |
| H85 | C51 | C52 | H87 | 90.0° | 180.0° |
| H86 | C52 | C53 | H88 | 90.0° | 180.0° |
| H86 | C52 | C53 | H89 | 90.0° | 60.0° |
| H87 | C52 | C53 | H88 | 90.0° | 60.1° |
| H87 | C52 | C53 | H89 | 90.0° | 180.0° |
| H88 | C53 | C54 | H90 | 90.0° | 179.9° |
| H88 | C53 | C54 | H91 | 90.0° | 60.0° |
| H89 | C53 | C54 | H90 | 90.0° | 60.0° |
| H89 | C53 | C54 | H91 | 90.0° | 180.0° |
| H90 | C54 | C55 | H92 | 90.0° | 180.0° |
| H90 | C54 | C55 | H93 | 90.0° | 60.1° |
| H91 | C54 | C55 | H92 | 90.0° | 60.1° |
| H91 | C54 | C55 | H93 | 90.0° | 180.0° |
| H92 | C55 | C56 | H94 | 90.0° | 180.0° |
| H92 | C55 | C56 | H95 | 90.0° | 60.0° |
| H93 | C55 | C56 | H94 | 90.0° | 60.0° |
| H93 | C55 | C56 | H95 | 90.0° | 180.0° |
| H94 | C56 | C50 | H96 | 90.0° | 180.0° |
| H94 | C56 | C50 | H97 | 90.0° | 60.0° |
| H95 | C56 | C50 | H96 | 90.0° | 59.9° |
| H95 | C56 | C50 | H97 | 90.0° | 179.9° |
| H96 | C50 | C57 | H98 | 90.0° | 180.0° |
| H96 | C50 | C57 | H99 | 90.0° | 59.9° |
| H97 | C50 | C57 | H98 | 90.0° | 60.0° |
| H97 | C50 | C57 | H99 | 90.0° | 180.0° |
| H98 | C57 | C58 | H100 | 90.0° | 180.0° |
| H98 | C57 | C58 | H101 | 90.0° | 60.0° |
| H99 | C57 | C58 | H100 | 90.0° | 60.0° |
| H99 | C57 | C58 | H101 | 90.0° | 179.9° |
| H100 | C58 | C59 | H102 | 90.0° | NaN° |
| H100 | C58 | C59 | H103 | 90.0° | 60.0° |
| H100 | C58 | C59 | H104 | 90.0° | 60.0° |
| H101 | C58 | C59 | H102 | 90.0° | 60.0° |
| H101 | C58 | C59 | H103 | 90.0° | 180.0° |
| H101 | C58 | C59 | H104 | 90.0° | 60.0° |
| H102 | C59 | H103 | H104 | 90.0° | 120.0° |
| H105 | C60 | C61 | H107 | 90.0° | 180.0° |
| H107 | C61 | C62 | H108 | 90.0° | 65.0° |
| H107 | C61 | C62 | H109 | 90.0° | 175.0° |
| H108 | C62 | C63 | H110 | 90.0° | 180.0° |
| H108 | C62 | C63 | H111 | 90.0° | 60.0° |
| H109 | C62 | C63 | H110 | 90.0° | 60.0° |
| H109 | C62 | C63 | H111 | 90.0° | 180.0° |
| H110 | C63 | C64 | H113 | 90.0° | 180.0° |
| H110 | C63 | C64 | H112 | 90.0° | 60.0° |
| H111 | C63 | C64 | H113 | 90.0° | 60.0° |
| H111 | C63 | C64 | H112 | 90.0° | 180.0° |
| H113 | C64 | C65 | H114 | 90.0° | 180.0° |
| H113 | C64 | C65 | H115 | 90.0° | 60.0° |
| H112 | C64 | C65 | H114 | 90.0° | 60.0° |
| H112 | C64 | C65 | H115 | 90.0° | 180.0° |
| H114 | C65 | C66 | H116 | 90.0° | 180.0° |
| H114 | C65 | C66 | H117 | 90.0° | 60.0° |
| H115 | C65 | C66 | H116 | 90.0° | 60.0° |
| H115 | C65 | C66 | H117 | 90.0° | 180.0° |
| H116 | C66 | C67 | H118 | 90.0° | 180.0° |
| H116 | C66 | C67 | H121 | 90.0° | 60.0° |
| H117 | C66 | C67 | H118 | 90.0° | 60.0° |
| H117 | C66 | C67 | H121 | 90.0° | 180.0° |
| H118 | C67 | C68 | H120 | 90.0° | 180.0° |
| H118 | C67 | C68 | H119 | 90.0° | 60.1° |
| H121 | C67 | C68 | H120 | 90.0° | 60.0° |
| H121 | C67 | C68 | H119 | 90.0° | 179.9° |
| H120 | C68 | C69 | H123 | 90.0° | NaN° |
| H120 | C68 | C69 | H122 | 90.0° | 60.1° |
| H119 | C68 | C69 | H123 | 90.0° | 60.0° |
| H119 | C68 | C69 | H122 | 90.0° | 180.0° |
| H123 | C69 | C70 | H124 | 90.0° | 180.0° |
| H123 | C69 | C70 | H125 | 90.0° | 60.0° |
| H122 | C69 | C70 | H124 | 90.0° | 60.0° |
| H122 | C69 | C70 | H125 | 90.0° | 180.0° |
| H124 | C70 | C71 | H127 | 90.0° | 180.0° |
| H124 | C70 | C71 | H126 | 90.0° | 60.0° |
| H125 | C70 | C71 | H127 | 90.0° | 60.0° |
| H125 | C70 | C71 | H126 | 90.0° | 180.0° |
| H127 | C71 | C72 | H128 | 90.0° | 180.0° |
| H127 | C71 | C72 | H129 | 90.0° | 60.0° |
| H126 | C71 | C72 | H128 | 90.0° | 60.0° |
| H126 | C71 | C72 | H129 | 90.0° | 180.0° |
| H128 | C72 | C73 | H130 | 90.0° | 180.0° |
| H128 | C72 | C73 | H131 | 90.0° | 60.0° |
| H129 | C72 | C73 | H130 | 90.0° | 60.0° |
| H129 | C72 | C73 | H131 | 90.0° | 180.0° |
| H130 | C73 | C74 | H132 | 90.0° | 60.0° |
| H130 | C73 | C74 | H134 | 90.0° | 180.0° |
| H130 | C73 | C74 | H133 | 90.0° | 59.9° |
| H131 | C73 | C74 | H132 | 90.0° | 60.0° |
| H131 | C73 | C74 | H134 | 90.0° | 60.0° |
| H131 | C73 | C74 | H133 | 90.0° | 180.0° |
| H132 | C74 | H134 | H133 | 90.0° | 120.0° |
