UK3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N11 | C25 | sing | 1.47Å | 1.45Å | |
| C25 | C22 | sing | 1.53Å | 1.53Å | |
| O1 | C12 | sing | 1.43Å | 1.42Å | |
| C5 | N8 | sing | 1.37Å | 1.38Å | Aromatic |
| C5 | C4 | doub | 1.34Å | 1.35Å | Aromatic |
| N8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| N5 | C79 | sing | 1.47Å | 1.46Å | |
| N5 | C45 | sing | 1.35Å | 1.33Å | |
| C79 | C12 | sing | 1.53Å | 1.54Å | |
| C79 | C66 | sing | 1.51Å | 1.56Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| O23 | C66 | doub | 1.21Å | 1.23Å | |
| O21 | C24 | doub | 1.21Å | 1.23Å | |
| C4 | C78 | sing | 1.51Å | 1.50Å | |
| C4 | C10 | sing | 1.46Å | 1.46Å | Aromatic |
| C56 | C78 | sing | 1.53Å | 1.55Å | |
| C56 | C45 | sing | 1.51Å | 1.53Å | |
| C56 | N10 | sing | 1.46Å | 1.45Å | |
| C66 | N9 | sing | 1.35Å | 1.36Å | |
| C9 | C20 | doub | 1.39Å | 1.41Å | Aromatic |
| C9 | C10 | sing | 1.41Å | 1.43Å | Aromatic |
| C45 | O22 | doub | 1.21Å | 1.23Å | |
| C21 | C19 | sing | 1.53Å | 1.54Å | |
| C20 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | C14 | doub | 1.40Å | 1.41Å | Aromatic |
| C24 | N10 | sing | 1.35Å | 1.34Å | |
| C24 | C26 | sing | 1.51Å | 1.54Å | |
| O4 | C7 | doub | 1.21Å | 1.23Å | |
| N2 | N16 | doub | 1.29Å | 1.39Å | Aromatic |
| N2 | N1 | sing | 1.29Å | 1.34Å | Aromatic |
| N16 | C6 | sing | 1.35Å | 1.32Å | Aromatic |
| N9 | C11 | sing | 1.47Å | 1.47Å | |
| N9 | C8 | sing | 1.47Å | 1.48Å | |
| C59 | C57 | doub | 1.38Å | 1.40Å | Aromatic |
| C59 | C18 | sing | 1.39Å | 1.40Å | Aromatic |
| N1 | C3 | sing | 1.46Å | 1.46Å | |
| N1 | C1 | sing | 1.35Å | 1.37Å | Aromatic |
| C17 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | C1 | doub | 1.36Å | 1.38Å | Aromatic |
| C6 | C18 | sing | 1.49Å | 1.49Å | |
| C14 | C16 | sing | 1.37Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.55Å | |
| C19 | C89 | sing | 1.53Å | 1.55Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C7 | N7 | sing | 1.35Å | 1.34Å | |
| C26 | N12 | sing | 1.46Å | 1.48Å | |
| C57 | C53 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C13 | sing | 1.55Å | 1.52Å | |
| C18 | C30 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C15 | sing | 1.54Å | 1.54Å | |
| C89 | N7 | sing | 1.46Å | 1.46Å | |
| C89 | C67 | sing | 1.51Å | 1.53Å | |
| C33 | N13 | sing | 1.47Å | 1.46Å | |
| C33 | C31 | sing | 1.53Å | 1.54Å | |
| C53 | C42 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | N12 | sing | 1.46Å | 1.48Å | |
| C27 | C28 | sing | 1.53Å | 1.54Å | |
| N12 | C52 | sing | 1.35Å | 1.36Å | |
| C30 | C42 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C80 | sing | 1.53Å | 1.54Å | |
| C13 | C15 | sing | 1.55Å | 1.52Å | |
| C42 | N3 | sing | 1.40Å | 1.39Å | |
| N13 | C37 | sing | 1.35Å | 1.35Å | |
| C67 | N6 | sing | 1.35Å | 1.34Å | |
| C67 | O11 | doub | 1.21Å | 1.23Å | |
| N6 | C34 | sing | 1.46Å | 1.46Å | |
| C31 | C28 | sing | 1.53Å | 1.54Å | |
| C50 | C48 | doub | 1.38Å | 1.39Å | Aromatic |
| C50 | C39 | sing | 1.40Å | 1.41Å | Aromatic |
| C48 | C46 | sing | 1.38Å | 1.39Å | Aromatic |
| C52 | O20 | doub | 1.22Å | 1.23Å | |
| C52 | C55 | sing | 1.48Å | 1.51Å | |
| O5 | C77 | doub | 1.21Å | 1.23Å | |
| C76 | C71 | sing | 1.53Å | 1.54Å | |
| C85 | C82 | sing | 1.53Å | 1.55Å | |
| C80 | C73 | sing | 1.53Å | 1.54Å | |
| C63 | C55 | doub | 1.40Å | 1.40Å | Aromatic |
| C63 | C62 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | C39 | sing | 1.48Å | 1.53Å | |
| C37 | O17 | doub | 1.22Å | 1.23Å | |
| O18 | C54 | doub | 1.21Å | 1.23Å | |
| N3 | C54 | sing | 1.35Å | 1.34Å | |
| C39 | C41 | doub | 1.40Å | 1.42Å | Aromatic |
| O6 | C86 | doub | 1.21Å | 1.23Å | |
| C29 | C34 | sing | 1.53Å | 1.55Å | |
| C29 | C32 | sing | 1.51Å | 1.53Å | |
| C46 | C44 | doub | 1.38Å | 1.39Å | Aromatic |
| O15 | C23 | doub | 1.21Å | 1.23Å | |
| C34 | C23 | sing | 1.51Å | 1.55Å | |
| C55 | C58 | sing | 1.40Å | 1.41Å | Aromatic |
| C54 | C90 | sing | 1.51Å | 1.55Å | |
| C77 | C82 | sing | 1.51Å | 1.55Å | |
| C77 | O25 | sing | 1.34Å | 1.36Å | |
| C23 | N4 | sing | 1.35Å | 1.34Å | |
| C82 | C86 | sing | 1.51Å | 1.54Å | |
| C82 | F1 | sing | 1.40Å | 1.34Å | |
| C62 | C61 | doub | 1.39Å | 1.39Å | Aromatic |
| C71 | C69 | sing | 1.53Å | 1.55Å | |
| C41 | C44 | sing | 1.39Å | 1.40Å | Aromatic |
| C41 | O16 | sing | 1.36Å | 1.37Å | |
| C86 | C88 | sing | 1.51Å | 1.54Å | |
| C73 | N14 | sing | 1.47Å | 1.46Å | |
| C44 | O14 | sing | 1.36Å | 1.37Å | |
| C93 | O7 | sing | 1.43Å | 1.42Å | |
| C35 | C32 | doub | 1.38Å | 1.41Å | Aromatic |
| C35 | C36 | sing | 1.38Å | 1.41Å | Aromatic |
| N4 | C90 | sing | 1.46Å | 1.46Å | |
| C69 | O25 | sing | 1.45Å | 1.43Å | |
| C69 | C65 | sing | 1.54Å | 1.57Å | |
| C32 | C43 | sing | 1.38Å | 1.41Å | Aromatic |
| O2 | C72 | doub | 1.21Å | 1.23Å | |
| C90 | C47 | sing | 1.53Å | 1.54Å | |
| C58 | O19 | sing | 1.36Å | 1.38Å | |
| C58 | C60 | doub | 1.39Å | 1.40Å | Aromatic |
| C72 | N14 | sing | 1.34Å | 1.39Å | |
| C72 | O24 | sing | 1.34Å | 1.35Å | |
| N14 | C68 | sing | 1.47Å | 1.46Å | |
| C61 | C60 | sing | 1.38Å | 1.39Å | Aromatic |
| O7 | C87 | sing | 1.43Å | 1.43Å | |
| C36 | C38 | doub | 1.39Å | 1.41Å | Aromatic |
| O24 | C65 | sing | 1.46Å | 1.42Å | |
| C88 | C92 | sing | 1.53Å | 1.54Å | |
| C88 | C91 | sing | 1.53Å | 1.56Å | |
| C47 | C49 | sing | 1.53Å | 1.54Å | |
| C65 | C68 | sing | 1.53Å | 1.54Å | |
| C65 | C64 | sing | 1.53Å | 1.55Å | |
| C60 | O12 | sing | 1.36Å | 1.37Å | |
| C43 | C40 | doub | 1.38Å | 1.41Å | Aromatic |
| C68 | C70 | sing | 1.52Å | 1.57Å | |
| C91 | C87 | sing | 1.53Å | 1.55Å | |
| C91 | O8 | sing | 1.43Å | 1.43Å | |
| C99 | C97 | sing | 1.53Å | 1.53Å | |
| C97 | O9 | sing | 1.43Å | 1.42Å | |
| C97 | C98 | sing | 1.53Å | 1.54Å | |
| C49 | S1 | sing | 1.81Å | 1.81Å | |
| C87 | C84 | sing | 1.53Å | 1.55Å | |
| O9 | C94 | sing | 1.43Å | 1.40Å | |
| C38 | C40 | sing | 1.39Å | 1.41Å | Aromatic |
| C38 | O13 | sing | 1.36Å | 1.36Å | |
| C94 | O8 | sing | 1.43Å | 1.40Å | |
| C94 | C95 | sing | 1.53Å | 1.54Å | |
| O3 | C75 | doub | 1.22Å | 1.23Å | |
| C98 | C96 | sing | 1.53Å | 1.55Å | |
| C70 | C75 | sing | 1.51Å | 1.54Å | |
| C70 | C74 | sing | 1.53Å | 1.55Å | |
| C75 | C81 | sing | 1.50Å | 1.54Å | |
| C51 | S1 | sing | 1.81Å | 1.81Å | |
| C84 | C81 | sing | 1.53Å | 1.55Å | |
| C96 | C95 | sing | 1.53Å | 1.57Å | |
| C96 | N15 | sing | 1.47Å | 1.49Å | |
| C95 | O10 | sing | 1.43Å | 1.42Å | |
| C110 | N15 | sing | 1.47Å | 1.47Å | |
| C81 | C83 | sing | 1.52Å | 1.54Å | |
| N15 | C100 | sing | 1.47Å | 1.46Å | |
| N3 | H113 | sing | 0.97Å | 1.00Å | |
| C5 | HC5 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| O1 | HO11 | sing | 0.97Å | 0.95Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| N4 | H114 | sing | 0.97Å | 1.00Å | |
| N5 | H115 | sing | 0.97Å | 1.00Å | |
| N6 | HN61 | sing | 0.97Å | 1.00Å | |
| N7 | HN71 | sing | 0.97Å | 1.00Å | |
| N8 | H128 | sing | 0.97Å | 1.00Å | |
| C100 | H213 | sing | 1.09Å | 1.10Å | |
| C100 | H013 | sing | 1.09Å | 1.10Å | |
| C100 | HC10 | sing | 1.09Å | 1.10Å | |
| C110 | H413 | sing | 1.09Å | 1.10Å | |
| C110 | H513 | sing | 1.09Å | 1.10Å | |
| C110 | H313 | sing | 1.09Å | 1.10Å | |
| N10 | H911 | sing | 0.97Å | 1.00Å | |
| O10 | H412 | sing | 0.97Å | 0.95Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| N11 | H100 | sing | 1.01Å | 1.00Å | |
| N11 | H121 | sing | 1.01Å | 1.00Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| O12 | H512 | sing | 0.97Å | 0.95Å | |
| N13 | H212 | sing | 0.97Å | 1.00Å | |
| O13 | HO13 | sing | 0.97Å | 0.95Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| O14 | H712 | sing | 0.97Å | 0.95Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| O16 | H812 | sing | 0.97Å | 0.95Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| O19 | H912 | sing | 0.97Å | 0.95Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H35 | sing | 1.09Å | 1.10Å | |
| C29 | H34 | sing | 1.09Å | 1.10Å | |
| C30 | H36 | sing | 1.08Å | 1.08Å | |
| C31 | H38 | sing | 1.09Å | 1.10Å | |
| C31 | H37 | sing | 1.09Å | 1.10Å | |
| C33 | H40 | sing | 1.09Å | 1.10Å | |
| C33 | H39 | sing | 1.09Å | 1.10Å | |
| C34 | H41 | sing | 1.09Å | 1.10Å | |
| C35 | H42 | sing | 1.08Å | 1.08Å | |
| C36 | H43 | sing | 1.08Å | 1.08Å | |
| C40 | H44 | sing | 1.08Å | 1.08Å | |
| C43 | H45 | sing | 1.08Å | 1.08Å | |
| C46 | H46 | sing | 1.08Å | 1.08Å | |
| C47 | H48 | sing | 1.09Å | 1.10Å | |
| C47 | H47 | sing | 1.09Å | 1.10Å | |
| C48 | H49 | sing | 1.08Å | 1.08Å | |
| C49 | H50 | sing | 1.09Å | 1.10Å | |
| C49 | H51 | sing | 1.09Å | 1.10Å | |
| C50 | H52 | sing | 1.08Å | 1.08Å | |
| C51 | H53 | sing | 1.09Å | 1.10Å | |
| C51 | H55 | sing | 1.09Å | 1.10Å | |
| C51 | H54 | sing | 1.09Å | 1.10Å | |
| C53 | H56 | sing | 1.08Å | 1.08Å | |
| C56 | H57 | sing | 1.09Å | 1.10Å | |
| C57 | H58 | sing | 1.08Å | 1.08Å | |
| C59 | H59 | sing | 1.08Å | 1.08Å | |
| C61 | H60 | sing | 1.08Å | 1.08Å | |
| C62 | H61 | sing | 1.08Å | 1.08Å | |
| C63 | H62 | sing | 1.08Å | 1.08Å | |
| C64 | H63 | sing | 1.09Å | 1.10Å | |
| C64 | H65 | sing | 1.09Å | 1.10Å | |
| C64 | H64 | sing | 1.09Å | 1.10Å | |
| C68 | H66 | sing | 1.11Å | 1.10Å | |
| C69 | H67 | sing | 1.09Å | 1.10Å | |
| C70 | H68 | sing | 1.09Å | 1.10Å | |
| C71 | H70 | sing | 1.09Å | 1.10Å | |
| C71 | H69 | sing | 1.09Å | 1.10Å | |
| C73 | H71 | sing | 1.09Å | 1.10Å | |
| C73 | H72 | sing | 1.09Å | 1.10Å | |
| C74 | H040 | sing | 1.09Å | 1.10Å | |
| C74 | H74 | sing | 1.09Å | 1.10Å | |
| C74 | H73 | sing | 1.09Å | 1.10Å | |
| C76 | H78 | sing | 1.09Å | 1.10Å | |
| C76 | H77 | sing | 1.09Å | 1.10Å | |
| C76 | H76 | sing | 1.09Å | 1.10Å | |
| C78 | H79 | sing | 1.09Å | 1.10Å | |
| C78 | H80 | sing | 1.09Å | 1.10Å | |
| C79 | H81 | sing | 1.09Å | 1.10Å | |
| C80 | H82 | sing | 1.09Å | 1.10Å | |
| C80 | H83 | sing | 1.09Å | 1.10Å | |
| C81 | H84 | sing | 1.11Å | 1.10Å | |
| C83 | H86 | sing | 1.09Å | 1.10Å | |
| C83 | H85 | sing | 1.09Å | 1.10Å | |
| C83 | H87 | sing | 1.09Å | 1.10Å | |
| C84 | H89 | sing | 1.09Å | 1.10Å | |
| C84 | H88 | sing | 1.10Å | 1.10Å | |
| C85 | H91 | sing | 1.09Å | 1.10Å | |
| C85 | H90 | sing | 1.09Å | 1.10Å | |
| C85 | H92 | sing | 1.09Å | 1.10Å | |
| C87 | H93 | sing | 1.09Å | 1.10Å | |
| C88 | H94 | sing | 1.09Å | 1.10Å | |
| C89 | H95 | sing | 1.09Å | 1.10Å | |
| C90 | H96 | sing | 1.09Å | 1.10Å | |
| C91 | H97 | sing | 1.09Å | 1.10Å | |
| C92 | H99 | sing | 1.09Å | 1.10Å | |
| C92 | H98 | sing | 1.09Å | 1.10Å | |
| C92 | H010 | sing | 1.09Å | 1.10Å | |
| C93 | HC86 | sing | 1.09Å | 1.10Å | |
| C93 | H310 | sing | 1.09Å | 1.10Å | |
| C93 | H210 | sing | 1.09Å | 1.10Å | |
| C94 | H410 | sing | 1.09Å | 1.10Å | |
| C95 | H510 | sing | 1.09Å | 1.10Å | |
| C96 | HC96 | sing | 1.09Å | 1.10Å | |
| C97 | H710 | sing | 1.09Å | 1.10Å | |
| C98 | H910 | sing | 1.09Å | 1.10Å | |
| C98 | H810 | sing | 1.09Å | 1.10Å | |
| C99 | H011 | sing | 1.09Å | 1.10Å | |
| C99 | H111 | sing | 1.09Å | 1.10Å | |
| C99 | H211 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N11 | C25 | C22 | 111.1° | 109.4° |
| C25 | N11 | H100 | 109.5° | 111.0° |
| C25 | N11 | H121 | 109.5° | 111.0° |
| N11 | C25 | H27 | 109.1° | 109.5° |
| N11 | C25 | H26 | 109.0° | 109.5° |
| C25 | C22 | C21 | 114.5° | 109.5° |
| C25 | C22 | H25 | 108.2° | 109.5° |
| C25 | C22 | H24 | 108.2° | 109.5° |
| C22 | C25 | H27 | 109.0° | 109.5° |
| C22 | C25 | H26 | 109.1° | 109.5° |
| O1 | C12 | C79 | 109.5° | 109.5° |
| C12 | O1 | HO11 | 109.5° | 114.0° |
| O1 | C12 | H11 | 109.4° | 109.5° |
| O1 | C12 | H10 | 109.5° | 109.5° |
| N8 | C5 | C4 | 109.6° | 109.9° |
| C5 | N8 | C9 | 111.8° | 109.9° |
| N8 | C5 | HC5 | 125.2° | 125.0° |
| C5 | N8 | H128 | 124.1° | 125.0° |
| C5 | C4 | C78 | 125.9° | 126.5° |
| C5 | C4 | C10 | 105.7° | 107.1° |
| C4 | C5 | HC5 | 125.2° | 125.1° |
| N8 | C9 | C20 | 133.3° | 133.5° |
| N8 | C9 | C10 | 104.2° | 107.2° |
| C9 | N8 | H128 | 124.1° | 125.1° |
| C79 | N5 | C45 | 128.1° | 120.0° |
| N5 | C79 | C12 | 108.4° | 109.5° |
| N5 | C79 | C66 | 116.2° | 109.5° |
| C79 | N5 | H115 | 115.9° | 120.0° |
| N5 | C79 | H81 | 103.7° | 109.5° |
| N5 | C45 | C56 | 115.1° | 120.0° |
| N5 | C45 | O22 | 125.1° | 120.0° |
| C45 | N5 | H115 | 115.9° | 120.0° |
| C12 | C79 | C66 | 120.1° | 109.5° |
| C79 | C12 | H11 | 109.5° | 109.5° |
| C79 | C12 | H10 | 109.5° | 109.5° |
| C12 | C79 | H81 | 103.1° | 109.5° |
| C79 | C66 | O23 | 114.9° | 120.0° |
| C79 | C66 | N9 | 124.2° | 120.0° |
| C66 | C79 | H81 | 102.9° | 109.5° |
| C22 | C21 | C19 | 113.8° | 109.5° |
| C22 | C21 | H23 | 108.4° | 109.4° |
| C22 | C21 | H22 | 108.4° | 109.5° |
| C21 | C22 | H25 | 108.2° | 109.5° |
| C21 | C22 | H24 | 108.2° | 109.4° |
| O23 | C66 | N9 | 120.9° | 120.0° |
| O21 | C24 | N10 | 122.7° | 120.0° |
| O21 | C24 | C26 | 119.8° | 120.0° |
| C78 | C4 | C10 | 128.2° | 126.5° |
| C4 | C78 | C56 | 118.6° | 109.5° |
| C4 | C78 | H79 | 107.1° | 109.4° |
| C4 | C78 | H80 | 107.1° | 109.5° |
| C4 | C10 | C9 | 108.6° | 106.0° |
| C4 | C10 | C14 | 134.6° | 134.1° |
| C78 | C56 | C45 | 108.2° | 109.4° |
| C78 | C56 | N10 | 109.1° | 109.5° |
| C78 | C56 | H57 | 109.7° | 109.5° |
| C56 | C78 | H79 | 107.1° | 109.5° |
| C56 | C78 | H80 | 107.1° | 109.5° |
| C45 | C56 | N10 | 109.0° | 109.5° |
| C56 | C45 | O22 | 119.5° | 120.0° |
| C45 | C56 | H57 | 109.8° | 109.5° |
| C56 | N10 | C24 | 126.6° | 120.0° |
| C56 | N10 | H911 | 116.7° | 120.0° |
| N10 | C56 | H57 | 111.0° | 109.5° |
| C66 | N9 | C11 | 119.1° | 125.6° |
| C66 | N9 | C8 | 130.5° | 125.7° |
| C20 | C9 | C10 | 122.4° | 119.3° |
| C9 | C20 | C17 | 119.1° | 119.8° |
| C9 | C20 | H21 | 120.4° | 120.1° |
| C9 | C10 | C14 | 116.8° | 119.9° |
| C21 | C19 | C89 | 114.4° | 109.5° |
| C19 | C21 | H23 | 108.4° | 109.5° |
| C19 | C21 | H22 | 108.4° | 109.5° |
| C21 | C19 | H19 | 108.2° | 109.5° |
| C21 | C19 | H20 | 108.2° | 109.5° |
| C20 | C17 | C16 | 119.9° | 120.7° |
| C20 | C17 | H18 | 120.0° | 119.7° |
| C17 | C20 | H21 | 120.4° | 120.1° |
| C10 | C14 | C16 | 121.3° | 119.8° |
| C10 | C14 | H14 | 119.3° | 120.1° |
| N10 | C24 | C26 | 117.3° | 120.0° |
| C24 | N10 | H911 | 116.7° | 120.0° |
| C24 | C26 | N12 | 110.8° | 109.5° |
| C24 | C26 | H28 | 109.1° | 109.4° |
| C24 | C26 | H29 | 109.1° | 109.4° |
| O4 | C7 | C8 | 120.4° | 120.0° |
| O4 | C7 | N7 | 124.0° | 120.0° |
| N16 | N2 | N1 | 106.5° | 110.5° |
| N2 | N16 | C6 | 108.5° | 108.7° |
| N2 | N1 | C3 | 121.6° | 125.7° |
| N2 | N1 | C1 | 110.3° | 108.5° |
| N16 | C6 | C1 | 109.1° | 106.2° |
| N16 | C6 | C18 | 124.3° | 126.9° |
| C11 | N9 | C8 | 110.0° | 108.7° |
| N9 | C11 | C13 | 106.4° | 104.8° |
| N9 | C11 | H9 | 110.2° | 110.4° |
| N9 | C11 | H8 | 110.2° | 110.3° |
| N9 | C8 | C7 | 114.0° | 109.8° |
| N9 | C8 | C15 | 102.4° | 107.3° |
| N9 | C8 | H7 | 110.5° | 110.0° |
| C57 | C59 | C18 | 120.2° | 120.0° |
| C59 | C57 | C53 | 120.3° | 120.2° |
| C59 | C57 | H58 | 119.9° | 119.9° |
| C57 | C59 | H59 | 119.9° | 120.0° |
| C59 | C18 | C6 | 124.0° | 120.1° |
| C59 | C18 | C30 | 119.1° | 119.9° |
| C18 | C59 | H59 | 119.9° | 120.0° |
| C3 | N1 | C1 | 127.3° | 125.8° |
| N1 | C3 | C2 | 110.7° | 109.5° |
| N1 | C3 | H5 | 109.2° | 109.5° |
| N1 | C3 | H4 | 109.2° | 109.5° |
| N1 | C1 | C6 | 105.3° | 106.1° |
| N1 | C1 | H1 | 127.4° | 127.0° |
| C17 | C16 | C14 | 120.4° | 120.5° |
| C16 | C17 | H18 | 120.1° | 119.7° |
| C17 | C16 | H17 | 119.8° | 119.7° |
| C1 | C6 | C18 | 126.5° | 126.9° |
| C6 | C1 | H1 | 127.4° | 127.0° |
| C6 | C18 | C30 | 116.9° | 120.1° |
| C16 | C14 | H14 | 119.3° | 120.0° |
| C14 | C16 | H17 | 119.8° | 119.8° |
| C3 | C2 | C80 | 113.8° | 109.5° |
| C3 | C2 | H2 | 108.4° | 109.4° |
| C3 | C2 | H3 | 108.4° | 109.4° |
| C2 | C3 | H5 | 109.2° | 109.4° |
| C2 | C3 | H4 | 109.2° | 109.4° |
| C19 | C89 | N7 | 109.0° | 109.5° |
| C19 | C89 | C67 | 109.7° | 109.5° |
| C89 | C19 | H19 | 108.2° | 109.4° |
| C89 | C19 | H20 | 108.2° | 109.5° |
| C19 | C89 | H95 | 109.1° | 109.5° |
| C8 | C7 | N7 | 115.6° | 120.0° |
| C7 | C8 | C15 | 110.6° | 109.9° |
| C7 | C8 | H7 | 109.5° | 109.8° |
| C7 | N7 | C89 | 125.8° | 120.0° |
| C7 | N7 | HN71 | 117.1° | 120.0° |
| C26 | N12 | C27 | 115.9° | 120.0° |
| C26 | N12 | C52 | 119.5° | 120.0° |
| N12 | C26 | H28 | 109.1° | 109.5° |
| N12 | C26 | H29 | 109.1° | 109.5° |
| C57 | C53 | C42 | 119.7° | 120.2° |
| C57 | C53 | H56 | 120.1° | 119.9° |
| C53 | C57 | H58 | 119.9° | 119.9° |
| C11 | C13 | C15 | 102.6° | 101.6° |
| C11 | C13 | H12 | 111.1° | 111.0° |
| C11 | C13 | H13 | 111.2° | 111.0° |
| C13 | C11 | H9 | 110.2° | 110.4° |
| C13 | C11 | H8 | 110.2° | 110.3° |
| C18 | C30 | C42 | 121.2° | 119.8° |
| C18 | C30 | H36 | 119.4° | 120.1° |
| C8 | C15 | C13 | 103.9° | 103.0° |
| C15 | C8 | H7 | 109.6° | 109.9° |
| C8 | C15 | H15 | 110.8° | 110.7° |
| C8 | C15 | H16 | 110.8° | 110.7° |
| N7 | C89 | C67 | 109.4° | 109.5° |
| C89 | N7 | HN71 | 117.1° | 120.0° |
| N7 | C89 | H95 | 110.3° | 109.5° |
| C89 | C67 | N6 | 115.7° | 120.0° |
| C89 | C67 | O11 | 119.9° | 120.0° |
| C67 | C89 | H95 | 109.3° | 109.4° |
| N13 | C33 | C31 | 114.0° | 109.4° |
| C33 | N13 | C37 | 134.1° | 120.0° |
| C33 | N13 | H212 | 112.9° | 120.0° |
| N13 | C33 | H40 | 108.3° | 109.5° |
| N13 | C33 | H39 | 108.3° | 109.4° |
| C33 | C31 | C28 | 113.3° | 109.5° |
| C33 | C31 | H38 | 108.5° | 109.4° |
| C33 | C31 | H37 | 108.5° | 109.5° |
| C31 | C33 | H40 | 108.3° | 109.5° |
| C31 | C33 | H39 | 108.3° | 109.4° |
| C53 | C42 | C30 | 119.6° | 119.9° |
| C53 | C42 | N3 | 125.7° | 120.1° |
| C42 | C53 | H56 | 120.2° | 119.9° |
| N12 | C27 | C28 | 116.0° | 109.5° |
| C27 | N12 | C52 | 124.7° | 120.0° |
| N12 | C27 | H31 | 107.8° | 109.5° |
| N12 | C27 | H30 | 107.8° | 109.5° |
| C27 | C28 | C31 | 112.1° | 109.5° |
| C27 | C28 | H32 | 108.8° | 109.4° |
| C27 | C28 | H33 | 108.8° | 109.5° |
| C28 | C27 | H31 | 107.8° | 109.4° |
| C28 | C27 | H30 | 107.8° | 109.4° |
| N12 | C52 | O20 | 122.0° | 120.0° |
| N12 | C52 | C55 | 119.1° | 120.0° |
| C30 | C42 | N3 | 114.7° | 120.0° |
| C42 | C30 | H36 | 119.4° | 120.1° |
| C2 | C80 | C73 | 114.3° | 109.4° |
| C80 | C2 | H2 | 108.4° | 109.5° |
| C80 | C2 | H3 | 108.4° | 109.5° |
| C2 | C80 | H82 | 108.3° | 109.4° |
| C2 | C80 | H83 | 108.3° | 109.5° |
| C15 | C13 | H12 | 111.1° | 111.0° |
| C15 | C13 | H13 | 111.1° | 111.0° |
| C13 | C15 | H15 | 110.8° | 110.7° |
| C13 | C15 | H16 | 110.8° | 110.7° |
| C42 | N3 | C54 | 130.8° | 120.0° |
| C42 | N3 | H113 | 114.6° | 119.9° |
| N13 | C37 | C39 | 124.5° | 120.0° |
| N13 | C37 | O17 | 113.8° | 120.0° |
| C37 | N13 | H212 | 113.0° | 120.0° |
| N6 | C67 | O11 | 124.4° | 120.0° |
| C67 | N6 | C34 | 124.7° | 120.0° |
| C67 | N6 | HN61 | 117.7° | 120.0° |
| N6 | C34 | C29 | 108.8° | 109.5° |
| N6 | C34 | C23 | 109.9° | 109.4° |
| C34 | N6 | HN61 | 117.7° | 120.1° |
| N6 | C34 | H41 | 108.0° | 109.5° |
| C31 | C28 | H32 | 108.8° | 109.5° |
| C31 | C28 | H33 | 108.8° | 109.5° |
| C28 | C31 | H38 | 108.5° | 109.5° |
| C28 | C31 | H37 | 108.5° | 109.5° |
| C48 | C50 | C39 | 122.3° | 120.0° |
| C50 | C48 | C46 | 120.3° | 120.4° |
| C50 | C48 | H49 | 119.9° | 119.8° |
| C48 | C50 | H52 | 118.9° | 120.0° |
| C50 | C39 | C37 | 122.4° | 120.1° |
| C50 | C39 | C41 | 116.3° | 119.7° |
| C39 | C50 | H52 | 118.8° | 120.0° |
| C48 | C46 | C44 | 119.4° | 120.4° |
| C48 | C46 | H46 | 120.3° | 119.8° |
| C46 | C48 | H49 | 119.9° | 119.9° |
| O20 | C52 | C55 | 118.8° | 120.0° |
| C52 | C55 | C63 | 119.7° | 120.2° |
| C52 | C55 | C58 | 121.2° | 120.1° |
| O5 | C77 | C82 | 121.9° | 119.9° |
| O5 | C77 | O25 | 124.1° | 120.5° |
| C76 | C71 | C69 | 114.4° | 109.4° |
| C76 | C71 | H70 | 108.2° | 109.5° |
| C76 | C71 | H69 | 108.2° | 109.5° |
| C71 | C76 | H78 | 109.5° | 109.4° |
| C71 | C76 | H77 | 109.5° | 109.5° |
| C71 | C76 | H76 | 109.5° | 109.5° |
| C85 | C82 | C77 | 111.0° | 108.9° |
| C85 | C82 | C86 | 110.9° | 109.5° |
| C85 | C82 | F1 | 107.3° | 109.5° |
| C82 | C85 | H91 | 109.5° | 109.5° |
| C82 | C85 | H90 | 109.5° | 109.5° |
| C82 | C85 | H92 | 109.4° | 109.5° |
| C80 | C73 | N14 | 111.6° | 109.4° |
| C80 | C73 | H71 | 108.9° | 109.5° |
| C80 | C73 | H72 | 108.9° | 109.4° |
| C73 | C80 | H82 | 108.2° | 109.4° |
| C73 | C80 | H83 | 108.3° | 109.5° |
| C55 | C63 | C62 | 120.8° | 120.0° |
| C63 | C55 | C58 | 118.9° | 119.7° |
| C55 | C63 | H62 | 119.6° | 120.0° |
| C63 | C62 | C61 | 119.9° | 120.4° |
| C63 | C62 | H61 | 120.1° | 119.8° |
| C62 | C63 | H62 | 119.6° | 120.0° |
| C39 | C37 | O17 | 121.5° | 120.0° |
| C37 | C39 | C41 | 121.3° | 120.2° |
| O18 | C54 | N3 | 125.4° | 120.0° |
| O18 | C54 | C90 | 120.5° | 120.0° |
| N3 | C54 | C90 | 114.0° | 120.0° |
| C54 | N3 | H113 | 114.6° | 120.0° |
| C39 | C41 | C44 | 121.1° | 119.7° |
| C39 | C41 | O16 | 124.0° | 120.2° |
| O6 | C86 | C82 | 121.2° | 119.5° |
| O6 | C86 | C88 | 120.8° | 120.1° |
| C34 | C29 | C32 | 117.6° | 109.4° |
| C29 | C34 | C23 | 116.1° | 109.5° |
| C34 | C29 | H35 | 107.4° | 109.5° |
| C34 | C29 | H34 | 107.4° | 109.5° |
| C29 | C34 | H41 | 106.8° | 109.4° |
| C29 | C32 | C35 | 120.0° | 119.9° |
| C29 | C32 | C43 | 120.7° | 119.9° |
| C32 | C29 | H35 | 107.4° | 109.5° |
| C32 | C29 | H34 | 107.4° | 109.5° |
| C46 | C44 | C41 | 120.6° | 119.9° |
| C46 | C44 | O14 | 118.9° | 120.0° |
| C44 | C46 | H46 | 120.3° | 119.8° |
| O15 | C23 | C34 | 119.6° | 120.0° |
| O15 | C23 | N4 | 122.6° | 120.0° |
| C34 | C23 | N4 | 117.8° | 120.0° |
| C23 | C34 | H41 | 106.9° | 109.5° |
| C55 | C58 | O19 | 121.5° | 120.2° |
| C55 | C58 | C60 | 119.8° | 119.7° |
| C54 | C90 | N4 | 113.6° | 109.5° |
| C54 | C90 | C47 | 115.1° | 109.4° |
| C54 | C90 | H96 | 106.0° | 109.5° |
| C82 | C77 | O25 | 113.9° | 119.6° |
| C77 | C82 | C86 | 108.8° | 109.7° |
| C77 | C82 | F1 | 109.7° | 109.4° |
| C77 | O25 | C69 | 122.0° | 118.1° |
| C23 | N4 | C90 | 126.4° | 120.0° |
| C23 | N4 | H114 | 116.8° | 120.0° |
| C86 | C82 | F1 | 109.2° | 109.8° |
| C82 | C86 | C88 | 118.0° | 120.3° |
| C62 | C61 | C60 | 120.2° | 120.3° |
| C62 | C61 | H60 | 119.9° | 119.8° |
| C61 | C62 | H61 | 120.0° | 119.8° |
| C71 | C69 | O25 | 108.8° | 109.5° |
| C71 | C69 | C65 | 114.9° | 109.4° |
| C71 | C69 | H67 | 107.5° | 109.9° |
| C69 | C71 | H70 | 108.2° | 109.5° |
| C69 | C71 | H69 | 108.2° | 109.4° |
| C44 | C41 | O16 | 114.9° | 120.2° |
| C41 | C44 | O14 | 120.5° | 120.0° |
| C41 | O16 | H812 | 109.5° | 114.0° |
| C86 | C88 | C92 | 109.6° | 109.3° |
| C86 | C88 | C91 | 112.8° | 109.7° |
| C86 | C88 | H94 | 107.0° | 109.5° |
| C73 | N14 | C72 | 122.5° | 124.2° |
| C73 | N14 | C68 | 124.7° | 127.4° |
| N14 | C73 | H71 | 108.9° | 109.4° |
| N14 | C73 | H72 | 108.9° | 109.5° |
| C44 | O14 | H712 | 109.5° | 114.0° |
| C93 | O7 | C87 | 114.2° | 114.0° |
| O7 | C93 | HC86 | 109.5° | 109.5° |
| O7 | C93 | H310 | 109.5° | 109.5° |
| O7 | C93 | H210 | 109.5° | 109.5° |
| C32 | C35 | C36 | 120.3° | 120.1° |
| C35 | C32 | C43 | 119.3° | 120.1° |
| C32 | C35 | H42 | 119.8° | 120.0° |
| C35 | C36 | C38 | 120.0° | 120.0° |
| C36 | C35 | H42 | 119.8° | 119.9° |
| C35 | C36 | H43 | 120.0° | 120.0° |
| N4 | C90 | C47 | 108.4° | 109.5° |
| C90 | N4 | H114 | 116.8° | 120.0° |
| N4 | C90 | H96 | 107.0° | 109.5° |
| O25 | C69 | C65 | 109.2° | 108.5° |
| O25 | C69 | H67 | 109.1° | 110.2° |
| C69 | C65 | O24 | 108.4° | 109.5° |
| C69 | C65 | C68 | 110.9° | 109.8° |
| C69 | C65 | C64 | 111.9° | 109.3° |
| C65 | C69 | H67 | 107.3° | 109.2° |
| C32 | C43 | C40 | 120.3° | 120.1° |
| C32 | C43 | H45 | 119.9° | 120.0° |
| O2 | C72 | N14 | 131.0° | 123.0° |
| O2 | C72 | O24 | 122.9° | 123.3° |
| C90 | C47 | C49 | 114.4° | 109.4° |
| C90 | C47 | H48 | 108.2° | 109.5° |
| C90 | C47 | H47 | 108.2° | 109.5° |
| C47 | C90 | H96 | 106.1° | 109.5° |
| O19 | C58 | C60 | 118.7° | 120.1° |
| C58 | O19 | H912 | 109.5° | 114.0° |
| C58 | C60 | C61 | 120.3° | 120.0° |
| C58 | C60 | O12 | 121.1° | 120.1° |
| N14 | C72 | O24 | 106.1° | 113.7° |
| C72 | N14 | C68 | 110.5° | 108.4° |
| C72 | O24 | C65 | 113.2° | 109.0° |
| N14 | C68 | C65 | 100.3° | 103.4° |
| N14 | C68 | C70 | 113.5° | 112.6° |
| N14 | C68 | H66 | 109.3° | 107.5° |
| C61 | C60 | O12 | 118.6° | 120.0° |
| C60 | C61 | H60 | 119.9° | 119.8° |
| O7 | C87 | C91 | 111.0° | 108.3° |
| O7 | C87 | C84 | 107.4° | 109.9° |
| O7 | C87 | H93 | 109.2° | 110.1° |
| C36 | C38 | C40 | 119.9° | 119.9° |
| C36 | C38 | O13 | 120.4° | 120.1° |
| C38 | C36 | H43 | 120.0° | 120.0° |
| O24 | C65 | C68 | 101.1° | 104.1° |
| O24 | C65 | C64 | 107.0° | 109.1° |
| C92 | C88 | C91 | 113.1° | 109.2° |
| C92 | C88 | H94 | 107.1° | 109.7° |
| C88 | C92 | H99 | 109.5° | 109.5° |
| C88 | C92 | H98 | 109.5° | 109.5° |
| C88 | C92 | H010 | 109.5° | 109.5° |
| C88 | C91 | C87 | 113.9° | 109.3° |
| C88 | C91 | O8 | 109.8° | 109.4° |
| C91 | C88 | H94 | 106.8° | 109.3° |
| C88 | C91 | H97 | 107.9° | 109.6° |
| C47 | C49 | S1 | 114.5° | 109.5° |
| C49 | C47 | H48 | 108.2° | 109.5° |
| C49 | C47 | H47 | 108.2° | 109.5° |
| C47 | C49 | H50 | 108.2° | 109.5° |
| C47 | C49 | H51 | 108.2° | 109.5° |
| C68 | C65 | C64 | 116.6° | 114.8° |
| C65 | C68 | C70 | 117.3° | 115.5° |
| C65 | C68 | H66 | 108.2° | 108.7° |
| C65 | C64 | H63 | 109.5° | 109.4° |
| C65 | C64 | H65 | 109.5° | 109.5° |
| C65 | C64 | H64 | 109.5° | 109.4° |
| C60 | O12 | H512 | 109.5° | 113.9° |
| C43 | C40 | C38 | 120.2° | 119.9° |
| C43 | C40 | H44 | 119.9° | 120.1° |
| C40 | C43 | H45 | 119.9° | 119.9° |
| C68 | C70 | C75 | 113.0° | 109.4° |
| C68 | C70 | C74 | 115.9° | 110.2° |
| C70 | C68 | H66 | 107.9° | 108.8° |
| C68 | C70 | H68 | 105.4° | 111.5° |
| C87 | C91 | O8 | 107.7° | 109.2° |
| C91 | C87 | C84 | 113.9° | 109.3° |
| C91 | C87 | H93 | 107.6° | 108.5° |
| C87 | C91 | H97 | 107.9° | 109.4° |
| C91 | O8 | C94 | 115.8° | 114.0° |
| O8 | C91 | H97 | 109.6° | 109.9° |
| C99 | C97 | O9 | 108.9° | 109.5° |
| C99 | C97 | C98 | 111.5° | 109.4° |
| C99 | C97 | H710 | 107.9° | 109.5° |
| C97 | C99 | H011 | 109.5° | 109.4° |
| C97 | C99 | H111 | 109.5° | 109.5° |
| C97 | C99 | H211 | 109.4° | 109.5° |
| O9 | C97 | C98 | 111.3° | 109.4° |
| C97 | O9 | C94 | 112.7° | 114.1° |
| O9 | C97 | H710 | 109.3° | 109.5° |
| C97 | C98 | C96 | 115.0° | 109.2° |
| C98 | C97 | H710 | 107.8° | 109.5° |
| C97 | C98 | H910 | 108.1° | 109.5° |
| C97 | C98 | H810 | 108.1° | 109.6° |
| C49 | S1 | C51 | 100.6° | 103.0° |
| S1 | C49 | H50 | 108.2° | 109.5° |
| S1 | C49 | H51 | 108.2° | 109.4° |
| C87 | C84 | C81 | 115.2° | 111.8° |
| C87 | C84 | H89 | 108.0° | 109.2° |
| C87 | C84 | H88 | 108.0° | 109.0° |
| C84 | C87 | H93 | 107.7° | 110.8° |
| O9 | C94 | O8 | 108.1° | 109.5° |
| O9 | C94 | C95 | 109.7° | 109.4° |
| O9 | C94 | H410 | 110.8° | 109.4° |
| C40 | C38 | O13 | 119.8° | 120.0° |
| C38 | C40 | H44 | 119.9° | 120.0° |
| C38 | O13 | HO13 | 109.5° | 114.0° |
| O8 | C94 | C95 | 108.4° | 109.5° |
| O8 | C94 | H410 | 110.8° | 109.5° |
| C94 | C95 | C96 | 110.9° | 109.2° |
| C94 | C95 | O10 | 108.5° | 109.5° |
| C95 | C94 | H410 | 108.8° | 109.5° |
| C94 | C95 | H510 | 108.4° | 109.5° |
| O3 | C75 | C70 | 121.4° | 118.7° |
| O3 | C75 | C81 | 120.4° | 118.2° |
| C98 | C96 | C95 | 111.2° | 109.0° |
| C98 | C96 | N15 | 108.8° | 109.6° |
| C98 | C96 | HC96 | 105.4° | 109.6° |
| C96 | C98 | H910 | 108.0° | 109.5° |
| C96 | C98 | H810 | 108.1° | 109.5° |
| C75 | C70 | C74 | 110.4° | 109.5° |
| C70 | C75 | C81 | 118.2° | 123.1° |
| C75 | C70 | H68 | 105.7° | 107.0° |
| C74 | C70 | H68 | 105.5° | 109.2° |
| C70 | C74 | H040 | 109.5° | 109.5° |
| C70 | C74 | H74 | 109.5° | 109.5° |
| C70 | C74 | H73 | 109.5° | 109.4° |
| C75 | C81 | C84 | 114.0° | 110.3° |
| C75 | C81 | C83 | 112.1° | 112.8° |
| C75 | C81 | H84 | 106.1° | 107.8° |
| S1 | C51 | H53 | 109.5° | 109.5° |
| S1 | C51 | H55 | 109.5° | 109.5° |
| S1 | C51 | H54 | 109.5° | 109.5° |
| C84 | C81 | C83 | 112.0° | 110.7° |
| C84 | C81 | H84 | 105.9° | 107.4° |
| C81 | C84 | H89 | 108.0° | 109.4° |
| C81 | C84 | H88 | 108.0° | 108.8° |
| C95 | C96 | N15 | 119.1° | 109.5° |
| C96 | C95 | O10 | 111.0° | 109.5° |
| C96 | C95 | H510 | 108.0° | 109.5° |
| C95 | C96 | HC96 | 105.2° | 109.5° |
| C96 | N15 | C110 | 111.9° | 111.0° |
| C96 | N15 | C100 | 116.5° | 111.0° |
| N15 | C96 | HC96 | 106.1° | 109.5° |
| C95 | O10 | H412 | 109.5° | 114.0° |
| O10 | C95 | H510 | 110.0° | 109.5° |
| C110 | N15 | C100 | 107.4° | 111.0° |
| N15 | C110 | H413 | 109.5° | 109.4° |
| N15 | C110 | H513 | 109.4° | 109.4° |
| N15 | C110 | H313 | 109.5° | 109.4° |
| C83 | C81 | H84 | 106.0° | 107.6° |
| C81 | C83 | H86 | 109.5° | 109.5° |
| C81 | C83 | H85 | 109.5° | 109.5° |
| C81 | C83 | H87 | 109.5° | 109.5° |
| N15 | C100 | H213 | 109.5° | 109.5° |
| N15 | C100 | H013 | 109.5° | 109.4° |
| N15 | C100 | HC10 | 109.5° | 109.5° |
| H12 | C13 | H13 | 109.5° | 110.9° |
| H15 | C15 | H16 | 109.5° | 110.8° |
| H23 | C21 | H22 | 109.5° | 109.5° |
| H25 | C22 | H24 | 109.5° | 109.5° |
| H28 | C26 | H29 | 109.5° | 109.5° |
| H32 | C28 | H33 | 109.4° | 109.5° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| H5 | C3 | H4 | 109.4° | 109.5° |
| H213 | C100 | H013 | 109.4° | 109.5° |
| H213 | C100 | HC10 | 109.5° | 109.5° |
| H013 | C100 | HC10 | 109.4° | 109.5° |
| H413 | C110 | H513 | 109.5° | 109.5° |
| H413 | C110 | H313 | 109.5° | 109.5° |
| H513 | C110 | H313 | 109.5° | 109.5° |
| H9 | C11 | H8 | 109.5° | 110.5° |
| H100 | N11 | H121 | 109.5° | 111.0° |
| H11 | C12 | H10 | 109.5° | 109.4° |
| H19 | C19 | H20 | 109.5° | 109.5° |
| H27 | C25 | H26 | 109.5° | 109.5° |
| H31 | C27 | H30 | 109.5° | 109.5° |
| H35 | C29 | H34 | 109.5° | 109.5° |
| H38 | C31 | H37 | 109.4° | 109.5° |
| H40 | C33 | H39 | 109.5° | 109.5° |
| H48 | C47 | H47 | 109.5° | 109.4° |
| H50 | C49 | H51 | 109.5° | 109.5° |
| H53 | C51 | H55 | 109.5° | 109.5° |
| H53 | C51 | H54 | 109.4° | 109.4° |
| H55 | C51 | H54 | 109.4° | 109.5° |
| H63 | C64 | H65 | 109.4° | 109.5° |
| H63 | C64 | H64 | 109.5° | 109.5° |
| H65 | C64 | H64 | 109.5° | 109.5° |
| H70 | C71 | H69 | 109.5° | 109.5° |
| H71 | C73 | H72 | 109.5° | 109.5° |
| H040 | C74 | H74 | 109.5° | 109.5° |
| H040 | C74 | H73 | 109.5° | 109.5° |
| H74 | C74 | H73 | 109.5° | 109.4° |
| H78 | C76 | H77 | 109.4° | 109.5° |
| H78 | C76 | H76 | 109.4° | 109.4° |
| H77 | C76 | H76 | 109.5° | 109.5° |
| H79 | C78 | H80 | 109.5° | 109.5° |
| H82 | C80 | H83 | 109.5° | 109.5° |
| H86 | C83 | H85 | 109.5° | 109.5° |
| H86 | C83 | H87 | 109.4° | 109.4° |
| H85 | C83 | H87 | 109.5° | 109.5° |
| H89 | C84 | H88 | 109.5° | 108.6° |
| H91 | C85 | H90 | 109.5° | 109.4° |
| H91 | C85 | H92 | 109.5° | 109.5° |
| H90 | C85 | H92 | 109.5° | 109.5° |
| H99 | C92 | H98 | 109.4° | 109.4° |
| H99 | C92 | H010 | 109.5° | 109.5° |
| H98 | C92 | H010 | 109.5° | 109.5° |
| HC86 | C93 | H310 | 109.5° | 109.5° |
| HC86 | C93 | H210 | 109.5° | 109.4° |
| H310 | C93 | H210 | 109.4° | 109.5° |
| H910 | C98 | H810 | 109.5° | 109.5° |
| H011 | C99 | H111 | 109.5° | 109.5° |
| H011 | C99 | H211 | 109.5° | 109.5° |
| H111 | C99 | H211 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N11 | C25 | C22 | H27 | 120.2° | 120.0° |
| N11 | C25 | C22 | H26 | 120.2° | 120.0° |
| N11 | C25 | C22 | C21 | 47.5° | 180.0° |
| N11 | C25 | C22 | H25 | 73.2° | 60.0° |
| N11 | C25 | C22 | H24 | 168.3° | 60.0° |
| C25 | N11 | H100 | H121 | 120.0° | 124.0° |
| N11 | C25 | H27 | H26 | 119.2° | 120.0° |
| C25 | C22 | C21 | H25 | 120.7° | 120.0° |
| C25 | C22 | C21 | H24 | 120.8° | 120.0° |
| C25 | C22 | C21 | C19 | 156.9° | 180.0° |
| C25 | C22 | C21 | H23 | 36.2° | 60.0° |
| C25 | C22 | C21 | H22 | 82.5° | 60.0° |
| C25 | C22 | H25 | H24 | 117.7° | 120.0° |
| C22 | C25 | N11 | H100 | 180.0° | 180.0° |
| C22 | C25 | N11 | H121 | 60.0° | 56.0° |
| C22 | C25 | H27 | H26 | 119.3° | 120.0° |
| O1 | C12 | C79 | N5 | 59.0° | 65.0° |
| O1 | C12 | C79 | H11 | 120.0° | 120.0° |
| O1 | C12 | C79 | H10 | 120.0° | 120.0° |
| O1 | C12 | C79 | C66 | 164.0° | 55.0° |
| O1 | C12 | H11 | H10 | 120.0° | 120.0° |
| O1 | C12 | C79 | H81 | 50.5° | 175.0° |
| N8 | C5 | C4 | HC5 | 180.0° | 180.0° |
| C5 | N8 | C9 | H128 | 180.0° | 179.9° |
| N8 | C5 | C4 | C78 | 177.0° | 180.0° |
| N8 | C5 | C4 | C10 | 0.4° | 0.2° |
| C5 | N8 | C9 | C20 | 178.6° | 180.0° |
| C5 | N8 | C9 | C10 | 0.9° | 0.0° |
| C4 | C5 | N8 | C9 | 0.8° | 0.1° |
| C5 | C4 | C78 | C10 | 175.9° | 179.7° |
| C5 | C4 | C78 | C56 | 47.7° | 96.5° |
| C5 | C4 | C10 | C9 | 0.2° | 0.2° |
| C5 | C4 | C10 | C14 | 179.6° | 179.7° |
| C4 | C5 | N8 | H128 | 179.2° | 180.0° |
| C5 | C4 | C78 | H79 | 169.0° | 23.5° |
| C5 | C4 | C78 | H80 | 73.6° | 143.5° |
| N8 | C9 | C10 | C4 | 0.7° | 0.2° |
| N8 | C9 | C20 | C10 | 179.5° | 179.9° |
| N8 | C9 | C20 | C17 | 178.9° | 179.6° |
| N8 | C9 | C10 | C14 | 179.8° | 179.7° |
| C9 | N8 | C5 | HC5 | 179.2° | 179.8° |
| N8 | C9 | C20 | H21 | 1.1° | 0.0° |
| C79 | N5 | C45 | H115 | 180.0° | 180.0° |
| N5 | C79 | C12 | C66 | 136.9° | 120.0° |
| N5 | C79 | C12 | H81 | 109.5° | 120.0° |
| N5 | C79 | C66 | H81 | 112.6° | 120.0° |
| N5 | C79 | C66 | O23 | 77.3° | 0.0° |
| C79 | N5 | C45 | C56 | 161.0° | 180.0° |
| N5 | C79 | C66 | N9 | 102.8° | 180.0° |
| C79 | N5 | C45 | O22 | 13.2° | 0.0° |
| N5 | C79 | C12 | H11 | 60.9° | 175.0° |
| N5 | C79 | C12 | H10 | 179.0° | 55.0° |
| C45 | N5 | C79 | C12 | 87.1° | 85.0° |
| C45 | N5 | C79 | C66 | 51.8° | 155.0° |
| N5 | C45 | C56 | C78 | 85.4° | 60.0° |
| N5 | C45 | C56 | O22 | 174.5° | 180.0° |
| N5 | C45 | C56 | N10 | 156.1° | 180.0° |
| N5 | C45 | C56 | H57 | 34.3° | 60.0° |
| C45 | N5 | C79 | H81 | 163.8° | 35.0° |
| C12 | C79 | C66 | H81 | 113.6° | 120.0° |
| C12 | C79 | C66 | O23 | 149.0° | 120.0° |
| C12 | C79 | C66 | N9 | 31.0° | 60.0° |
| C79 | C12 | O1 | HO11 | 180.0° | 180.0° |
| C12 | C79 | N5 | H115 | 92.9° | 95.0° |
| C79 | C12 | H11 | H10 | 120.0° | 120.0° |
| C79 | C66 | O23 | N9 | 180.0° | 179.9° |
| C79 | C66 | N9 | C11 | 178.5° | 0.0° |
| C79 | C66 | N9 | C8 | 7.0° | 180.0° |
| C66 | C79 | N5 | H115 | 128.2° | 25.0° |
| C66 | C79 | C12 | H11 | 76.0° | 65.0° |
| C66 | C79 | C12 | H10 | 44.0° | 175.0° |
| C22 | C21 | C19 | H23 | 120.6° | 120.0° |
| C22 | C21 | C19 | H22 | 120.6° | 120.0° |
| C22 | C21 | C19 | C89 | 75.5° | 180.0° |
| C22 | C21 | H23 | H22 | 118.0° | 120.0° |
| C21 | C22 | H25 | H24 | 117.7° | 120.0° |
| C22 | C21 | C19 | H19 | 163.8° | 60.0° |
| C22 | C21 | C19 | H20 | 45.2° | 60.0° |
| C21 | C22 | C25 | H27 | 167.8° | 60.0° |
| C21 | C22 | C25 | H26 | 72.7° | 60.0° |
| O23 | C66 | N9 | C11 | 1.5° | 180.0° |
| O23 | C66 | N9 | C8 | 173.0° | 0.1° |
| O23 | C66 | C79 | H81 | 35.3° | 120.0° |
| O21 | C24 | N10 | C56 | 8.3° | 4.9° |
| O21 | C24 | N10 | C26 | 176.2° | 180.0° |
| O21 | C24 | C26 | N12 | 155.7° | 4.7° |
| O21 | C24 | C26 | H28 | 84.2° | 115.3° |
| O21 | C24 | C26 | H29 | 35.5° | 124.7° |
| O21 | C24 | N10 | H911 | 171.6° | 175.0° |
| C4 | C78 | C56 | H79 | 121.3° | 120.0° |
| C4 | C78 | C56 | H80 | 121.3° | 120.0° |
| C4 | C78 | C56 | C45 | 174.4° | 174.1° |
| C4 | C78 | C56 | N10 | 56.0° | 65.9° |
| C78 | C4 | C10 | C9 | 176.3° | 180.0° |
| C78 | C4 | C10 | C14 | 3.1° | 0.1° |
| C78 | C4 | C5 | HC5 | 3.0° | 0.0° |
| C4 | C78 | C56 | H57 | 65.8° | 54.1° |
| C4 | C78 | H79 | H80 | 115.8° | 120.0° |
| C10 | C4 | C78 | C56 | 136.5° | 83.2° |
| C4 | C10 | C9 | C20 | 178.9° | 179.9° |
| C4 | C10 | C9 | C14 | 179.6° | 179.9° |
| C4 | C10 | C14 | C16 | 178.1° | 179.9° |
| C10 | C4 | C5 | HC5 | 179.6° | 179.7° |
| C4 | C10 | C14 | H14 | 1.9° | 0.1° |
| C10 | C4 | C78 | H79 | 15.2° | 156.8° |
| C10 | C4 | C78 | H80 | 102.2° | 36.8° |
| C78 | C56 | C45 | N10 | 118.5° | 120.0° |
| C78 | C56 | C45 | H57 | 119.7° | 120.0° |
| C78 | C56 | N10 | H57 | 121.0° | 120.0° |
| C78 | C56 | C45 | O22 | 89.2° | 120.0° |
| C78 | C56 | N10 | C24 | 103.2° | 98.4° |
| C78 | C56 | N10 | H911 | 76.8° | 81.5° |
| C56 | C78 | H79 | H80 | 115.9° | 120.0° |
| C45 | C56 | N10 | H57 | 121.1° | 120.0° |
| C45 | C56 | N10 | C24 | 138.9° | 141.6° |
| C56 | C45 | N5 | H115 | 19.0° | 0.0° |
| C45 | C56 | N10 | H911 | 41.1° | 38.5° |
| C45 | C56 | C78 | H79 | 53.1° | 65.9° |
| C45 | C56 | C78 | H80 | 64.3° | 54.1° |
| N10 | C56 | C45 | O22 | 29.4° | 0.0° |
| C56 | N10 | C24 | H911 | 180.0° | 179.9° |
| C56 | N10 | C24 | C26 | 167.9° | 175.1° |
| N10 | C56 | C78 | H79 | 65.3° | 54.1° |
| N10 | C56 | C78 | H80 | 177.3° | 174.1° |
| C66 | N9 | C11 | C8 | 173.2° | 180.0° |
| C66 | N9 | C8 | C7 | 89.6° | 61.7° |
| C66 | N9 | C11 | C13 | 174.8° | 155.9° |
| C66 | N9 | C8 | C15 | 150.9° | 178.9° |
| C66 | N9 | C8 | H7 | 34.2° | 59.4° |
| C66 | N9 | C11 | H9 | 65.7° | 37.0° |
| C66 | N9 | C11 | H8 | 55.3° | 85.3° |
| N9 | C66 | C79 | H81 | 144.7° | 60.0° |
| C9 | C20 | C17 | H21 | 180.0° | 179.6° |
| C20 | C9 | C10 | C14 | 0.6° | 0.2° |
| C9 | C20 | C17 | C16 | 1.0° | 0.4° |
| C9 | C20 | C17 | H18 | 179.1° | 179.8° |
| C20 | C9 | N8 | H128 | 1.4° | 0.1° |
| C10 | C9 | C20 | C17 | 0.5° | 0.4° |
| C9 | C10 | C14 | C16 | 1.3° | 0.0° |
| C10 | C9 | C20 | H21 | 179.4° | 180.0° |
| C10 | C9 | N8 | H128 | 179.1° | 179.8° |
| C9 | C10 | C14 | H14 | 178.7° | 180.0° |
| O22 | C45 | N5 | H115 | 166.8° | 180.0° |
| O22 | C45 | C56 | H57 | 151.2° | 120.0° |
| C21 | C19 | C89 | H19 | 120.7° | 120.0° |
| C21 | C19 | C89 | H20 | 120.7° | 120.0° |
| C21 | C19 | C89 | N7 | 65.3° | 65.0° |
| C21 | C19 | C89 | C67 | 175.0° | 175.0° |
| C19 | C21 | H23 | H22 | 118.0° | 120.0° |
| C19 | C21 | C22 | H25 | 82.4° | 60.0° |
| C19 | C21 | C22 | H24 | 36.1° | 60.0° |
| C21 | C19 | H19 | H20 | 117.8° | 120.0° |
| C21 | C19 | C89 | H95 | 55.3° | 55.0° |
| C20 | C17 | C16 | H18 | 180.0° | 179.8° |
| C20 | C17 | C16 | C14 | 0.3° | 0.2° |
| C20 | C17 | C16 | H17 | 179.8° | 180.0° |
| C10 | C14 | C16 | C17 | 0.9° | 0.0° |
| C10 | C14 | C16 | H14 | 180.0° | 180.0° |
| C10 | C14 | C16 | H17 | 179.1° | 179.8° |
| N10 | C24 | C26 | N12 | 20.7° | 175.3° |
| N10 | C24 | C26 | H28 | 99.5° | 64.7° |
| N10 | C24 | C26 | H29 | 140.9° | 55.3° |
| C24 | N10 | C56 | H57 | 17.8° | 21.6° |
| C24 | C26 | N12 | H28 | 120.2° | 120.0° |
| C24 | C26 | N12 | H29 | 120.2° | 120.0° |
| C24 | C26 | N12 | C27 | 78.4° | 85.4° |
| C24 | C26 | N12 | C52 | 100.9° | 94.6° |
| C24 | C26 | H28 | H29 | 119.4° | 119.9° |
| C26 | C24 | N10 | H911 | 12.1° | 5.0° |
| O4 | C7 | C8 | N9 | 2.3° | 0.7° |
| O4 | C7 | C8 | N7 | 178.4° | 180.0° |
| O4 | C7 | C8 | C15 | 112.4° | 118.5° |
| O4 | C7 | N7 | C89 | 0.2° | 0.0° |
| O4 | C7 | C8 | H7 | 126.7° | 120.4° |
| O4 | C7 | N7 | HN71 | 179.8° | 180.0° |
| N16 | N2 | N1 | C3 | 169.4° | 180.0° |
| N16 | N2 | N1 | C1 | 1.2° | 0.3° |
| N2 | N16 | C6 | C1 | 5.6° | 0.0° |
| N2 | N16 | C6 | C18 | 170.5° | 179.9° |
| N1 | N2 | N16 | C6 | 2.8° | 0.1° |
| N2 | N1 | C3 | C1 | 168.9° | 179.7° |
| N2 | N1 | C1 | C6 | 4.5° | 0.3° |
| N2 | N1 | C3 | C2 | 120.6° | 55.3° |
| N2 | N1 | C1 | H1 | 175.5° | 179.8° |
| N2 | N1 | C3 | H5 | 119.2° | 64.7° |
| N2 | N1 | C3 | H4 | 0.4° | 175.3° |
| N16 | C6 | C18 | C59 | 31.5° | 179.9° |
| N16 | C6 | C1 | N1 | 6.2° | 0.2° |
| N16 | C6 | C1 | C18 | 176.1° | 179.9° |
| N16 | C6 | C18 | C30 | 147.3° | 0.1° |
| N16 | C6 | C1 | H1 | 173.8° | 179.9° |
| C11 | N9 | C8 | C7 | 98.2° | 118.4° |
| N9 | C11 | C13 | H9 | 119.5° | 118.9° |
| N9 | C11 | C13 | H8 | 119.5° | 118.8° |
| C11 | N9 | C8 | C15 | 21.2° | 1.0° |
| N9 | C11 | C13 | C15 | 24.2° | 37.0° |
| C11 | N9 | C8 | H7 | 137.9° | 120.6° |
| N9 | C11 | C13 | H12 | 94.7° | 81.1° |
| N9 | C11 | C13 | H13 | 143.1° | 155.1° |
| N9 | C11 | H9 | H8 | 121.4° | 122.3° |
| N9 | C8 | C7 | C15 | 114.7° | 117.8° |
| N9 | C8 | C7 | H7 | 124.4° | 121.2° |
| N9 | C8 | C7 | N7 | 176.1° | 179.3° |
| C8 | N9 | C11 | C13 | 1.6° | 24.1° |
| N9 | C8 | C15 | H7 | 117.3° | 119.6° |
| N9 | C8 | C15 | C13 | 36.1° | 22.2° |
| N9 | C8 | C15 | H15 | 83.1° | 140.6° |
| N9 | C8 | C15 | H16 | 155.1° | 96.2° |
| C8 | N9 | C11 | H9 | 121.1° | 142.9° |
| C8 | N9 | C11 | H8 | 117.9° | 94.7° |
| C57 | C59 | C18 | H59 | 180.0° | 179.5° |
| C57 | C59 | C18 | C6 | 179.9° | 179.7° |
| C59 | C57 | C53 | H58 | 180.0° | 179.7° |
| C57 | C59 | C18 | C30 | 1.2° | 0.5° |
| C59 | C57 | C53 | C42 | 0.3° | 0.3° |
| C59 | C57 | C53 | H56 | 179.7° | 179.7° |
| C59 | C18 | C6 | C1 | 153.0° | 0.2° |
| C59 | C18 | C6 | C30 | 178.8° | 179.8° |
| C18 | C59 | C57 | C53 | 0.5° | 0.5° |
| C59 | C18 | C30 | C42 | 1.1° | 0.2° |
| C59 | C18 | C30 | H36 | 178.9° | 179.8° |
| C18 | C59 | C57 | H58 | 179.5° | 179.8° |
| C3 | N1 | C1 | C6 | 165.5° | 180.0° |
| N1 | C3 | C2 | H5 | 120.2° | 120.0° |
| N1 | C3 | C2 | H4 | 120.2° | 120.0° |
| N1 | C3 | C2 | C80 | 56.0° | 180.0° |
| C3 | N1 | C1 | H1 | 14.5° | 0.1° |
| N1 | C3 | C2 | H2 | 64.7° | 60.0° |
| N1 | C3 | C2 | H3 | 176.6° | 60.0° |
| N1 | C3 | H5 | H4 | 119.5° | 120.0° |
| N1 | C1 | C6 | H1 | 180.0° | 179.9° |
| N1 | C1 | C6 | C18 | 169.9° | 179.9° |
| C1 | N1 | C3 | C2 | 48.3° | 125.0° |
| C1 | N1 | C3 | H5 | 71.9° | 115.0° |
| C1 | N1 | C3 | H4 | 168.5° | 5.0° |
| C17 | C16 | C14 | H17 | 180.0° | 179.8° |
| C16 | C17 | C20 | H21 | 179.0° | 180.0° |
| C17 | C16 | C14 | H14 | 179.1° | 180.0° |
| C1 | C6 | C18 | C30 | 28.2° | 180.0° |
| C6 | C18 | C30 | C42 | 179.9° | 180.0° |
| C18 | C6 | C1 | H1 | 10.1° | 0.0° |
| C6 | C18 | C30 | H36 | 0.1° | 0.1° |
| C6 | C18 | C59 | H59 | 0.1° | 0.2° |
| C14 | C16 | C17 | H18 | 179.7° | 180.0° |
| C3 | C2 | C80 | H2 | 120.6° | 120.0° |
| C3 | C2 | C80 | H3 | 120.6° | 120.0° |
| C3 | C2 | C80 | C73 | 163.9° | 180.0° |
| C3 | C2 | H2 | H3 | 118.0° | 119.9° |
| C2 | C3 | H5 | H4 | 119.4° | 120.0° |
| C3 | C2 | C80 | H82 | 75.4° | 60.1° |
| C3 | C2 | C80 | H83 | 43.2° | 60.0° |
| C19 | C89 | N7 | C7 | 115.6° | 85.0° |
| C19 | C89 | N7 | C67 | 119.9° | 120.0° |
| C19 | C89 | N7 | H95 | 119.8° | 120.0° |
| C19 | C89 | C67 | H95 | 119.6° | 120.0° |
| C19 | C89 | C67 | N6 | 74.8° | 60.0° |
| C19 | C89 | C67 | O11 | 103.3° | 120.0° |
| C89 | C19 | C21 | H23 | 45.1° | 60.0° |
| C89 | C19 | C21 | H22 | 163.9° | 60.0° |
| C19 | C89 | N7 | HN71 | 64.5° | 95.0° |
| C89 | C19 | H19 | H20 | 117.7° | 120.0° |
| C7 | C8 | C15 | H7 | 120.9° | 121.0° |
| C8 | C7 | N7 | C89 | 178.6° | 180.0° |
| C7 | C8 | C15 | C13 | 85.8° | 141.6° |
| C7 | C8 | C15 | H15 | 155.1° | 100.0° |
| C7 | C8 | C15 | H16 | 33.3° | 23.2° |
| C8 | C7 | N7 | HN71 | 1.5° | 0.0° |
| N7 | C7 | C8 | C15 | 69.2° | 61.5° |
| C7 | N7 | C89 | HN71 | 180.0° | 180.0° |
| C7 | N7 | C89 | C67 | 124.5° | 155.0° |
| N7 | C7 | C8 | H7 | 51.8° | 59.6° |
| C7 | N7 | C89 | H95 | 4.2° | 35.0° |
| C26 | N12 | C27 | C52 | 179.2° | 180.0° |
| C26 | N12 | C27 | C28 | 116.0° | 71.2° |
| C26 | N12 | C52 | O20 | 9.5° | 1.2° |
| C26 | N12 | C52 | C55 | 165.0° | 178.7° |
| N12 | C26 | H28 | H29 | 119.4° | 120.1° |
| C26 | N12 | C27 | H31 | 5.0° | 48.8° |
| C26 | N12 | C27 | H30 | 123.1° | 168.8° |
| C57 | C53 | C42 | H56 | 180.0° | 180.0° |
| C57 | C53 | C42 | C30 | 0.4° | 0.0° |
| C57 | C53 | C42 | N3 | 178.0° | 180.0° |
| C53 | C57 | C59 | H59 | 179.5° | 180.0° |
| C11 | C13 | C15 | C8 | 37.1° | 35.5° |
| C11 | C13 | C15 | H12 | 118.9° | 118.1° |
| C11 | C13 | C15 | H13 | 118.9° | 118.1° |
| C11 | C13 | H12 | H13 | 123.2° | 123.9° |
| C11 | C13 | C15 | H15 | 82.0° | 153.9° |
| C11 | C13 | C15 | H16 | 156.2° | 82.9° |
| C13 | C11 | H9 | H8 | 121.4° | 122.3° |
| C18 | C30 | C42 | C53 | 0.3° | 0.0° |
| C18 | C30 | C42 | H36 | 180.0° | 179.9° |
| C18 | C30 | C42 | N3 | 178.8° | 180.0° |
| C30 | C18 | C59 | H59 | 178.8° | 180.0° |
| C8 | C15 | C13 | H15 | 119.1° | 118.3° |
| C8 | C15 | C13 | H16 | 119.1° | 118.4° |
| C8 | C15 | C13 | H12 | 81.8° | 82.5° |
| C8 | C15 | C13 | H13 | 156.0° | 153.6° |
| C8 | C15 | H15 | H16 | 122.6° | 123.2° |
| N7 | C89 | C67 | H95 | 120.9° | 120.0° |
| N7 | C89 | C67 | N6 | 165.7° | 180.0° |
| N7 | C89 | C67 | O11 | 16.1° | 0.0° |
| N7 | C89 | C19 | H19 | 55.4° | 55.0° |
| N7 | C89 | C19 | H20 | 174.0° | 175.0° |
| C89 | C67 | N6 | O11 | 178.1° | 180.0° |
| C89 | C67 | N6 | C34 | 170.0° | 180.0° |
| C89 | C67 | N6 | HN61 | 10.0° | 0.0° |
| C67 | C89 | N7 | HN71 | 55.4° | 25.0° |
| C67 | C89 | C19 | H19 | 64.3° | 65.0° |
| C67 | C89 | C19 | H20 | 54.3° | 55.0° |
| N13 | C33 | C31 | H40 | 120.7° | 120.0° |
| N13 | C33 | C31 | H39 | 120.7° | 119.9° |
| C33 | N13 | C37 | H212 | 180.0° | 179.9° |
| N13 | C33 | C31 | C28 | 85.2° | 180.0° |
| C33 | N13 | C37 | C39 | 30.0° | 179.9° |
| C33 | N13 | C37 | O17 | 153.9° | 0.1° |
| N13 | C33 | C31 | H38 | 35.4° | 60.0° |
| N13 | C33 | C31 | H37 | 154.2° | 59.9° |
| N13 | C33 | H40 | H39 | 118.0° | 120.0° |
| C33 | C31 | C28 | C27 | 79.3° | 180.0° |
| C31 | C33 | N13 | C37 | 59.3° | 180.0° |
| C33 | C31 | C28 | H38 | 120.6° | 120.0° |
| C33 | C31 | C28 | H37 | 120.6° | 120.0° |
| C33 | C31 | C28 | H32 | 160.3° | 60.0° |
| C33 | C31 | C28 | H33 | 41.2° | 59.9° |
| C31 | C33 | N13 | H212 | 120.8° | 0.1° |
| C33 | C31 | H38 | H37 | 118.3° | 120.0° |
| C31 | C33 | H40 | H39 | 117.9° | 120.0° |
| C53 | C42 | C30 | N3 | 178.5° | 180.0° |
| C53 | C42 | N3 | C54 | 20.0° | 145.3° |
| C53 | C42 | N3 | H113 | 160.0° | 34.7° |
| C53 | C42 | C30 | H36 | 179.7° | 180.0° |
| C42 | C53 | C57 | H58 | 179.7° | 180.0° |
| N12 | C27 | C28 | H31 | 121.0° | 120.0° |
| N12 | C27 | C28 | H30 | 120.9° | 120.0° |
| N12 | C27 | C28 | C31 | 158.1° | 180.0° |
| C27 | N12 | C52 | O20 | 171.4° | 178.8° |
| C27 | N12 | C52 | C55 | 14.2° | 1.2° |
| C27 | N12 | C26 | H28 | 161.5° | 34.6° |
| C27 | N12 | C26 | H29 | 41.9° | 154.6° |
| N12 | C27 | C28 | H32 | 81.4° | 60.0° |
| N12 | C27 | C28 | H33 | 37.7° | 60.0° |
| N12 | C27 | H31 | H30 | 117.0° | 120.0° |
| C28 | C27 | N12 | C52 | 64.8° | 108.8° |
| C27 | C28 | C31 | H32 | 120.4° | 120.0° |
| C27 | C28 | C31 | H33 | 120.4° | 120.0° |
| C27 | C28 | H32 | H33 | 118.8° | 120.0° |
| C28 | C27 | H31 | H30 | 117.1° | 120.0° |
| C27 | C28 | C31 | H38 | 160.1° | 60.0° |
| C27 | C28 | C31 | H37 | 41.3° | 60.0° |
| N12 | C52 | O20 | C55 | 174.5° | 179.9° |
| N12 | C52 | C55 | C63 | 54.5° | 31.6° |
| N12 | C52 | C55 | C58 | 130.2° | 148.7° |
| C52 | N12 | C26 | H28 | 19.3° | 145.4° |
| C52 | N12 | C26 | H29 | 138.9° | 25.4° |
| C52 | N12 | C27 | H31 | 174.2° | 131.2° |
| C52 | N12 | C27 | H30 | 56.1° | 11.2° |
| C30 | C42 | N3 | C54 | 161.6° | 34.6° |
| C30 | C42 | N3 | H113 | 18.4° | 145.4° |
| C30 | C42 | C53 | H56 | 179.6° | 180.0° |
| C2 | C80 | C73 | H82 | 120.7° | 119.9° |
| C2 | C80 | C73 | H83 | 120.7° | 120.1° |
| C2 | C80 | C73 | N14 | 172.8° | 175.0° |
| C80 | C2 | H2 | H3 | 118.0° | 120.1° |
| C80 | C2 | C3 | H5 | 176.2° | 60.0° |
| C80 | C2 | C3 | H4 | 64.2° | 60.0° |
| C2 | C80 | C73 | H71 | 52.5° | 55.1° |
| C2 | C80 | C73 | H72 | 66.9° | 65.0° |
| C2 | C80 | H82 | H83 | 117.8° | 120.0° |
| C13 | C15 | C8 | H7 | 153.3° | 97.4° |
| C15 | C13 | H12 | H13 | 123.2° | 123.9° |
| C13 | C15 | H15 | H16 | 122.5° | 123.2° |
| C15 | C13 | C11 | H9 | 143.7° | 155.9° |
| C15 | C13 | C11 | H8 | 95.4° | 81.8° |
| C42 | N3 | C54 | O18 | 0.9° | 4.5° |
| C42 | N3 | C54 | H113 | 180.0° | 180.0° |
| C42 | N3 | C54 | C90 | 178.3° | 175.4° |
| N3 | C42 | C30 | H36 | 1.1° | 0.1° |
| N3 | C42 | C53 | H56 | 2.0° | 0.1° |
| N13 | C37 | C39 | C50 | 0.4° | 0.3° |
| N13 | C37 | C39 | O17 | 175.8° | 180.0° |
| N13 | C37 | C39 | C41 | 177.0° | 180.0° |
| C37 | N13 | C33 | H40 | 61.4° | 60.0° |
| C37 | N13 | C33 | H39 | 179.9° | 60.1° |
| C67 | N6 | C34 | HN61 | 180.0° | 180.0° |
| C67 | N6 | C34 | C29 | 143.1° | 85.0° |
| C67 | N6 | C34 | C23 | 88.7° | 155.0° |
| C67 | N6 | C34 | H41 | 27.5° | 35.0° |
| N6 | C67 | C89 | H95 | 44.8° | 60.0° |
| O11 | C67 | N6 | C34 | 8.1° | 0.0° |
| O11 | C67 | N6 | HN61 | 171.9° | 180.0° |
| O11 | C67 | C89 | H95 | 137.1° | 120.0° |
| N6 | C34 | C29 | C23 | 124.6° | 120.0° |
| N6 | C34 | C29 | H41 | 116.4° | 120.0° |
| N6 | C34 | C29 | C32 | 177.7° | 65.0° |
| N6 | C34 | C23 | O15 | 33.1° | 0.0° |
| N6 | C34 | C23 | H41 | 116.9° | 120.0° |
| N6 | C34 | C23 | N4 | 149.0° | 180.0° |
| N6 | C34 | C29 | H35 | 61.1° | 55.0° |
| N6 | C34 | C29 | H34 | 56.5° | 175.0° |
| C31 | C28 | H32 | H33 | 118.8° | 120.0° |
| C31 | C28 | C27 | H31 | 37.2° | 60.0° |
| C31 | C28 | C27 | H30 | 80.9° | 60.0° |
| C28 | C31 | H38 | H37 | 118.2° | 120.0° |
| C28 | C31 | C33 | H40 | 154.1° | 60.0° |
| C28 | C31 | C33 | H39 | 35.4° | 60.1° |
| C48 | C50 | C39 | H52 | 180.0° | 179.4° |
| C50 | C48 | C46 | H49 | 180.0° | 179.6° |
| C48 | C50 | C39 | C37 | 175.3° | 179.7° |
| C48 | C50 | C39 | C41 | 2.2° | 0.6° |
| C50 | C48 | C46 | C44 | 0.9° | 0.4° |
| C50 | C48 | C46 | H46 | 179.1° | 179.7° |
| C39 | C50 | C48 | C46 | 0.6° | 0.7° |
| C50 | C39 | C37 | C41 | 177.4° | 179.7° |
| C50 | C39 | C37 | O17 | 176.2° | 179.7° |
| C50 | C39 | C41 | C44 | 2.3° | 0.3° |
| C50 | C39 | C41 | O16 | 177.9° | 179.8° |
| C39 | C50 | C48 | H49 | 179.4° | 179.7° |
| C48 | C46 | C44 | H46 | 180.0° | 179.9° |
| C48 | C46 | C44 | C41 | 0.8° | 0.1° |
| C48 | C46 | C44 | O14 | 179.0° | 180.0° |
| C46 | C48 | C50 | H52 | 179.4° | 180.0° |
| O20 | C52 | C55 | C63 | 120.2° | 148.4° |
| O20 | C52 | C55 | C58 | 55.2° | 31.4° |
| C52 | C55 | C63 | C58 | 175.5° | 179.8° |
| C52 | C55 | C63 | C62 | 176.3° | 179.7° |
| C52 | C55 | C58 | O19 | 2.2° | 0.0° |
| C52 | C55 | C58 | C60 | 177.6° | 180.0° |
| C52 | C55 | C63 | H62 | 3.7° | 0.0° |
| O5 | C77 | C82 | C85 | 51.0° | 67.1° |
| O5 | C77 | C82 | O25 | 177.4° | 179.1° |
| O5 | C77 | C82 | C86 | 71.2° | 52.7° |
| O5 | C77 | C82 | F1 | 169.4° | 173.2° |
| O5 | C77 | O25 | C69 | 6.9° | 1.6° |
| C76 | C71 | C69 | H70 | 120.7° | 120.0° |
| C76 | C71 | C69 | H69 | 120.7° | 119.9° |
| C76 | C71 | C69 | O25 | 70.3° | 64.9° |
| C76 | C71 | C69 | C65 | 167.0° | 176.2° |
| C76 | C71 | C69 | H67 | 47.7° | 56.3° |
| C76 | C71 | H70 | H69 | 117.7° | 120.0° |
| C71 | C76 | H78 | H77 | 120.0° | 120.0° |
| C71 | C76 | H78 | H76 | 120.0° | 120.0° |
| C71 | C76 | H77 | H76 | 120.0° | 120.0° |
| C85 | C82 | C86 | O6 | 45.4° | 46.1° |
| C85 | C82 | C77 | C86 | 122.2° | 119.8° |
| C85 | C82 | C77 | F1 | 118.4° | 119.7° |
| C85 | C82 | C77 | O25 | 126.4° | 113.7° |
| C85 | C82 | C86 | F1 | 118.1° | 120.2° |
| C85 | C82 | C86 | C88 | 132.0° | 133.4° |
| C82 | C85 | H91 | H90 | 120.0° | 120.0° |
| C82 | C85 | H91 | H92 | 120.0° | 120.0° |
| C82 | C85 | H90 | H92 | 120.0° | 120.1° |
| C80 | C73 | N14 | H71 | 120.3° | 120.0° |
| C80 | C73 | N14 | H72 | 120.3° | 120.0° |
| C80 | C73 | N14 | C72 | 77.6° | 85.0° |
| C80 | C73 | N14 | C68 | 83.7° | 92.8° |
| C73 | C80 | C2 | H2 | 43.3° | 60.1° |
| C73 | C80 | C2 | H3 | 75.4° | 60.0° |
| C80 | C73 | H71 | H72 | 119.0° | 120.0° |
| C73 | C80 | H82 | H83 | 117.8° | 120.0° |
| C55 | C63 | C62 | H62 | 180.0° | 179.7° |
| C55 | C63 | C62 | C61 | 0.6° | 0.6° |
| C63 | C55 | C58 | O19 | 177.6° | 179.7° |
| C63 | C55 | C58 | C60 | 2.2° | 0.2° |
| C55 | C63 | C62 | H61 | 179.4° | 179.7° |
| C62 | C63 | C55 | C58 | 0.8° | 0.5° |
| C63 | C62 | C61 | H61 | 180.0° | 179.8° |
| C63 | C62 | C61 | C60 | 0.6° | 0.3° |
| C63 | C62 | C61 | H60 | 179.4° | 179.8° |
| C37 | C39 | C41 | C44 | 175.3° | 179.9° |
| C37 | C39 | C41 | O16 | 4.6° | 0.1° |
| C39 | C37 | N13 | H212 | 149.9° | 0.0° |
| C37 | C39 | C50 | H52 | 4.7° | 0.3° |
| O17 | C37 | C39 | C41 | 1.2° | 0.0° |
| O17 | C37 | N13 | H212 | 26.2° | 180.0° |
| O18 | C54 | N3 | C90 | 179.2° | 180.0° |
| O18 | C54 | C90 | N4 | 96.0° | 0.0° |
| O18 | C54 | C90 | C47 | 29.8° | 120.0° |
| O18 | C54 | N3 | H113 | 179.1° | 175.5° |
| O18 | C54 | C90 | H96 | 146.8° | 120.0° |
| N3 | C54 | C90 | N4 | 83.2° | 180.0° |
| N3 | C54 | C90 | C47 | 151.0° | 60.0° |
| N3 | C54 | C90 | H96 | 34.0° | 60.0° |
| C39 | C41 | C44 | C46 | 0.9° | 0.1° |
| C39 | C41 | C44 | O16 | 179.9° | 179.9° |
| C39 | C41 | C44 | O14 | 179.4° | 180.0° |
| C39 | C41 | O16 | H812 | 4.5° | 90.1° |
| C41 | C39 | C50 | H52 | 177.8° | 180.0° |
| O6 | C86 | C82 | C77 | 76.9° | 73.4° |
| O6 | C86 | C82 | C88 | 177.4° | 179.5° |
| O6 | C86 | C82 | F1 | 163.5° | 166.4° |
| O6 | C86 | C88 | C92 | 93.5° | 65.9° |
| O6 | C86 | C88 | C91 | 33.4° | 53.8° |
| O6 | C86 | C88 | H94 | 150.7° | 173.8° |
| C34 | C29 | C32 | H35 | 121.2° | 120.0° |
| C34 | C29 | C32 | H34 | 121.2° | 120.0° |
| C29 | C34 | C23 | O15 | 157.2° | 120.0° |
| C29 | C34 | C23 | H41 | 119.1° | 120.0° |
| C29 | C34 | C23 | N4 | 24.9° | 60.0° |
| C34 | C29 | C32 | C35 | 132.2° | 89.7° |
| C34 | C29 | C32 | C43 | 45.7° | 90.0° |
| C29 | C34 | N6 | HN61 | 36.9° | 95.0° |
| C34 | C29 | H35 | H34 | 116.3° | 120.0° |
| C32 | C29 | C34 | C23 | 57.7° | 175.0° |
| C29 | C32 | C35 | C43 | 177.9° | 179.7° |
| C29 | C32 | C35 | C36 | 176.9° | 180.0° |
| C29 | C32 | C43 | C40 | 176.3° | 179.7° |
| C32 | C29 | H35 | H34 | 116.3° | 120.0° |
| C32 | C29 | C34 | H41 | 61.4° | 55.0° |
| C29 | C32 | C35 | H42 | 3.1° | 0.0° |
| C29 | C32 | C43 | H45 | 3.8° | 0.0° |
| C46 | C44 | C41 | O14 | 179.7° | 180.0° |
| C46 | C44 | C41 | O16 | 179.3° | 179.9° |
| C46 | C44 | O14 | H712 | 180.0° | 90.0° |
| C44 | C46 | C48 | H49 | 179.1° | 180.0° |
| O15 | C23 | C34 | N4 | 177.9° | 180.0° |
| O15 | C23 | N4 | C90 | 2.4° | 0.0° |
| O15 | C23 | N4 | H114 | 177.6° | 180.0° |
| O15 | C23 | C34 | H41 | 83.8° | 120.0° |
| C34 | C23 | N4 | C90 | 175.4° | 180.0° |
| C34 | C23 | N4 | H114 | 4.5° | 0.0° |
| C23 | C34 | N6 | HN61 | 91.3° | 25.0° |
| C23 | C34 | C29 | H35 | 63.4° | 65.0° |
| C23 | C34 | C29 | H34 | 178.9° | 55.0° |
| C55 | C58 | O19 | C60 | 179.8° | 180.0° |
| C55 | C58 | C60 | C61 | 2.2° | 0.1° |
| C55 | C58 | C60 | O12 | 177.2° | 180.0° |
| C55 | C58 | O19 | H912 | 19.3° | 90.0° |
| C58 | C55 | C63 | H62 | 179.2° | 179.8° |
| C54 | C90 | N4 | C23 | 66.8° | 155.0° |
| C54 | C90 | N4 | C47 | 129.3° | 119.9° |
| C54 | C90 | N4 | H96 | 116.7° | 120.0° |
| C54 | C90 | C47 | H96 | 117.0° | 120.0° |
| C54 | C90 | C47 | C49 | 54.2° | 175.0° |
| C90 | C54 | N3 | H113 | 1.7° | 4.6° |
| C54 | C90 | N4 | H114 | 113.2° | 25.0° |
| C54 | C90 | C47 | H48 | 66.6° | 65.0° |
| C54 | C90 | C47 | H47 | 174.9° | 55.0° |
| C77 | C82 | C86 | F1 | 119.7° | 120.3° |
| C77 | C82 | C86 | C88 | 105.7° | 107.2° |
| C82 | C77 | O25 | C69 | 170.4° | 177.5° |
| C77 | C82 | C85 | H91 | 180.0° | 60.0° |
| C77 | C82 | C85 | H90 | 60.0° | 180.0° |
| C77 | C82 | C85 | H92 | 60.0° | 60.0° |
| O25 | C77 | C82 | C86 | 111.4° | 126.5° |
| O25 | C77 | C82 | F1 | 8.0° | 5.9° |
| C77 | O25 | C69 | C71 | 99.8° | 109.0° |
| C77 | O25 | C69 | C65 | 134.1° | 131.6° |
| C77 | O25 | C69 | H67 | 17.1° | 12.0° |
| C23 | N4 | C90 | H114 | 180.0° | 180.0° |
| C23 | N4 | C90 | C47 | 163.9° | 85.0° |
| N4 | C23 | C34 | H41 | 94.2° | 60.0° |
| C23 | N4 | C90 | H96 | 49.8° | 35.0° |
| C82 | C86 | C88 | C92 | 83.9° | 113.6° |
| C82 | C86 | C88 | C91 | 149.1° | 126.7° |
| C86 | C82 | C85 | H91 | 59.0° | 180.0° |
| C86 | C82 | C85 | H90 | 61.0° | 60.1° |
| C86 | C82 | C85 | H92 | 179.0° | 60.0° |
| C82 | C86 | C88 | H94 | 31.9° | 6.7° |
| F1 | C82 | C86 | C88 | 13.9° | 13.1° |
| F1 | C82 | C85 | H91 | 60.2° | 59.6° |
| F1 | C82 | C85 | H90 | 179.8° | 60.4° |
| F1 | C82 | C85 | H92 | 59.8° | 179.6° |
| C62 | C61 | C60 | C58 | 0.8° | 0.0° |
| C62 | C61 | C60 | H60 | 180.0° | 179.9° |
| C62 | C61 | C60 | O12 | 178.6° | 179.9° |
| C61 | C62 | C63 | H62 | 179.4° | 179.8° |
| C71 | C69 | O25 | C65 | 126.1° | 119.4° |
| C71 | C69 | O25 | H67 | 117.0° | 121.0° |
| C71 | C69 | C65 | H67 | 119.4° | 120.3° |
| C71 | C69 | C65 | O24 | 57.3° | 31.7° |
| C71 | C69 | C65 | C68 | 167.5° | 145.4° |
| C71 | C69 | C65 | C64 | 60.4° | 87.8° |
| C69 | C71 | H70 | H69 | 117.8° | 120.0° |
| C69 | C71 | C76 | H78 | 180.0° | 180.0° |
| C69 | C71 | C76 | H77 | 60.0° | 60.0° |
| C69 | C71 | C76 | H76 | 60.0° | 60.1° |
| C41 | C44 | O14 | H712 | 0.3° | 90.0° |
| C44 | C41 | O16 | H812 | 175.3° | 90.0° |
| C41 | C44 | C46 | H46 | 179.2° | 180.0° |
| O16 | C41 | C44 | O14 | 0.5° | 0.1° |
| C86 | C88 | C92 | C91 | 126.8° | 120.0° |
| C86 | C88 | C92 | H94 | 115.8° | 120.1° |
| C86 | C88 | C91 | H94 | 117.3° | 120.1° |
| C86 | C88 | C91 | C87 | 83.5° | 122.5° |
| C86 | C88 | C91 | O8 | 155.7° | 118.0° |
| C86 | C88 | C91 | H97 | 36.4° | 2.6° |
| C86 | C88 | C92 | H99 | 180.0° | 60.0° |
| C86 | C88 | C92 | H98 | 60.0° | 180.0° |
| C86 | C88 | C92 | H010 | 60.0° | 60.0° |
| C73 | N14 | C72 | O2 | 25.7° | 10.0° |
| C73 | N14 | C72 | C68 | 163.6° | 178.1° |
| C73 | N14 | C72 | O24 | 152.3° | 168.6° |
| C73 | N14 | C68 | C65 | 138.1° | 165.9° |
| C73 | N14 | C68 | C70 | 95.8° | 68.8° |
| C73 | N14 | C68 | H66 | 24.6° | 51.0° |
| N14 | C73 | H71 | H72 | 119.0° | 120.1° |
| N14 | C73 | C80 | H82 | 66.5° | 55.1° |
| N14 | C73 | C80 | H83 | 52.1° | 64.9° |
| O14 | C44 | C46 | H46 | 1.0° | 0.0° |
| C93 | O7 | C87 | C91 | 82.7° | 102.2° |
| C93 | O7 | C87 | C84 | 152.1° | 138.5° |
| C93 | O7 | C87 | H93 | 35.7° | 16.2° |
| O7 | C93 | HC86 | H310 | 120.0° | 120.0° |
| O7 | C93 | HC86 | H210 | 120.0° | 120.0° |
| O7 | C93 | H310 | H210 | 120.0° | 120.1° |
| C32 | C35 | C36 | H42 | 180.0° | 180.0° |
| C32 | C35 | C36 | C38 | 0.3° | 0.0° |
| C35 | C32 | C43 | C40 | 1.6° | 0.6° |
| C35 | C32 | C29 | H35 | 11.0° | 30.3° |
| C35 | C32 | C29 | H34 | 106.6° | 150.3° |
| C32 | C35 | C36 | H43 | 179.7° | 180.0° |
| C35 | C32 | C43 | H45 | 178.4° | 179.7° |
| C36 | C35 | C32 | C43 | 0.9° | 0.3° |
| C35 | C36 | C38 | H43 | 180.0° | 179.9° |
| C35 | C36 | C38 | C40 | 0.9° | 0.1° |
| C35 | C36 | C38 | O13 | 179.2° | 180.0° |
| N4 | C90 | C47 | H96 | 114.7° | 120.1° |
| N4 | C90 | C47 | C49 | 177.5° | 65.0° |
| N4 | C90 | C47 | H48 | 61.8° | 55.0° |
| N4 | C90 | C47 | H47 | 56.7° | 175.0° |
| O25 | C69 | C65 | H67 | 118.1° | 120.2° |
| O25 | C69 | C65 | O24 | 179.8° | 151.2° |
| O25 | C69 | C65 | C68 | 70.0° | 95.1° |
| O25 | C69 | C65 | C64 | 62.1° | 31.7° |
| O25 | C69 | C71 | H70 | 50.5° | 175.0° |
| O25 | C69 | C71 | H69 | 169.0° | 55.0° |
| C69 | C65 | O24 | C72 | 92.1° | 111.7° |
| C69 | C65 | C68 | N14 | 86.6° | 106.7° |
| C69 | C65 | O24 | C68 | 116.7° | 117.4° |
| C69 | C65 | O24 | C64 | 120.8° | 119.6° |
| C69 | C65 | C68 | C64 | 129.6° | 123.6° |
| C69 | C65 | C68 | C70 | 150.0° | 130.0° |
| C69 | C65 | C64 | H63 | 180.0° | 178.3° |
| C69 | C65 | C64 | H65 | 60.0° | 61.7° |
| C69 | C65 | C64 | H64 | 60.0° | 58.2° |
| C69 | C65 | C68 | H66 | 27.8° | 7.4° |
| C65 | C69 | C71 | H70 | 72.2° | 56.1° |
| C65 | C69 | C71 | H69 | 46.3° | 63.9° |
| C32 | C43 | C40 | H45 | 180.0° | 179.7° |
| C32 | C43 | C40 | C38 | 1.0° | 0.5° |
| C43 | C32 | C29 | H35 | 166.8° | 150.0° |
| C43 | C32 | C29 | H34 | 75.5° | 30.0° |
| C43 | C32 | C35 | H42 | 179.1° | 179.7° |
| C32 | C43 | C40 | H44 | 179.0° | 179.7° |
| O2 | C72 | N14 | O24 | 178.0° | 178.6° |
| O2 | C72 | N14 | C68 | 170.7° | 171.8° |
| O2 | C72 | O24 | C65 | 168.6° | 179.2° |
| C90 | C47 | C49 | H48 | 120.7° | 120.0° |
| C90 | C47 | C49 | H47 | 120.7° | 120.0° |
| C90 | C47 | C49 | S1 | 153.6° | 180.0° |
| C47 | C90 | N4 | H114 | 16.1° | 95.0° |
| C90 | C47 | H48 | H47 | 117.8° | 120.0° |
| C90 | C47 | C49 | H50 | 32.9° | 60.0° |
| C90 | C47 | C49 | H51 | 85.7° | 60.0° |
| O19 | C58 | C60 | C61 | 177.6° | 180.0° |
| O19 | C58 | C60 | O12 | 3.0° | 0.1° |
| C58 | C60 | C61 | O12 | 179.4° | 179.9° |
| C58 | C60 | O12 | H512 | 180.0° | 90.0° |
| C60 | C58 | O19 | H912 | 160.5° | 90.0° |
| C58 | C60 | C61 | H60 | 179.2° | 179.9° |
| N14 | C72 | O24 | C65 | 9.7° | 2.2° |
| C72 | N14 | C68 | C65 | 25.1° | 12.2° |
| C72 | N14 | C68 | C70 | 101.0° | 113.1° |
| C72 | N14 | C68 | H66 | 138.6° | 127.0° |
| C72 | N14 | C73 | H71 | 42.8° | 155.1° |
| C72 | N14 | C73 | H72 | 162.1° | 35.0° |
| O24 | C72 | N14 | C68 | 11.3° | 9.5° |
| C72 | O24 | C65 | C68 | 24.6° | 5.7° |
| C72 | O24 | C65 | C64 | 147.2° | 128.7° |
| N14 | C68 | C65 | O24 | 28.2° | 10.5° |
| N14 | C68 | C65 | C70 | 123.4° | 123.4° |
| N14 | C68 | C65 | H66 | 114.4° | 114.0° |
| N14 | C68 | C65 | C64 | 143.8° | 129.7° |
| N14 | C68 | C70 | H66 | 121.2° | 119.1° |
| N14 | C68 | C70 | C75 | 83.8° | 90.6° |
| N14 | C68 | C70 | C74 | 45.0° | 29.9° |
| N14 | C68 | C70 | H68 | 161.3° | 151.3° |
| C68 | N14 | C73 | H71 | 156.0° | 27.2° |
| C68 | N14 | C73 | H72 | 36.6° | 147.2° |
| C61 | C60 | O12 | H512 | 0.6° | 90.1° |
| C60 | C61 | C62 | H61 | 179.4° | 180.0° |
| O7 | C87 | C91 | C88 | 56.2° | 73.9° |
| O7 | C87 | C91 | C84 | 121.4° | 119.7° |
| O7 | C87 | C91 | H93 | 119.4° | 119.4° |
| O7 | C87 | C91 | O8 | 178.2° | 45.7° |
| O7 | C87 | C84 | H93 | 117.4° | 121.9° |
| O7 | C87 | C84 | C81 | 72.1° | 92.6° |
| O7 | C87 | C84 | H89 | 167.1° | 28.6° |
| O7 | C87 | C84 | H88 | 48.8° | 147.1° |
| O7 | C87 | C91 | H97 | 63.6° | 166.0° |
| C87 | O7 | C93 | HC86 | 180.0° | 61.5° |
| C87 | O7 | C93 | H310 | 60.0° | 178.5° |
| C87 | O7 | C93 | H210 | 60.0° | 58.4° |
| C36 | C38 | C40 | C43 | 0.2° | 0.2° |
| C36 | C38 | C40 | O13 | 179.9° | 180.0° |
| C36 | C38 | O13 | HO13 | 180.0° | 89.9° |
| C38 | C36 | C35 | H42 | 179.7° | 180.0° |
| C36 | C38 | C40 | H44 | 179.8° | 180.0° |
| O24 | C65 | C68 | C64 | 115.6° | 119.2° |
| O24 | C65 | C68 | C70 | 95.2° | 112.9° |
| O24 | C65 | C64 | H63 | 61.5° | 58.5° |
| O24 | C65 | C64 | H65 | 178.5° | 178.6° |
| O24 | C65 | C64 | H64 | 58.5° | 61.5° |
| O24 | C65 | C68 | H66 | 142.6° | 124.5° |
| O24 | C65 | C69 | H67 | 62.1° | 88.6° |
| C92 | C88 | C91 | H94 | 117.5° | 120.1° |
| C92 | C88 | C91 | C87 | 151.4° | 117.7° |
| C92 | C88 | C91 | O8 | 30.6° | 1.8° |
| C92 | C88 | C91 | H97 | 88.8° | 122.4° |
| C88 | C92 | H99 | H98 | 120.0° | 120.0° |
| C88 | C92 | H99 | H010 | 120.0° | 120.0° |
| C88 | C92 | H98 | H010 | 120.0° | 120.0° |
| C88 | C91 | C87 | O8 | 122.0° | 119.6° |
| C88 | C91 | C87 | H97 | 119.8° | 120.1° |
| C88 | C91 | O8 | H97 | 118.3° | 120.4° |
| C88 | C91 | C87 | C84 | 65.1° | 166.4° |
| C88 | C91 | O8 | C94 | 114.5° | 89.9° |
| C88 | C91 | C87 | H93 | 175.6° | 45.5° |
| C91 | C88 | C92 | H99 | 53.2° | 179.9° |
| C91 | C88 | C92 | H98 | 66.8° | 60.0° |
| C91 | C88 | C92 | H010 | 173.2° | 60.1° |
| C47 | C49 | S1 | H50 | 120.7° | 120.0° |
| C47 | C49 | S1 | H51 | 120.7° | 120.0° |
| C47 | C49 | S1 | C51 | 59.2° | 180.0° |
| C49 | C47 | H48 | H47 | 117.7° | 120.0° |
| C47 | C49 | H50 | H51 | 117.7° | 120.0° |
| C49 | C47 | C90 | H96 | 62.8° | 55.0° |
| C65 | C68 | C70 | H66 | 122.4° | 122.5° |
| C65 | C68 | C70 | C75 | 159.8° | 151.0° |
| C65 | C68 | C70 | C74 | 71.4° | 88.5° |
| C68 | C65 | C64 | H63 | 50.8° | 57.8° |
| C68 | C65 | C64 | H65 | 69.2° | 62.2° |
| C68 | C65 | C64 | H64 | 170.8° | 177.8° |
| C68 | C65 | C69 | H67 | 48.0° | 25.1° |
| C65 | C68 | C70 | H68 | 44.9° | 32.9° |
| C64 | C65 | C68 | C70 | 20.4° | 6.3° |
| C65 | C64 | H63 | H65 | 120.0° | 120.0° |
| C65 | C64 | H63 | H64 | 120.0° | 119.9° |
| C65 | C64 | H65 | H64 | 120.0° | 119.9° |
| C64 | C65 | C68 | H66 | 101.8° | 116.3° |
| C64 | C65 | C69 | H67 | 179.8° | 151.9° |
| O12 | C60 | C61 | H60 | 1.4° | 0.0° |
| C43 | C40 | C38 | H44 | 180.0° | 179.7° |
| C43 | C40 | C38 | O13 | 179.8° | 179.8° |
| C68 | C70 | C75 | O3 | 63.4° | 23.0° |
| C68 | C70 | C75 | C74 | 131.6° | 120.9° |
| C68 | C70 | C75 | H68 | 114.7° | 120.9° |
| C68 | C70 | C74 | H68 | 116.2° | 122.7° |
| C68 | C70 | C75 | C81 | 118.1° | 156.4° |
| C68 | C70 | C74 | H040 | 180.0° | 56.0° |
| C68 | C70 | C74 | H74 | 60.0° | 176.1° |
| C68 | C70 | C74 | H73 | 60.0° | 64.0° |
| C87 | C91 | O8 | H97 | 117.2° | 120.1° |
| C91 | C87 | C84 | H93 | 119.2° | 119.5° |
| C87 | C91 | O8 | C94 | 121.0° | 150.6° |
| C91 | C87 | C84 | C81 | 164.6° | 148.8° |
| C91 | C87 | C84 | H89 | 43.7° | 90.0° |
| C91 | C87 | C84 | H88 | 74.6° | 28.4° |
| C87 | C91 | C88 | H94 | 33.9° | 2.4° |
| O8 | C91 | C87 | C84 | 56.9° | 74.0° |
| C91 | O8 | C94 | O9 | 76.2° | 65.0° |
| C91 | O8 | C94 | C95 | 164.9° | 175.0° |
| O8 | C91 | C87 | H93 | 62.4° | 165.1° |
| O8 | C91 | C88 | H94 | 87.0° | 121.9° |
| C91 | O8 | C94 | H410 | 45.5° | 55.0° |
| C99 | C97 | O9 | C98 | 123.3° | 119.9° |
| C99 | C97 | O9 | H710 | 117.7° | 120.1° |
| C99 | C97 | C98 | H710 | 118.3° | 120.0° |
| C99 | C97 | O9 | C94 | 175.4° | 178.9° |
| C99 | C97 | C98 | C96 | 167.1° | 177.6° |
| C99 | C97 | C98 | H910 | 46.3° | 62.5° |
| C99 | C97 | C98 | H810 | 72.0° | 57.7° |
| C97 | C99 | H011 | H111 | 120.0° | 120.0° |
| C97 | C99 | H011 | H211 | 120.0° | 120.0° |
| C97 | C99 | H111 | H211 | 120.0° | 120.0° |
| O9 | C97 | C98 | H710 | 119.9° | 120.0° |
| C97 | O9 | C94 | O8 | 173.4° | 178.9° |
| C97 | O9 | C94 | C95 | 68.5° | 61.1° |
| O9 | C97 | C98 | C96 | 45.3° | 57.6° |
| C97 | O9 | C94 | H410 | 51.7° | 58.8° |
| O9 | C97 | C98 | H910 | 75.5° | 177.5° |
| O9 | C97 | C98 | H810 | 166.1° | 62.3° |
| O9 | C97 | C99 | H011 | 180.0° | 60.0° |
| O9 | C97 | C99 | H111 | 60.0° | 180.0° |
| O9 | C97 | C99 | H211 | 60.0° | 59.9° |
| C98 | C97 | O9 | C94 | 61.3° | 61.2° |
| C97 | C98 | C96 | H910 | 120.8° | 119.9° |
| C97 | C98 | C96 | H810 | 120.8° | 120.0° |
| C97 | C98 | C96 | C95 | 37.5° | 57.0° |
| C97 | C98 | C96 | N15 | 170.6° | 176.9° |
| C97 | C98 | C96 | HC96 | 75.9° | 62.9° |
| C97 | C98 | H910 | H810 | 117.5° | 120.2° |
| C98 | C97 | C99 | H011 | 56.8° | 179.9° |
| C98 | C97 | C99 | H111 | 63.2° | 60.1° |
| C98 | C97 | C99 | H211 | 176.8° | 60.0° |
| S1 | C49 | C47 | H48 | 85.6° | 60.0° |
| S1 | C49 | C47 | H47 | 32.9° | 60.0° |
| S1 | C49 | H50 | H51 | 117.7° | 120.0° |
| C49 | S1 | C51 | H53 | 180.0° | 180.0° |
| C49 | S1 | C51 | H55 | 60.0° | 60.0° |
| C49 | S1 | C51 | H54 | 60.0° | 60.0° |
| C87 | C84 | C81 | C75 | 68.4° | 81.7° |
| C87 | C84 | C81 | H89 | 120.8° | 121.1° |
| C87 | C84 | C81 | H88 | 120.9° | 120.5° |
| C87 | C84 | C81 | C83 | 162.9° | 43.8° |
| C87 | C84 | C81 | H84 | 47.8° | 161.1° |
| C87 | C84 | H89 | H88 | 117.4° | 118.7° |
| C84 | C87 | C91 | H97 | 175.1° | 46.4° |
| O9 | C94 | O8 | C95 | 118.9° | 119.9° |
| O9 | C94 | O8 | H410 | 121.7° | 120.0° |
| O9 | C94 | C95 | H410 | 121.4° | 119.9° |
| O9 | C94 | C95 | C96 | 57.9° | 57.5° |
| O9 | C94 | C95 | O10 | 180.0° | 177.5° |
| O9 | C94 | C95 | H510 | 60.6° | 62.4° |
| C94 | O9 | C97 | H710 | 57.7° | 58.8° |
| C40 | C38 | O13 | HO13 | 0.1° | 90.0° |
| C40 | C38 | C36 | H43 | 179.1° | 180.0° |
| C38 | C40 | C43 | H45 | 179.0° | 179.7° |
| O13 | C38 | C36 | H43 | 0.8° | 0.0° |
| O13 | C38 | C40 | H44 | 0.1° | 0.0° |
| O8 | C94 | C95 | H410 | 120.7° | 120.1° |
| O8 | C94 | C95 | C96 | 175.8° | 177.6° |
| O8 | C94 | C95 | O10 | 62.1° | 62.5° |
| C94 | O8 | C91 | H97 | 3.8° | 30.5° |
| O8 | C94 | C95 | H510 | 57.4° | 57.6° |
| C94 | C95 | C96 | C98 | 42.7° | 57.0° |
| C94 | C95 | C96 | O10 | 120.6° | 119.9° |
| C94 | C95 | C96 | H510 | 118.7° | 119.9° |
| C94 | C95 | C96 | N15 | 170.5° | 176.9° |
| C94 | C95 | O10 | H510 | 118.4° | 120.1° |
| C94 | C95 | O10 | H412 | 180.0° | 59.9° |
| C94 | C95 | C96 | HC96 | 70.9° | 63.0° |
| O3 | C75 | C70 | C81 | 178.5° | 179.4° |
| O3 | C75 | C70 | C74 | 68.2° | 97.9° |
| O3 | C75 | C81 | C84 | 112.3° | 64.3° |
| O3 | C75 | C81 | C83 | 119.1° | 171.3° |
| O3 | C75 | C70 | H68 | 178.1° | 143.9° |
| O3 | C75 | C81 | H84 | 3.9° | 52.7° |
| C98 | C96 | C95 | N15 | 127.7° | 119.9° |
| C98 | C96 | C95 | HC96 | 113.6° | 120.0° |
| C98 | C96 | N15 | HC96 | 113.0° | 120.3° |
| C98 | C96 | C95 | O10 | 163.4° | 176.9° |
| C98 | C96 | N15 | C110 | 73.2° | 70.4° |
| C98 | C96 | N15 | C100 | 162.8° | 53.5° |
| C98 | C96 | C95 | H510 | 75.9° | 63.0° |
| C96 | C98 | C97 | H710 | 74.6° | 62.4° |
| C96 | C98 | H910 | H810 | 117.5° | 120.1° |
| C75 | C70 | C74 | H68 | 113.7° | 116.9° |
| C70 | C75 | C81 | C84 | 69.2° | 115.1° |
| C70 | C75 | C81 | C83 | 59.4° | 9.3° |
| C75 | C70 | C68 | H66 | 37.4° | 28.5° |
| C75 | C70 | C74 | H040 | 49.9° | 64.4° |
| C75 | C70 | C74 | H74 | 169.9° | 55.7° |
| C75 | C70 | C74 | H73 | 70.1° | 175.6° |
| C70 | C75 | C81 | H84 | 174.6° | 127.9° |
| C74 | C70 | C75 | C81 | 110.3° | 82.7° |
| C74 | C70 | C68 | H66 | 166.3° | 148.9° |
| C70 | C74 | H040 | H74 | 120.0° | 120.0° |
| C70 | C74 | H040 | H73 | 120.0° | 120.0° |
| C70 | C74 | H74 | H73 | 120.0° | 119.9° |
| C75 | C81 | C84 | C83 | 128.7° | 125.5° |
| C75 | C81 | C84 | H84 | 116.2° | 117.2° |
| C75 | C81 | C83 | H84 | 115.3° | 118.7° |
| C81 | C75 | C70 | H68 | 3.3° | 35.5° |
| C75 | C81 | C83 | H86 | 180.0° | 66.0° |
| C75 | C81 | C83 | H85 | 60.0° | 174.0° |
| C75 | C81 | C83 | H87 | 60.0° | 54.0° |
| C75 | C81 | C84 | H89 | 170.8° | 157.2° |
| C75 | C81 | C84 | H88 | 52.4° | 38.7° |
| C51 | S1 | C49 | H50 | 180.0° | 60.0° |
| C51 | S1 | C49 | H51 | 61.5° | 60.0° |
| S1 | C51 | H53 | H55 | 120.0° | 120.0° |
| S1 | C51 | H53 | H54 | 120.0° | 120.0° |
| S1 | C51 | H55 | H54 | 120.0° | 120.0° |
| C84 | C81 | C83 | H84 | 115.1° | 117.2° |
| C84 | C81 | C83 | H86 | 50.4° | 169.9° |
| C84 | C81 | C83 | H85 | 69.6° | 49.8° |
| C84 | C81 | C83 | H87 | 170.4° | 70.1° |
| C81 | C84 | H89 | H88 | 117.4° | 118.6° |
| C81 | C84 | C87 | H93 | 45.4° | 29.3° |
| C95 | C96 | N15 | HC96 | 118.2° | 120.1° |
| C96 | C95 | O10 | H510 | 119.5° | 120.1° |
| C95 | C96 | N15 | C110 | 158.1° | 170.0° |
| C95 | C96 | N15 | C100 | 34.0° | 66.1° |
| C96 | C95 | O10 | H412 | 57.9° | 179.7° |
| C96 | C95 | C94 | H410 | 63.5° | 62.4° |
| C95 | C96 | C98 | H910 | 83.3° | 176.9° |
| C95 | C96 | C98 | H810 | 158.4° | 63.0° |
| N15 | C96 | C95 | O10 | 68.9° | 63.2° |
| C96 | N15 | C110 | C100 | 129.0° | 123.9° |
| C96 | N15 | C100 | H213 | 180.0° | 180.0° |
| C96 | N15 | C100 | H013 | 60.0° | 60.0° |
| C96 | N15 | C100 | HC10 | 60.0° | 60.0° |
| C96 | N15 | C110 | H413 | 180.0° | 63.9° |
| C96 | N15 | C110 | H513 | 60.0° | 56.1° |
| C96 | N15 | C110 | H313 | 60.0° | 176.0° |
| N15 | C96 | C95 | H510 | 51.8° | 56.9° |
| N15 | C96 | C98 | H910 | 49.8° | 63.2° |
| N15 | C96 | C98 | H810 | 68.6° | 56.9° |
| O10 | C95 | C94 | H410 | 58.6° | 57.6° |
| O10 | C95 | C96 | HC96 | 49.8° | 56.9° |
| C110 | N15 | C100 | H213 | 53.6° | 56.1° |
| C110 | N15 | C100 | H013 | 66.4° | 176.1° |
| C110 | N15 | C100 | HC10 | 173.7° | 63.9° |
| N15 | C110 | H413 | H513 | 120.0° | 120.0° |
| N15 | C110 | H413 | H313 | 120.0° | 120.0° |
| N15 | C110 | H513 | H313 | 120.0° | 119.9° |
| C110 | N15 | C96 | HC96 | 39.9° | 49.9° |
| C81 | C83 | H86 | H85 | 120.0° | 120.0° |
| C81 | C83 | H86 | H87 | 120.0° | 120.0° |
| C81 | C83 | H85 | H87 | 120.0° | 120.0° |
| C83 | C81 | C84 | H89 | 42.1° | 77.3° |
| C83 | C81 | C84 | H88 | 76.2° | 164.3° |
| N15 | C100 | H213 | H013 | 120.0° | 120.0° |
| N15 | C100 | H213 | HC10 | 120.0° | 120.0° |
| N15 | C100 | H013 | HC10 | 120.0° | 120.0° |
| C100 | N15 | C110 | H413 | 51.0° | 60.0° |
| C100 | N15 | C110 | H513 | 171.0° | 180.0° |
| C100 | N15 | C110 | H313 | 69.0° | 60.0° |
| C100 | N15 | C96 | HC96 | 84.2° | 173.8° |
| HC5 | C5 | N8 | H128 | 0.8° | 0.0° |
| H7 | C8 | C15 | H15 | 34.2° | 21.0° |
| H7 | C8 | C15 | H16 | 87.6° | 144.2° |
| H12 | C13 | C15 | H15 | 159.1° | 35.8° |
| H12 | C13 | C15 | H16 | 37.3° | 159.1° |
| H12 | C13 | C11 | H9 | 24.8° | 37.8° |
| H12 | C13 | C11 | H8 | 145.8° | 160.1° |
| H13 | C13 | C15 | H15 | 36.9° | 88.1° |
| H13 | C13 | C15 | H16 | 84.9° | 35.2° |
| H13 | C13 | C11 | H9 | 97.4° | 86.1° |
| H13 | C13 | C11 | H8 | 23.5° | 36.3° |
| H18 | C17 | C20 | H21 | 1.0° | 0.2° |
| H18 | C17 | C16 | H17 | 0.2° | 0.2° |
| H23 | C21 | C22 | H25 | 156.9° | 60.0° |
| H23 | C21 | C22 | H24 | 84.5° | 180.0° |
| H23 | C21 | C19 | H19 | 75.6° | 180.0° |
| H23 | C21 | C19 | H20 | 165.8° | 60.0° |
| H22 | C21 | C22 | H25 | 38.2° | 180.0° |
| H22 | C21 | C22 | H24 | 156.7° | 60.0° |
| H22 | C21 | C19 | H19 | 43.1° | 60.0° |
| H22 | C21 | C19 | H20 | 75.4° | 180.0° |
| H25 | C22 | C25 | H27 | 47.0° | 179.9° |
| H25 | C22 | C25 | H26 | 166.5° | 60.0° |
| H24 | C22 | C25 | H27 | 71.5° | 59.9° |
| H24 | C22 | C25 | H26 | 48.0° | 180.0° |
| H32 | C28 | C27 | H31 | 157.6° | 180.0° |
| H32 | C28 | C27 | H30 | 39.5° | 60.0° |
| H32 | C28 | C31 | H38 | 39.7° | 180.0° |
| H32 | C28 | C31 | H37 | 79.1° | 60.0° |
| H33 | C28 | C27 | H31 | 83.2° | 60.0° |
| H33 | C28 | C27 | H30 | 158.7° | 180.0° |
| H33 | C28 | C31 | H38 | 79.4° | 60.0° |
| H33 | C28 | C31 | H37 | 161.8° | 180.0° |
| HO11 | O1 | C12 | H11 | 60.0° | 60.0° |
| HO11 | O1 | C12 | H10 | 60.0° | 60.0° |
| H2 | C2 | C3 | H5 | 55.5° | 180.0° |
| H2 | C2 | C3 | H4 | 175.1° | 60.0° |
| H2 | C2 | C80 | H82 | 164.0° | 180.0° |
| H2 | C2 | C80 | H83 | 77.5° | 60.0° |
| H3 | C2 | C3 | H5 | 63.2° | 60.0° |
| H3 | C2 | C3 | H4 | 56.4° | NaN° |
| H3 | C2 | C80 | H82 | 45.3° | 59.9° |
| H3 | C2 | C80 | H83 | 163.8° | 179.9° |
| H114 | N4 | C90 | H96 | 130.1° | 145.0° |
| H115 | N5 | C79 | H81 | 16.2° | 145.0° |
| HN61 | N6 | C34 | H41 | 152.5° | 145.0° |
| HN71 | N7 | C89 | H95 | 175.7° | 145.0° |
| H213 | C100 | H013 | HC10 | 120.0° | 120.1° |
| H413 | C110 | H513 | H313 | 120.0° | 120.1° |
| H911 | N10 | C56 | H57 | 162.2° | 158.5° |
| H412 | O10 | C95 | H510 | 61.6° | 60.2° |
| H100 | N11 | C25 | H27 | 59.8° | 60.1° |
| H100 | N11 | C25 | H26 | 59.7° | 60.0° |
| H121 | N11 | C25 | H27 | 60.2° | 176.0° |
| H121 | N11 | C25 | H26 | 179.8° | 63.9° |
| H11 | C12 | C79 | H81 | 170.5° | 55.0° |
| H10 | C12 | C79 | H81 | 69.5° | 65.0° |
| H212 | N13 | C33 | H40 | 118.6° | 120.0° |
| H212 | N13 | C33 | H39 | 0.2° | 120.0° |
| H14 | C14 | C16 | H17 | 0.9° | 0.2° |
| H19 | C19 | C89 | H95 | 176.0° | 175.0° |
| H20 | C19 | C89 | H95 | 65.4° | 65.0° |
| H35 | C29 | C34 | H41 | 177.5° | 175.0° |
| H34 | C29 | C34 | H41 | 59.8° | 65.0° |
| H38 | C31 | C33 | H40 | 85.3° | 60.0° |
| H38 | C31 | C33 | H39 | 156.0° | 179.9° |
| H37 | C31 | C33 | H40 | 33.5° | 179.9° |
| H37 | C31 | C33 | H39 | 85.2° | 60.0° |
| H42 | C35 | C36 | H43 | 0.3° | 0.1° |
| H44 | C40 | C43 | H45 | 1.1° | 0.0° |
| H46 | C46 | C48 | H49 | 0.9° | 0.0° |
| H48 | C47 | C49 | H50 | 153.6° | 180.0° |
| H48 | C47 | C49 | H51 | 35.1° | 60.0° |
| H48 | C47 | C90 | H96 | 176.5° | 175.0° |
| H47 | C47 | C49 | H50 | 87.8° | 60.0° |
| H47 | C47 | C49 | H51 | 153.6° | 180.0° |
| H47 | C47 | C90 | H96 | 57.9° | 65.0° |
| H49 | C48 | C50 | H52 | 0.6° | 0.3° |
| H53 | C51 | H55 | H54 | 120.0° | 119.9° |
| H56 | C53 | C57 | H58 | 0.3° | 0.0° |
| H57 | C56 | C78 | H79 | 172.9° | 174.1° |
| H57 | C56 | C78 | H80 | 55.5° | 65.9° |
| H58 | C57 | C59 | H59 | 0.5° | 0.2° |
| H60 | C61 | C62 | H61 | 0.6° | 0.0° |
| H61 | C62 | C63 | H62 | 0.6° | 0.0° |
| H63 | C64 | H65 | H64 | 120.0° | 120.1° |
| H66 | C68 | C70 | H68 | 77.5° | 89.7° |
| H67 | C69 | C71 | H70 | 168.4° | 63.8° |
| H67 | C69 | C71 | H69 | 73.0° | 176.2° |
| H68 | C70 | C74 | H040 | 63.8° | 178.7° |
| H68 | C70 | C74 | H74 | 56.2° | 61.2° |
| H68 | C70 | C74 | H73 | 176.2° | 58.8° |
| H70 | C71 | C76 | H78 | 59.3° | 60.0° |
| H70 | C71 | C76 | H77 | 60.7° | 180.0° |
| H70 | C71 | C76 | H76 | 179.2° | 60.0° |
| H69 | C71 | C76 | H78 | 59.3° | 60.1° |
| H69 | C71 | C76 | H77 | 179.3° | 60.0° |
| H69 | C71 | C76 | H76 | 60.7° | 180.0° |
| H71 | C73 | C80 | H82 | 173.2° | 64.9° |
| H71 | C73 | C80 | H83 | 68.2° | 175.1° |
| H72 | C73 | C80 | H82 | 53.9° | 175.1° |
| H72 | C73 | C80 | H83 | 172.4° | 55.1° |
| H040 | C74 | H74 | H73 | 120.0° | 120.0° |
| H78 | C76 | H77 | H76 | 119.9° | 120.0° |
| H84 | C81 | C83 | H86 | 64.7° | 52.7° |
| H84 | C81 | C83 | H85 | 175.3° | 67.3° |
| H84 | C81 | C83 | H87 | 55.3° | 172.7° |
| H84 | C81 | C84 | H89 | 73.0° | 40.0° |
| H84 | C81 | C84 | H88 | 168.7° | 78.5° |
| H86 | C83 | H85 | H87 | 120.0° | 119.9° |
| H89 | C84 | C87 | H93 | 75.5° | 150.5° |
| H88 | C84 | C87 | H93 | 166.2° | 91.0° |
| H91 | C85 | H90 | H92 | 120.0° | 120.0° |
| H93 | C87 | C91 | H97 | 55.8° | 74.5° |
| H94 | C88 | C91 | H97 | 153.7° | 117.5° |
| H94 | C88 | C92 | H99 | 64.2° | 60.1° |
| H94 | C88 | C92 | H98 | 175.8° | 59.8° |
| H94 | C88 | C92 | H010 | 55.8° | 179.9° |
| H99 | C92 | H98 | H010 | 120.0° | 120.0° |
| HC86 | C93 | H310 | H210 | 120.0° | 119.9° |
| H410 | C94 | C95 | H510 | 178.0° | 177.7° |
| H510 | C95 | C96 | HC96 | 170.4° | 177.1° |
| HC96 | C96 | C98 | H910 | 163.2° | 57.0° |
| HC96 | C96 | C98 | H810 | 44.9° | 177.1° |
| H710 | C97 | C98 | H910 | 164.6° | 57.5° |
| H710 | C97 | C98 | H810 | 46.3° | 177.7° |
| H710 | C97 | C99 | H011 | 61.4° | 60.0° |
| H710 | C97 | C99 | H111 | 178.6° | 59.9° |
| H710 | C97 | C99 | H211 | 58.6° | 180.0° |
| H011 | C99 | H111 | H211 | 120.0° | 120.0° |
