M1K
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O20 | C77 | sing | 1.43Å | 1.43Å | |
C77 | C81 | sing | 1.53Å | 1.56Å | |
C77 | C75 | sing | 1.53Å | 1.54Å | |
O18 | C75 | sing | 1.43Å | 1.46Å | |
O23 | C81 | sing | 1.43Å | 1.45Å | |
C81 | C79 | sing | 1.53Å | 1.43Å | |
C75 | C73 | sing | 1.53Å | 1.46Å | |
C73 | O16 | sing | 1.43Å | 1.45Å | |
C73 | O11 | sing | 1.43Å | 1.41Å | |
C79 | O16 | sing | 1.43Å | 1.57Å | |
C79 | C85 | sing | 1.53Å | 1.60Å | |
O07 | C60 | sing | 1.43Å | 1.45Å | |
C85 | O26 | sing | 1.43Å | 1.48Å | |
O11 | C67 | sing | 1.43Å | 1.50Å | |
O09 | C64 | sing | 1.43Å | 1.42Å | |
C64 | C60 | sing | 1.53Å | 1.49Å | |
C64 | C63 | sing | 1.53Å | 1.48Å | |
C45 | C33 | sing | 1.53Å | 1.51Å | |
C60 | C59 | sing | 1.53Å | 1.69Å | |
C67 | C63 | sing | 1.53Å | 1.54Å | |
C59 | O06 | sing | 1.43Å | 1.49Å | |
C59 | C57 | sing | 1.53Å | 1.46Å | |
C63 | O04 | sing | 1.43Å | 1.52Å | |
O04 | C57 | sing | 1.43Å | 1.44Å | |
O01 | C37 | sing | 1.43Å | 1.45Å | |
C57 | O02 | sing | 1.43Å | 1.53Å | |
C46 | C38 | sing | 1.53Å | 1.50Å | |
C46 | C49 | sing | 1.53Å | 1.55Å | |
O02 | C50 | sing | 1.43Å | 1.58Å | |
C33 | C37 | sing | 1.53Å | 1.52Å | |
C33 | C32 | sing | 1.54Å | 1.53Å | |
C33 | C38 | sing | 1.52Å | 1.51Å | |
C37 | C35 | sing | 1.54Å | 1.55Å | |
C32 | C40 | sing | 1.52Å | 1.57Å | |
C32 | C30 | sing | 1.51Å | 1.52Å | |
C42 | C31 | sing | 1.53Å | 1.57Å | |
C40 | C47 | sing | 1.50Å | 1.44Å | |
C38 | C44 | sing | 1.50Å | 1.53Å | |
C47 | C44 | doub | 1.30Å | 1.46Å | |
C49 | C50 | sing | 1.53Å | 1.46Å | |
C44 | C48 | sing | 1.52Å | 1.42Å | |
C50 | C48 | sing | 1.53Å | 1.41Å | |
C35 | C31 | sing | 1.52Å | 1.53Å | |
C31 | C30 | sing | 1.55Å | 1.45Å | |
C31 | C34 | sing | 1.53Å | 1.53Å | |
C30 | C36 | sing | 1.52Å | 1.54Å | |
C30 | C41 | sing | 1.53Å | 1.60Å | |
C36 | C39 | sing | 1.55Å | 1.55Å | |
C48 | C54 | sing | 1.53Å | 1.47Å | |
C48 | C53 | sing | 1.53Å | 1.53Å | |
C52 | C43 | sing | 1.53Å | 1.51Å | |
C39 | C34 | sing | 1.55Å | 1.59Å | |
C34 | C43 | sing | 1.53Å | 1.55Å | |
C43 | C51 | sing | 1.53Å | 1.57Å | |
C51 | C55 | sing | 1.53Å | 1.50Å | |
C61 | C58 | sing | 1.53Å | 1.55Å | |
C55 | C56 | sing | 1.53Å | 1.59Å | |
C58 | C62 | sing | 1.53Å | 1.52Å | |
C58 | C56 | sing | 1.53Å | 1.63Å | |
C58 | O05 | sing | 1.43Å | 1.45Å | |
C56 | O03 | sing | 1.43Å | 1.45Å | |
C84 | C78 | sing | 1.53Å | 1.52Å | |
C84 | O25 | sing | 1.43Å | 1.53Å | |
C78 | C80 | sing | 1.53Å | 1.52Å | |
C78 | O15 | sing | 1.43Å | 1.41Å | |
O03 | C65 | sing | 1.43Å | 1.45Å | |
C80 | O22 | sing | 1.43Å | 1.44Å | |
C80 | C76 | sing | 1.53Å | 1.55Å | |
O24 | C83 | sing | 1.43Å | 1.46Å | |
O27 | C86 | sing | 1.43Å | 1.42Å | |
O15 | C72 | sing | 1.43Å | 1.48Å | |
C65 | O08 | sing | 1.43Å | 1.40Å | |
C65 | C66 | sing | 1.53Å | 1.51Å | |
O10 | C72 | sing | 1.43Å | 1.42Å | |
O10 | C66 | sing | 1.43Å | 1.40Å | |
C83 | C86 | sing | 1.53Å | 1.49Å | |
C83 | C82 | sing | 1.53Å | 1.57Å | |
C74 | C76 | sing | 1.53Å | 1.51Å | |
C74 | C72 | sing | 1.53Å | 1.58Å | |
C74 | O17 | sing | 1.43Å | 1.41Å | |
O19 | C76 | sing | 1.43Å | 1.39Å | |
C86 | C88 | sing | 1.53Å | 1.57Å | |
O08 | C69 | sing | 1.43Å | 1.38Å | |
C66 | C68 | sing | 1.53Å | 1.56Å | |
O14 | C82 | sing | 1.43Å | 1.44Å | |
O14 | C71 | sing | 1.43Å | 1.54Å | |
C82 | O21 | sing | 1.43Å | 1.40Å | |
C88 | C87 | sing | 1.53Å | 1.48Å | |
C88 | O28 | sing | 1.43Å | 1.46Å | |
C69 | C71 | sing | 1.53Å | 1.58Å | |
C69 | C70 | sing | 1.53Å | 1.53Å | |
C87 | O21 | sing | 1.43Å | 1.45Å | |
C87 | C89 | sing | 1.53Å | 1.56Å | |
C68 | C70 | sing | 1.53Å | 1.56Å | |
C68 | O12 | sing | 1.43Å | 1.45Å | |
C70 | O13 | sing | 1.43Å | 1.41Å | |
O29 | C89 | sing | 1.43Å | 1.42Å | |
C32 | H1 | sing | 1.09Å | 1.10Å | |
C34 | H2 | sing | 1.09Å | 1.10Å | |
C35 | H3 | sing | 1.09Å | 1.10Å | |
C35 | H4 | sing | 1.09Å | 1.10Å | |
C36 | H5 | sing | 1.09Å | 1.10Å | |
C36 | H6 | sing | 1.09Å | 1.10Å | |
C37 | H7 | sing | 1.09Å | 1.10Å | |
C38 | H8 | sing | 1.09Å | 1.10Å | |
C39 | H9 | sing | 1.09Å | 1.10Å | |
C39 | H10 | sing | 1.09Å | 1.10Å | |
C40 | H11 | sing | 1.09Å | 1.10Å | |
C40 | H12 | sing | 1.09Å | 1.10Å | |
C41 | H13 | sing | 1.09Å | 1.10Å | |
C41 | H14 | sing | 1.09Å | 1.10Å | |
C41 | H15 | sing | 1.09Å | 1.10Å | |
C42 | H16 | sing | 1.09Å | 1.10Å | |
C42 | H17 | sing | 1.09Å | 1.10Å | |
C42 | H18 | sing | 1.09Å | 1.10Å | |
C43 | H19 | sing | 1.09Å | 1.10Å | |
C45 | H20 | sing | 1.09Å | 1.10Å | |
C45 | H21 | sing | 1.09Å | 1.10Å | |
C45 | H22 | sing | 1.09Å | 1.10Å | |
C46 | H23 | sing | 1.09Å | 1.10Å | |
C46 | H24 | sing | 1.09Å | 1.10Å | |
C47 | H25 | sing | 1.08Å | 1.08Å | |
C49 | H26 | sing | 1.09Å | 1.10Å | |
C49 | H27 | sing | 1.09Å | 1.10Å | |
C50 | H28 | sing | 1.09Å | 1.10Å | |
C51 | H29 | sing | 1.09Å | 1.10Å | |
C51 | H30 | sing | 1.09Å | 1.10Å | |
C52 | H31 | sing | 1.09Å | 1.10Å | |
C52 | H32 | sing | 1.09Å | 1.10Å | |
C52 | H33 | sing | 1.09Å | 1.10Å | |
C53 | H34 | sing | 1.09Å | 1.10Å | |
C53 | H35 | sing | 1.09Å | 1.10Å | |
C53 | H36 | sing | 1.09Å | 1.10Å | |
C54 | H37 | sing | 1.09Å | 1.10Å | |
C54 | H38 | sing | 1.09Å | 1.10Å | |
C54 | H39 | sing | 1.09Å | 1.10Å | |
C55 | H40 | sing | 1.09Å | 1.10Å | |
C55 | H41 | sing | 1.09Å | 1.10Å | |
C56 | H42 | sing | 1.09Å | 1.10Å | |
C57 | H43 | sing | 1.09Å | 1.10Å | |
C59 | H44 | sing | 1.09Å | 1.10Å | |
C60 | H45 | sing | 1.09Å | 1.10Å | |
C61 | H46 | sing | 1.09Å | 1.10Å | |
C61 | H47 | sing | 1.09Å | 1.10Å | |
C61 | H48 | sing | 1.09Å | 1.10Å | |
C62 | H49 | sing | 1.09Å | 1.10Å | |
C62 | H50 | sing | 1.09Å | 1.10Å | |
C62 | H51 | sing | 1.09Å | 1.10Å | |
C63 | H52 | sing | 1.09Å | 1.10Å | |
C64 | H53 | sing | 1.09Å | 1.10Å | |
C65 | H54 | sing | 1.09Å | 1.10Å | |
C66 | H55 | sing | 1.09Å | 1.10Å | |
C67 | H56 | sing | 1.09Å | 1.10Å | |
C67 | H57 | sing | 1.09Å | 1.10Å | |
C68 | H58 | sing | 1.09Å | 1.10Å | |
C69 | H59 | sing | 1.09Å | 1.10Å | |
C70 | H60 | sing | 1.09Å | 1.10Å | |
C71 | H61 | sing | 1.09Å | 1.10Å | |
C71 | H62 | sing | 1.09Å | 1.10Å | |
C72 | H63 | sing | 1.09Å | 1.10Å | |
C73 | H64 | sing | 1.09Å | 1.10Å | |
C74 | H65 | sing | 1.09Å | 1.10Å | |
C75 | H66 | sing | 1.09Å | 1.10Å | |
C76 | H67 | sing | 1.09Å | 1.10Å | |
C77 | H68 | sing | 1.09Å | 1.10Å | |
C78 | H69 | sing | 1.09Å | 1.10Å | |
C79 | H70 | sing | 1.09Å | 1.10Å | |
C80 | H71 | sing | 1.09Å | 1.10Å | |
C81 | H72 | sing | 1.09Å | 1.10Å | |
C82 | H73 | sing | 1.09Å | 1.10Å | |
C83 | H74 | sing | 1.09Å | 1.10Å | |
C84 | H75 | sing | 1.09Å | 1.10Å | |
C84 | H76 | sing | 1.09Å | 1.10Å | |
C85 | H77 | sing | 1.09Å | 1.10Å | |
C85 | H78 | sing | 1.09Å | 1.10Å | |
C86 | H79 | sing | 1.09Å | 1.10Å | |
C87 | H80 | sing | 1.09Å | 1.10Å | |
C88 | H81 | sing | 1.09Å | 1.10Å | |
C89 | H82 | sing | 1.09Å | 1.10Å | |
C89 | H83 | sing | 1.09Å | 1.10Å | |
O01 | H84 | sing | 0.97Å | 0.95Å | |
O05 | H85 | sing | 0.97Å | 0.95Å | |
O06 | H86 | sing | 0.97Å | 0.95Å | |
O07 | H87 | sing | 0.97Å | 0.95Å | |
O09 | H88 | sing | 0.97Å | 0.95Å | |
O12 | H89 | sing | 0.97Å | 0.95Å | |
O13 | H90 | sing | 0.97Å | 0.95Å | |
O17 | H91 | sing | 0.97Å | 0.95Å | |
O18 | H92 | sing | 0.97Å | 0.95Å | |
O19 | H93 | sing | 0.97Å | 0.95Å | |
O20 | H94 | sing | 0.97Å | 0.95Å | |
O22 | H95 | sing | 0.97Å | 0.95Å | |
O23 | H96 | sing | 0.97Å | 0.95Å | |
O24 | H97 | sing | 0.97Å | 0.95Å | |
O25 | H98 | sing | 0.97Å | 0.95Å | |
O26 | H99 | sing | 0.97Å | 0.95Å | |
O27 | H100 | sing | 0.97Å | 0.95Å | |
O28 | H101 | sing | 0.97Å | 0.95Å | |
O29 | H102 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O20 | C77 | C81 | 107.1° | 109.5° |
O20 | C77 | C75 | 109.1° | 109.5° |
O20 | C77 | H68 | 111.9° | 109.6° |
C77 | O20 | H94 | 109.5° | 114.0° |
C81 | C77 | C75 | 108.3° | 109.0° |
C77 | C81 | O23 | 107.3° | 109.5° |
C77 | C81 | C79 | 112.5° | 109.2° |
C81 | C77 | H68 | 110.1° | 109.5° |
C77 | C81 | H72 | 106.8° | 109.5° |
C77 | C75 | O18 | 109.3° | 109.6° |
C77 | C75 | C73 | 111.1° | 109.2° |
C77 | C75 | H66 | 109.1° | 109.5° |
C75 | C77 | H68 | 110.3° | 109.6° |
O18 | C75 | C73 | 106.9° | 109.5° |
O18 | C75 | H66 | 110.3° | 109.5° |
C75 | O18 | H92 | 109.5° | 114.0° |
O23 | C81 | C79 | 113.7° | 109.5° |
O23 | C81 | H72 | 108.1° | 109.6° |
C81 | O23 | H96 | 109.5° | 114.0° |
C81 | C79 | O16 | 114.0° | 109.4° |
C81 | C79 | C85 | 110.9° | 109.5° |
C81 | C79 | H70 | 109.7° | 109.6° |
C79 | C81 | H72 | 108.3° | 109.5° |
C75 | C73 | O16 | 111.5° | 109.4° |
C75 | C73 | O11 | 109.1° | 109.5° |
C75 | C73 | H64 | 108.5° | 109.5° |
C73 | C75 | H66 | 110.2° | 109.5° |
O16 | C73 | O11 | 109.7° | 109.5° |
C73 | O16 | C79 | 115.0° | 114.1° |
O16 | C73 | H64 | 108.7° | 109.5° |
C73 | O11 | C67 | 108.1° | 114.0° |
O11 | C73 | H64 | 109.3° | 109.5° |
O16 | C79 | C85 | 106.7° | 109.5° |
O16 | C79 | H70 | 107.8° | 109.5° |
C79 | C85 | O26 | 108.7° | 109.5° |
C85 | C79 | H70 | 107.4° | 109.5° |
C79 | C85 | H77 | 109.7° | 109.5° |
C79 | C85 | H78 | 109.6° | 109.5° |
O07 | C60 | C64 | 112.5° | 109.6° |
O07 | C60 | C59 | 106.5° | 109.5° |
O07 | C60 | H45 | 110.8° | 109.6° |
C60 | O07 | H87 | 109.5° | 114.0° |
O26 | C85 | H77 | 109.7° | 109.5° |
O26 | C85 | H78 | 109.7° | 109.4° |
C85 | O26 | H99 | 109.5° | 114.0° |
O11 | C67 | C63 | 108.2° | 109.5° |
O11 | C67 | H56 | 109.8° | 109.5° |
O11 | C67 | H57 | 109.8° | 109.5° |
O09 | C64 | C60 | 109.9° | 109.5° |
O09 | C64 | C63 | 108.5° | 109.5° |
O09 | C64 | H53 | 110.4° | 109.7° |
C64 | O09 | H88 | 109.5° | 114.0° |
C60 | C64 | C63 | 108.8° | 109.1° |
C64 | C60 | C59 | 108.9° | 109.0° |
C64 | C60 | H45 | 110.3° | 109.6° |
C60 | C64 | H53 | 109.5° | 109.6° |
C64 | C63 | C67 | 109.8° | 109.5° |
C64 | C63 | O04 | 109.8° | 109.4° |
C64 | C63 | H52 | 109.4° | 109.4° |
C63 | C64 | H53 | 109.6° | 109.5° |
C45 | C33 | C37 | 108.4° | 109.2° |
C45 | C33 | C32 | 104.0° | 109.2° |
C45 | C33 | C38 | 104.1° | 108.5° |
C33 | C45 | H20 | 109.5° | 109.4° |
C33 | C45 | H21 | 109.5° | 109.5° |
C33 | C45 | H22 | 109.5° | 109.5° |
C60 | C59 | O06 | 108.5° | 109.5° |
C60 | C59 | C57 | 111.6° | 109.2° |
C60 | C59 | H44 | 107.6° | 109.6° |
C59 | C60 | H45 | 107.7° | 109.6° |
C67 | C63 | O04 | 110.2° | 109.5° |
C67 | C63 | H52 | 108.7° | 109.5° |
C63 | C67 | H56 | 109.8° | 109.5° |
C63 | C67 | H57 | 109.8° | 109.5° |
O06 | C59 | C57 | 108.5° | 109.5° |
O06 | C59 | H44 | 110.1° | 109.5° |
C59 | O06 | H86 | 109.5° | 114.0° |
C59 | C57 | O04 | 110.9° | 109.4° |
C59 | C57 | O02 | 106.7° | 109.5° |
C59 | C57 | H43 | 110.7° | 109.5° |
C57 | C59 | H44 | 110.5° | 109.5° |
C63 | O04 | C57 | 110.8° | 114.1° |
O04 | C63 | H52 | 108.8° | 109.4° |
O04 | C57 | O02 | 107.8° | 109.4° |
O04 | C57 | H43 | 111.0° | 109.5° |
O01 | C37 | C33 | 112.9° | 109.2° |
O01 | C37 | C35 | 108.8° | 109.1° |
O01 | C37 | H7 | 108.8° | 109.2° |
C37 | O01 | H84 | 109.5° | 114.0° |
C57 | O02 | C50 | 108.8° | 114.0° |
O02 | C57 | H43 | 109.6° | 109.5° |
C38 | C46 | C49 | 103.5° | 109.4° |
C46 | C38 | C33 | 110.1° | 110.0° |
C46 | C38 | C44 | 103.0° | 109.4° |
C46 | C38 | H8 | 107.2° | 107.3° |
C38 | C46 | H23 | 110.9° | 109.5° |
C38 | C46 | H24 | 111.0° | 109.5° |
C46 | C49 | C50 | 115.2° | 109.7° |
C49 | C46 | H23 | 111.0° | 109.5° |
C49 | C46 | H24 | 110.9° | 109.5° |
C46 | C49 | H26 | 108.0° | 109.4° |
C46 | C49 | H27 | 108.0° | 109.4° |
O02 | C50 | C49 | 107.5° | 109.5° |
O02 | C50 | C48 | 111.2° | 109.5° |
O02 | C50 | H28 | 108.1° | 109.5° |
C37 | C33 | C32 | 108.4° | 110.2° |
C37 | C33 | C38 | 118.9° | 109.0° |
C33 | C37 | C35 | 110.5° | 110.9° |
C33 | C37 | H7 | 108.0° | 109.2° |
C32 | C33 | C38 | 111.8° | 110.7° |
C33 | C32 | C40 | 112.8° | 109.4° |
C33 | C32 | C30 | 114.2° | 107.3° |
C33 | C32 | H1 | 106.5° | 109.6° |
C33 | C38 | C44 | 121.5° | 113.9° |
C33 | C38 | H8 | 107.2° | 108.1° |
C37 | C35 | C31 | 111.2° | 107.5° |
C37 | C35 | H3 | 109.1° | 109.9° |
C37 | C35 | H4 | 109.0° | 109.9° |
C35 | C37 | H7 | 107.6° | 109.2° |
C40 | C32 | C30 | 109.9° | 111.6° |
C32 | C40 | C47 | 121.8° | 109.5° |
C40 | C32 | H1 | 106.2° | 109.5° |
C32 | C40 | H11 | 106.3° | 109.5° |
C32 | C40 | H12 | 106.3° | 109.5° |
C32 | C30 | C31 | 113.0° | 107.0° |
C32 | C30 | C36 | 112.2° | 117.0° |
C32 | C30 | C41 | 115.8° | 109.7° |
C30 | C32 | H1 | 106.6° | 109.5° |
C42 | C31 | C35 | 111.5° | 110.8° |
C42 | C31 | C30 | 108.3° | 110.3° |
C42 | C31 | C34 | 113.2° | 110.3° |
C31 | C42 | H16 | 109.5° | 109.5° |
C31 | C42 | H17 | 109.5° | 109.4° |
C31 | C42 | H18 | 109.5° | 109.5° |
C40 | C47 | C44 | 118.4° | 122.7° |
C47 | C40 | H11 | 106.3° | 109.4° |
C47 | C40 | H12 | 106.3° | 109.4° |
C40 | C47 | H25 | 120.8° | 118.6° |
C38 | C44 | C47 | 119.3° | 124.1° |
C38 | C44 | C48 | 121.1° | 117.8° |
C44 | C38 | H8 | 107.0° | 108.0° |
C47 | C44 | C48 | 118.9° | 118.1° |
C44 | C47 | H25 | 120.8° | 118.7° |
C49 | C50 | C48 | 109.9° | 109.5° |
C50 | C49 | H26 | 108.0° | 109.4° |
C50 | C49 | H27 | 108.0° | 109.4° |
C49 | C50 | H28 | 109.6° | 109.5° |
C44 | C48 | C50 | 109.5° | 108.3° |
C44 | C48 | C54 | 106.5° | 109.7° |
C44 | C48 | C53 | 112.1° | 109.7° |
C50 | C48 | C54 | 111.6° | 109.7° |
C50 | C48 | C53 | 109.1° | 109.7° |
C48 | C50 | H28 | 110.4° | 109.5° |
C35 | C31 | C30 | 105.6° | 107.3° |
C35 | C31 | C34 | 118.2° | 116.1° |
C31 | C35 | H3 | 109.0° | 109.8° |
C31 | C35 | H4 | 109.0° | 109.9° |
C30 | C31 | C34 | 98.5° | 101.6° |
C31 | C30 | C36 | 102.6° | 103.2° |
C31 | C30 | C41 | 108.1° | 109.7° |
C31 | C34 | C39 | 101.1° | 102.9° |
C31 | C34 | C43 | 124.4° | 110.7° |
C31 | C34 | H2 | 106.5° | 110.7° |
C36 | C30 | C41 | 103.9° | 109.8° |
C30 | C36 | C39 | 101.6° | 105.3° |
C30 | C36 | H5 | 111.4° | 110.3° |
C30 | C36 | H6 | 111.4° | 110.2° |
C30 | C41 | H13 | 109.5° | 109.4° |
C30 | C41 | H14 | 109.5° | 109.5° |
C30 | C41 | H15 | 109.5° | 109.5° |
C36 | C39 | C34 | 104.0° | 106.4° |
C39 | C36 | H5 | 111.4° | 110.3° |
C39 | C36 | H6 | 111.4° | 110.3° |
C36 | C39 | H9 | 110.8° | 110.1° |
C36 | C39 | H10 | 110.8° | 110.1° |
C54 | C48 | C53 | 107.9° | 109.7° |
C48 | C54 | H37 | 109.5° | 109.5° |
C48 | C54 | H38 | 109.5° | 109.5° |
C48 | C54 | H39 | 109.5° | 109.4° |
C48 | C53 | H34 | 109.5° | 109.4° |
C48 | C53 | H35 | 109.5° | 109.4° |
C48 | C53 | H36 | 109.5° | 109.5° |
C52 | C43 | C34 | 117.9° | 109.5° |
C52 | C43 | C51 | 111.5° | 109.5° |
C52 | C43 | H19 | 106.0° | 109.5° |
C43 | C52 | H31 | 109.5° | 109.5° |
C43 | C52 | H32 | 109.4° | 109.5° |
C43 | C52 | H33 | 109.5° | 109.5° |
C39 | C34 | C43 | 111.5° | 110.8° |
C39 | C34 | H2 | 105.8° | 110.9° |
C34 | C39 | H9 | 110.8° | 110.1° |
C34 | C39 | H10 | 110.8° | 110.1° |
C34 | C43 | C51 | 109.7° | 109.5° |
C43 | C34 | H2 | 106.2° | 110.6° |
C34 | C43 | H19 | 105.5° | 109.4° |
C43 | C51 | C55 | 110.8° | 109.5° |
C51 | C43 | H19 | 105.3° | 109.5° |
C43 | C51 | H29 | 109.2° | 109.5° |
C43 | C51 | H30 | 109.1° | 109.4° |
C51 | C55 | C56 | 112.1° | 109.5° |
C55 | C51 | H29 | 109.1° | 109.5° |
C55 | C51 | H30 | 109.1° | 109.4° |
C51 | C55 | H40 | 108.8° | 109.5° |
C51 | C55 | H41 | 108.8° | 109.4° |
C61 | C58 | C62 | 110.3° | 109.5° |
C61 | C58 | C56 | 108.9° | 109.4° |
C61 | C58 | O05 | 107.3° | 109.5° |
C58 | C61 | H46 | 109.5° | 109.4° |
C58 | C61 | H47 | 109.4° | 109.4° |
C58 | C61 | H48 | 109.5° | 109.5° |
C55 | C56 | C58 | 108.0° | 109.5° |
C55 | C56 | O03 | 107.1° | 109.5° |
C56 | C55 | H40 | 108.8° | 109.5° |
C56 | C55 | H41 | 108.8° | 109.5° |
C55 | C56 | H42 | 109.3° | 109.4° |
C62 | C58 | C56 | 109.9° | 109.4° |
C62 | C58 | O05 | 109.8° | 109.5° |
C58 | C62 | H49 | 109.5° | 109.5° |
C58 | C62 | H50 | 109.5° | 109.4° |
C58 | C62 | H51 | 109.5° | 109.5° |
C56 | C58 | O05 | 110.7° | 109.5° |
C58 | C56 | O03 | 112.3° | 109.5° |
C58 | C56 | H42 | 108.9° | 109.4° |
C58 | O05 | H85 | 109.5° | 114.0° |
C56 | O03 | C65 | 113.2° | 114.0° |
O03 | C56 | H42 | 111.2° | 109.5° |
C78 | C84 | O25 | 110.6° | 109.5° |
C84 | C78 | C80 | 110.7° | 109.5° |
C84 | C78 | O15 | 107.0° | 109.5° |
C84 | C78 | H69 | 106.3° | 109.5° |
C78 | C84 | H75 | 109.2° | 109.5° |
C78 | C84 | H76 | 109.2° | 109.5° |
O25 | C84 | H75 | 109.2° | 109.4° |
O25 | C84 | H76 | 109.2° | 109.5° |
C84 | O25 | H98 | 109.5° | 114.0° |
C80 | C78 | O15 | 118.2° | 109.4° |
C78 | C80 | O22 | 112.6° | 109.6° |
C78 | C80 | C76 | 113.5° | 109.1° |
C80 | C78 | H69 | 106.4° | 109.5° |
C78 | C80 | H71 | 107.3° | 109.5° |
C78 | O15 | C72 | 120.0° | 114.0° |
O15 | C78 | H69 | 107.7° | 109.5° |
O03 | C65 | O08 | 107.1° | 109.5° |
O03 | C65 | C66 | 108.6° | 109.5° |
O03 | C65 | H54 | 110.2° | 109.5° |
O22 | C80 | C76 | 108.1° | 109.5° |
O22 | C80 | H71 | 108.2° | 109.5° |
C80 | O22 | H95 | 109.5° | 114.0° |
C80 | C76 | C74 | 108.8° | 109.1° |
C80 | C76 | O19 | 107.9° | 109.6° |
C80 | C76 | H67 | 109.4° | 109.6° |
C76 | C80 | H71 | 106.9° | 109.6° |
O24 | C83 | C86 | 105.5° | 109.5° |
O24 | C83 | C82 | 108.4° | 109.5° |
O24 | C83 | H74 | 110.6° | 109.6° |
C83 | O24 | H97 | 109.5° | 114.0° |
O27 | C86 | C83 | 109.8° | 109.5° |
O27 | C86 | C88 | 110.1° | 109.5° |
O27 | C86 | H79 | 109.9° | 109.7° |
C86 | O27 | H100 | 109.5° | 114.0° |
O15 | C72 | O10 | 112.0° | 109.5° |
O15 | C72 | C74 | 112.1° | 109.4° |
O15 | C72 | H63 | 108.4° | 109.5° |
O08 | C65 | C66 | 110.6° | 109.4° |
C65 | O08 | C69 | 113.0° | 114.1° |
O08 | C65 | H54 | 111.0° | 109.5° |
C65 | C66 | O10 | 106.7° | 109.5° |
C65 | C66 | C68 | 109.5° | 109.2° |
C66 | C65 | H54 | 109.4° | 109.4° |
C65 | C66 | H55 | 109.3° | 109.5° |
C72 | O10 | C66 | 112.3° | 114.0° |
O10 | C72 | C74 | 107.9° | 109.5° |
O10 | C72 | H63 | 109.2° | 109.5° |
O10 | C66 | C68 | 111.7° | 109.5° |
O10 | C66 | H55 | 110.9° | 109.6° |
C86 | C83 | C82 | 113.1° | 109.2° |
C83 | C86 | C88 | 109.9° | 109.0° |
C86 | C83 | H74 | 110.1° | 109.5° |
C83 | C86 | H79 | 109.0° | 109.6° |
C83 | C82 | O14 | 110.1° | 109.5° |
C83 | C82 | O21 | 109.9° | 109.4° |
C83 | C82 | H73 | 107.7° | 109.5° |
C82 | C83 | H74 | 109.1° | 109.5° |
C76 | C74 | C72 | 108.4° | 109.1° |
C76 | C74 | O17 | 110.5° | 109.5° |
C74 | C76 | O19 | 109.2° | 109.5° |
C76 | C74 | H65 | 110.0° | 109.6° |
C74 | C76 | H67 | 109.9° | 109.5° |
C72 | C74 | O17 | 107.3° | 109.5° |
C74 | C72 | H63 | 107.2° | 109.5° |
C72 | C74 | H65 | 109.1° | 109.6° |
O17 | C74 | H65 | 111.5° | 109.6° |
C74 | O17 | H91 | 109.5° | 114.0° |
O19 | C76 | H67 | 111.7° | 109.5° |
C76 | O19 | H93 | 109.5° | 114.0° |
C86 | C88 | C87 | 108.2° | 109.2° |
C86 | C88 | O28 | 111.0° | 109.5° |
C88 | C86 | H79 | 108.0° | 109.5° |
C86 | C88 | H81 | 108.2° | 109.5° |
O08 | C69 | C71 | 109.1° | 109.5° |
O08 | C69 | C70 | 107.1° | 109.4° |
O08 | C69 | H59 | 111.8° | 109.5° |
C66 | C68 | C70 | 110.2° | 109.0° |
C66 | C68 | O12 | 111.4° | 109.5° |
C68 | C66 | H55 | 108.7° | 109.5° |
C66 | C68 | H58 | 108.3° | 109.5° |
C82 | O14 | C71 | 114.0° | 114.0° |
O14 | C82 | O21 | 109.8° | 109.4° |
O14 | C82 | H73 | 109.4° | 109.5° |
O14 | C71 | C69 | 106.2° | 109.5° |
O14 | C71 | H61 | 110.3° | 109.5° |
O14 | C71 | H62 | 110.3° | 109.5° |
C82 | O21 | C87 | 114.6° | 114.1° |
O21 | C82 | H73 | 109.9° | 109.5° |
C87 | C88 | O28 | 110.5° | 109.5° |
C88 | C87 | O21 | 113.6° | 109.4° |
C88 | C87 | C89 | 110.3° | 109.5° |
C88 | C87 | H80 | 108.3° | 109.5° |
C87 | C88 | H81 | 109.3° | 109.5° |
O28 | C88 | H81 | 109.6° | 109.6° |
C88 | O28 | H101 | 109.5° | 114.0° |
C71 | C69 | C70 | 110.2° | 109.5° |
C71 | C69 | H59 | 108.9° | 109.5° |
C69 | C71 | H61 | 110.3° | 109.4° |
C69 | C71 | H62 | 110.3° | 109.5° |
C69 | C70 | C68 | 110.2° | 109.2° |
C69 | C70 | O13 | 108.6° | 109.5° |
C70 | C69 | H59 | 109.6° | 109.5° |
C69 | C70 | H60 | 108.9° | 109.5° |
O21 | C87 | C89 | 108.5° | 109.5° |
O21 | C87 | H80 | 108.7° | 109.5° |
C87 | C89 | O29 | 106.1° | 109.5° |
C89 | C87 | H80 | 107.3° | 109.5° |
C87 | C89 | H82 | 110.3° | 109.5° |
C87 | C89 | H83 | 110.3° | 109.5° |
C70 | C68 | O12 | 109.2° | 109.6° |
C68 | C70 | O13 | 110.2° | 109.5° |
C70 | C68 | H58 | 108.2° | 109.5° |
C68 | C70 | H60 | 108.5° | 109.5° |
O12 | C68 | H58 | 109.5° | 109.7° |
C68 | O12 | H89 | 109.5° | 114.0° |
O13 | C70 | H60 | 110.4° | 109.6° |
C70 | O13 | H90 | 109.5° | 114.0° |
O29 | C89 | H82 | 110.3° | 109.5° |
O29 | C89 | H83 | 110.3° | 109.4° |
C89 | O29 | H102 | 109.5° | 114.0° |
H3 | C35 | H4 | 109.5° | 109.8° |
H5 | C36 | H6 | 109.4° | 110.3° |
H9 | C39 | H10 | 109.5° | 110.1° |
H11 | C40 | H12 | 109.5° | 109.5° |
H13 | C41 | H14 | 109.5° | 109.5° |
H13 | C41 | H15 | 109.5° | 109.4° |
H14 | C41 | H15 | 109.5° | 109.5° |
H16 | C42 | H17 | 109.5° | 109.5° |
H16 | C42 | H18 | 109.5° | 109.5° |
H17 | C42 | H18 | 109.4° | 109.4° |
H20 | C45 | H21 | 109.4° | 109.4° |
H20 | C45 | H22 | 109.5° | 109.5° |
H21 | C45 | H22 | 109.4° | 109.6° |
H23 | C46 | H24 | 109.5° | 109.5° |
H26 | C49 | H27 | 109.5° | 109.5° |
H29 | C51 | H30 | 109.5° | 109.5° |
H31 | C52 | H32 | 109.5° | 109.4° |
H31 | C52 | H33 | 109.4° | 109.4° |
H32 | C52 | H33 | 109.5° | 109.5° |
H34 | C53 | H35 | 109.4° | 109.5° |
H34 | C53 | H36 | 109.5° | 109.5° |
H35 | C53 | H36 | 109.5° | 109.4° |
H37 | C54 | H38 | 109.5° | 109.5° |
H37 | C54 | H39 | 109.4° | 109.5° |
H38 | C54 | H39 | 109.4° | 109.4° |
H40 | C55 | H41 | 109.5° | 109.5° |
H46 | C61 | H47 | 109.5° | 109.4° |
H46 | C61 | H48 | 109.5° | 109.5° |
H47 | C61 | H48 | 109.5° | 109.5° |
H49 | C62 | H50 | 109.5° | 109.5° |
H49 | C62 | H51 | 109.5° | 109.5° |
H50 | C62 | H51 | 109.4° | 109.4° |
H56 | C67 | H57 | 109.5° | 109.4° |
H61 | C71 | H62 | 109.5° | 109.5° |
H75 | C84 | H76 | 109.5° | 109.5° |
H77 | C85 | H78 | 109.5° | 109.4° |
H82 | C89 | H83 | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O20 | C77 | C81 | C75 | 117.5° | 119.8° |
O20 | C77 | C81 | H68 | 121.9° | 120.3° |
O20 | C77 | C75 | H68 | 123.3° | 120.3° |
O20 | C77 | C75 | O18 | 57.8° | 177.2° |
O20 | C77 | C81 | O23 | 89.4° | 177.2° |
O20 | C77 | C81 | C79 | 144.9° | 62.8° |
O20 | C77 | C75 | C73 | 175.5° | 62.8° |
O20 | C77 | C75 | H66 | 62.8° | 57.0° |
O20 | C77 | C81 | H72 | 26.2° | 57.0° |
C81 | C77 | C75 | H68 | 120.5° | 119.9° |
C81 | C77 | C75 | O18 | 174.0° | 63.0° |
C77 | C81 | O23 | C79 | 125.0° | 119.7° |
C77 | C81 | O23 | H72 | 114.8° | 120.2° |
C77 | C81 | C79 | H72 | 117.7° | 119.9° |
C81 | C77 | C75 | C73 | 68.3° | 57.0° |
C77 | C81 | C79 | O16 | 28.3° | 57.7° |
C77 | C81 | C79 | C85 | 148.8° | 177.6° |
C81 | C77 | C75 | H66 | 53.4° | 176.9° |
C77 | C81 | C79 | H70 | 92.7° | 62.4° |
C81 | C77 | O20 | H94 | 180.0° | 180.0° |
C77 | C81 | O23 | H96 | 180.0° | 60.0° |
C77 | C75 | O18 | C73 | 120.3° | 119.7° |
C77 | C75 | O18 | H66 | 119.9° | 120.2° |
C75 | C77 | C81 | O23 | 153.1° | 62.9° |
C75 | C77 | C81 | C79 | 27.4° | 57.0° |
C77 | C75 | C73 | H66 | 121.0° | 119.9° |
C77 | C75 | C73 | O16 | 44.1° | 57.6° |
C77 | C75 | C73 | O11 | 165.4° | 62.4° |
C77 | C75 | C73 | H64 | 75.6° | 177.6° |
C75 | C77 | C81 | H72 | 91.3° | 176.9° |
C77 | C75 | O18 | H92 | 180.0° | 179.7° |
C75 | C77 | O20 | H94 | 63.0° | 60.5° |
O18 | C75 | C73 | H66 | 119.8° | 120.1° |
O18 | C75 | C73 | O16 | 163.3° | 62.4° |
O18 | C75 | C73 | O11 | 75.5° | 177.6° |
O18 | C75 | C73 | H64 | 43.5° | 57.6° |
O18 | C75 | C77 | H68 | 65.5° | 56.9° |
O23 | C81 | C79 | H72 | 120.1° | 120.2° |
O23 | C81 | C79 | O16 | 93.9° | 62.3° |
O23 | C81 | C79 | C85 | 26.6° | 57.6° |
O23 | C81 | C77 | H68 | 32.5° | 56.9° |
O23 | C81 | C79 | H70 | 145.2° | 177.7° |
C81 | C79 | O16 | C73 | 54.3° | 61.2° |
C81 | C79 | O16 | C85 | 122.8° | 119.9° |
C81 | C79 | O16 | H70 | 122.0° | 120.1° |
C81 | C79 | C85 | H70 | 119.9° | 120.1° |
C81 | C79 | C85 | O26 | 124.1° | 175.1° |
C79 | C81 | C77 | H68 | 93.3° | 176.9° |
C81 | C79 | C85 | H77 | 4.2° | 64.9° |
C81 | C79 | C85 | H78 | 116.0° | 55.1° |
C79 | C81 | O23 | H96 | 55.0° | 179.7° |
C75 | C73 | O16 | O11 | 120.9° | 120.0° |
C75 | C73 | O16 | H64 | 119.6° | 120.0° |
C75 | C73 | O11 | H64 | 118.5° | 120.0° |
C75 | C73 | O16 | C79 | 14.3° | 61.2° |
C75 | C73 | O11 | C67 | 164.0° | 175.1° |
C73 | C75 | C77 | H68 | 52.2° | 176.9° |
C73 | C75 | O18 | H92 | 59.7° | 60.0° |
O16 | C73 | O11 | H64 | 119.1° | 120.0° |
C73 | O16 | C79 | C85 | 177.2° | 178.8° |
O16 | C73 | O11 | C67 | 73.6° | 65.0° |
O16 | C73 | C75 | H66 | 76.9° | 177.5° |
C73 | O16 | C79 | H70 | 67.6° | 58.8° |
O11 | C73 | O16 | C79 | 106.7° | 58.8° |
C73 | O11 | C67 | C63 | 142.9° | 180.0° |
C73 | O11 | C67 | H56 | 23.1° | 60.0° |
C73 | O11 | C67 | H57 | 97.3° | 60.0° |
O11 | C73 | C75 | H66 | 44.4° | 57.5° |
O16 | C79 | C85 | H70 | 115.4° | 120.0° |
O16 | C79 | C85 | O26 | 0.6° | 65.0° |
C79 | O16 | C73 | H64 | 133.8° | 178.8° |
O16 | C79 | C81 | H72 | 146.0° | 177.5° |
O16 | C79 | C85 | H77 | 120.5° | 55.0° |
O16 | C79 | C85 | H78 | 119.3° | 175.0° |
C79 | C85 | O26 | H77 | 119.9° | 120.1° |
C79 | C85 | O26 | H78 | 119.9° | 120.0° |
C85 | C79 | C81 | H72 | 93.5° | 62.5° |
C79 | C85 | H77 | H78 | 120.3° | 120.0° |
C79 | C85 | O26 | H99 | 180.0° | 180.0° |
O07 | C60 | C64 | O09 | 68.9° | 63.3° |
O07 | C60 | C64 | C59 | 117.8° | 119.9° |
O07 | C60 | C64 | H45 | 124.2° | 120.2° |
O07 | C60 | C64 | C63 | 172.4° | 176.9° |
O07 | C60 | C59 | H45 | 118.9° | 120.2° |
O07 | C60 | C59 | O06 | 69.3° | 63.2° |
O07 | C60 | C59 | C57 | 171.3° | 176.9° |
O07 | C60 | C59 | H44 | 49.8° | 57.0° |
O07 | C60 | C64 | H53 | 52.6° | 57.0° |
O26 | C85 | C79 | H70 | 116.0° | 55.0° |
O26 | C85 | H77 | H78 | 120.4° | 120.0° |
O11 | C67 | C63 | C64 | 73.3° | 175.0° |
O11 | C67 | C63 | H56 | 119.8° | 120.0° |
O11 | C67 | C63 | H57 | 119.8° | 120.1° |
O11 | C67 | C63 | O04 | 47.8° | 65.0° |
O11 | C67 | C63 | H52 | 167.0° | 55.0° |
O11 | C67 | H56 | H57 | 120.6° | 120.0° |
C67 | O11 | C73 | H64 | 45.5° | 55.0° |
O09 | C64 | C60 | C63 | 118.7° | 119.9° |
O09 | C64 | C60 | H53 | 121.5° | 120.3° |
O09 | C64 | C63 | H53 | 120.7° | 120.2° |
O09 | C64 | C60 | C59 | 173.3° | 176.9° |
O09 | C64 | C63 | C67 | 54.9° | 62.5° |
O09 | C64 | C63 | O04 | 176.3° | 177.5° |
O09 | C64 | C60 | H45 | 55.3° | 56.9° |
O09 | C64 | C63 | H52 | 64.4° | 57.6° |
C60 | C64 | C63 | H53 | 119.7° | 119.9° |
C64 | C60 | C59 | H45 | 119.6° | 119.9° |
C60 | C64 | C63 | C67 | 174.4° | 177.6° |
C64 | C60 | C59 | O06 | 169.2° | 176.9° |
C64 | C60 | C59 | C57 | 49.8° | 57.0° |
C60 | C64 | C63 | O04 | 64.2° | 57.6° |
C64 | C60 | C59 | H44 | 71.7° | 62.9° |
C60 | C64 | C63 | H52 | 55.2° | 62.3° |
C64 | C60 | O07 | H87 | 180.0° | 179.6° |
C60 | C64 | O09 | H88 | 180.0° | 60.0° |
C63 | C64 | C60 | C59 | 54.6° | 57.0° |
C64 | C63 | C67 | O04 | 121.1° | 120.0° |
C64 | C63 | C67 | H52 | 119.7° | 120.0° |
C64 | C63 | O04 | H52 | 119.8° | 119.9° |
C64 | C63 | O04 | C57 | 66.6° | 61.1° |
C63 | C64 | C60 | H45 | 63.4° | 62.9° |
C64 | C63 | C67 | H56 | 46.5° | 55.0° |
C64 | C63 | C67 | H57 | 166.9° | 64.9° |
C63 | C64 | O09 | H88 | 61.1° | 179.7° |
C45 | C33 | C37 | O01 | 73.4° | 63.0° |
C45 | C33 | C38 | C46 | 39.9° | 37.9° |
C45 | C33 | C37 | C32 | 112.3° | 120.0° |
C45 | C33 | C37 | C38 | 118.5° | 118.4° |
C45 | C33 | C32 | C38 | 111.8° | 119.3° |
C45 | C33 | C37 | C35 | 164.4° | 176.7° |
C45 | C33 | C32 | C40 | 68.6° | 58.9° |
C45 | C33 | C32 | C30 | 165.0° | 180.0° |
C45 | C33 | C38 | C44 | 80.5° | 85.3° |
C45 | C33 | C32 | H1 | 47.5° | 61.2° |
C45 | C33 | C37 | H7 | 47.0° | 56.3° |
C45 | C33 | C38 | H8 | 156.2° | 154.8° |
C33 | C45 | H20 | H21 | 120.0° | 119.9° |
C33 | C45 | H20 | H22 | 120.0° | 120.0° |
C33 | C45 | H21 | H22 | 120.0° | 120.1° |
C60 | C59 | O06 | C57 | 121.4° | 119.7° |
C60 | C59 | O06 | H44 | 117.5° | 120.3° |
C60 | C59 | C57 | H44 | 119.8° | 120.0° |
C60 | C59 | C57 | O04 | 51.6° | 57.6° |
C60 | C59 | C57 | O02 | 168.8° | 177.6° |
C60 | C59 | C57 | H43 | 72.0° | 62.3° |
C59 | C60 | C64 | H53 | 65.2° | 62.8° |
C60 | C59 | O06 | H86 | 180.0° | 179.7° |
C59 | C60 | O07 | H87 | 60.8° | 60.0° |
C67 | C63 | O04 | H52 | 119.1° | 120.1° |
C67 | C63 | O04 | C57 | 172.2° | 178.8° |
C67 | C63 | C64 | H53 | 65.8° | 57.7° |
C63 | C67 | H56 | H57 | 120.6° | 120.0° |
O06 | C59 | C57 | H44 | 120.7° | 120.1° |
O06 | C59 | C57 | O04 | 171.1° | 177.5° |
O06 | C59 | C57 | O02 | 71.7° | 62.5° |
O06 | C59 | C57 | H43 | 47.5° | 57.6° |
O06 | C59 | C60 | H45 | 49.6° | 57.0° |
C59 | C57 | O04 | C63 | 60.3° | 61.2° |
C59 | C57 | O04 | O02 | 116.5° | 120.0° |
C59 | C57 | O04 | H43 | 123.5° | 120.0° |
C59 | C57 | O02 | H43 | 119.9° | 120.1° |
C59 | C57 | O02 | C50 | 158.3° | 175.0° |
C57 | C59 | C60 | H45 | 69.8° | 62.9° |
C57 | C59 | O06 | H86 | 58.6° | 60.0° |
C63 | O04 | C57 | O02 | 176.8° | 178.9° |
C63 | O04 | C57 | H43 | 63.2° | 58.8° |
O04 | C63 | C64 | H53 | 55.6° | 62.3° |
O04 | C63 | C67 | H56 | 167.6° | 175.0° |
O04 | C63 | C67 | H57 | 72.0° | 55.0° |
O04 | C57 | O02 | H43 | 120.9° | 120.0° |
O04 | C57 | O02 | C50 | 82.4° | 65.1° |
O04 | C57 | C59 | H44 | 68.1° | 62.4° |
C57 | O04 | C63 | H52 | 53.1° | 58.8° |
O01 | C37 | C33 | C35 | 122.2° | 120.3° |
O01 | C37 | C33 | H7 | 120.3° | 119.3° |
O01 | C37 | C33 | C32 | 174.3° | 177.0° |
O01 | C37 | C33 | C38 | 45.1° | 55.3° |
O01 | C37 | C35 | H7 | 117.7° | 119.3° |
O01 | C37 | C35 | C31 | 173.7° | 178.8° |
O01 | C37 | C35 | H3 | 66.0° | 61.7° |
O01 | C37 | C35 | H4 | 53.5° | 59.3° |
C57 | O02 | C50 | C49 | 100.8° | 90.0° |
C57 | O02 | C50 | C48 | 138.8° | 150.0° |
C57 | O02 | C50 | H28 | 17.5° | 30.0° |
O02 | C57 | C59 | H44 | 49.0° | 57.5° |
C38 | C46 | C49 | H23 | 119.0° | 120.0° |
C38 | C46 | C49 | H24 | 119.0° | 119.9° |
C46 | C38 | C33 | C37 | 80.8° | 80.9° |
C46 | C38 | C33 | C32 | 151.6° | 157.7° |
C46 | C38 | C33 | C44 | 120.4° | 123.2° |
C46 | C38 | C33 | H8 | 116.3° | 116.8° |
C46 | C38 | C44 | H8 | 112.9° | 116.4° |
C46 | C38 | C44 | C47 | 129.5° | 128.4° |
C38 | C46 | C49 | C50 | 65.8° | 62.7° |
C46 | C38 | C44 | C48 | 60.0° | 51.5° |
C38 | C46 | H23 | H24 | 122.8° | 120.1° |
C38 | C46 | C49 | H26 | 173.3° | 177.3° |
C38 | C46 | C49 | H27 | 55.0° | 57.4° |
C46 | C49 | C50 | O02 | 61.2° | 56.4° |
C49 | C46 | C38 | C33 | 172.0° | 179.8° |
C49 | C46 | C38 | C44 | 57.0° | 54.4° |
C46 | C49 | C50 | H26 | 120.9° | 120.0° |
C46 | C49 | C50 | H27 | 120.8° | 120.1° |
C46 | C49 | C50 | C48 | 60.0° | 63.6° |
C49 | C46 | C38 | H8 | 55.7° | 62.5° |
C49 | C46 | H23 | H24 | 122.8° | 120.0° |
C46 | C49 | H26 | H27 | 117.4° | 119.9° |
C46 | C49 | C50 | H28 | 178.4° | 176.4° |
O02 | C50 | C49 | C48 | 121.2° | 120.0° |
O02 | C50 | C49 | H28 | 117.3° | 120.0° |
O02 | C50 | C48 | C44 | 70.7° | 64.7° |
O02 | C50 | C48 | H28 | 120.0° | 120.0° |
O02 | C50 | C48 | C54 | 47.0° | 55.0° |
O02 | C50 | C48 | C53 | 166.2° | 175.5° |
O02 | C50 | C49 | H26 | 59.7° | 63.7° |
O02 | C50 | C49 | H27 | 178.0° | 176.4° |
C50 | O02 | C57 | H43 | 38.4° | 54.9° |
C37 | C33 | C32 | C38 | 133.0° | 120.7° |
C33 | C37 | C35 | H7 | 117.7° | 120.4° |
C37 | C33 | C32 | C40 | 176.2° | 178.9° |
C37 | C33 | C32 | C30 | 49.7° | 60.0° |
C37 | C33 | C38 | C44 | 158.8° | 155.9° |
C33 | C37 | C35 | C31 | 61.7° | 58.5° |
C37 | C33 | C32 | H1 | 67.7° | 58.8° |
C33 | C37 | C35 | H3 | 58.5° | 178.0° |
C33 | C37 | C35 | H4 | 178.1° | 61.0° |
C37 | C33 | C38 | H8 | 35.5° | 35.9° |
C37 | C33 | C45 | H20 | 180.0° | 60.1° |
C37 | C33 | C45 | H21 | 60.0° | 179.9° |
C37 | C33 | C45 | H22 | 60.0° | 59.9° |
C33 | C37 | O01 | H84 | 180.0° | 174.8° |
C32 | C33 | C37 | C35 | 52.1° | 56.7° |
C33 | C32 | C40 | C30 | 128.7° | 118.6° |
C33 | C32 | C40 | H1 | 116.3° | 120.1° |
C33 | C32 | C30 | H1 | 117.4° | 118.9° |
C33 | C32 | C40 | C47 | 34.9° | 55.1° |
C32 | C33 | C38 | C44 | 31.2° | 34.5° |
C33 | C32 | C30 | C31 | 56.3° | 65.6° |
C33 | C32 | C30 | C36 | 171.7° | 179.3° |
C33 | C32 | C30 | C41 | 69.3° | 53.4° |
C32 | C33 | C37 | H7 | 65.4° | 63.7° |
C32 | C33 | C38 | H8 | 92.1° | 85.5° |
C33 | C32 | C40 | H11 | 156.6° | 175.1° |
C33 | C32 | C40 | H12 | 86.8° | 64.9° |
C32 | C33 | C45 | H20 | 64.7° | 179.3° |
C32 | C33 | C45 | H21 | 55.2° | 59.4° |
C32 | C33 | C45 | H22 | 175.2° | 60.7° |
C38 | C33 | C37 | C35 | 77.1° | 65.0° |
C38 | C33 | C32 | C40 | 43.2° | 60.5° |
C38 | C33 | C32 | C30 | 83.3° | 60.7° |
C33 | C38 | C44 | H8 | 123.4° | 120.0° |
C33 | C38 | C44 | C47 | 5.7° | 4.8° |
C33 | C38 | C44 | C48 | 176.3° | 175.1° |
C38 | C33 | C32 | H1 | 159.3° | 179.5° |
C38 | C33 | C37 | H7 | 165.5° | 174.6° |
C38 | C33 | C45 | H20 | 52.5° | 58.6° |
C38 | C33 | C45 | H21 | 172.5° | 61.2° |
C38 | C33 | C45 | H22 | 67.5° | 178.6° |
C33 | C38 | C46 | H23 | 68.9° | 60.2° |
C33 | C38 | C46 | H24 | 53.0° | 59.9° |
C37 | C35 | C31 | C42 | 54.3° | 56.5° |
C37 | C35 | C31 | H3 | 120.3° | 119.5° |
C37 | C35 | C31 | H4 | 120.2° | 119.6° |
C37 | C35 | C31 | C30 | 63.1° | 63.9° |
C37 | C35 | C31 | C34 | 172.0° | 176.7° |
C37 | C35 | H3 | H4 | 119.2° | 121.0° |
C35 | C37 | O01 | H84 | 56.8° | 63.8° |
C40 | C32 | C30 | H1 | 114.7° | 121.3° |
C32 | C40 | C47 | H11 | 121.7° | 120.1° |
C32 | C40 | C47 | H12 | 121.7° | 120.0° |
C32 | C40 | C47 | C44 | 8.9° | 26.3° |
C40 | C32 | C30 | C31 | 175.8° | 174.6° |
C40 | C32 | C30 | C36 | 60.3° | 59.5° |
C40 | C32 | C30 | C41 | 58.7° | 66.4° |
C32 | C40 | H11 | H12 | 114.4° | 120.0° |
C32 | C40 | C47 | H25 | 171.1° | 153.7° |
C32 | C30 | C31 | C42 | 59.9° | 51.6° |
C30 | C32 | C40 | C47 | 93.8° | 63.5° |
C32 | C30 | C31 | C35 | 59.6° | 69.2° |
C32 | C30 | C31 | C36 | 121.0° | 124.0° |
C32 | C30 | C31 | C41 | 129.6° | 119.0° |
C32 | C30 | C31 | C34 | 177.9° | 168.5° |
C32 | C30 | C36 | C41 | 125.8° | 125.9° |
C32 | C30 | C36 | C39 | 163.0° | 146.6° |
C32 | C30 | C36 | H5 | 44.3° | 27.6° |
C32 | C30 | C36 | H6 | 78.2° | 94.5° |
C30 | C32 | C40 | H11 | 27.9° | 56.5° |
C30 | C32 | C40 | H12 | 144.5° | 176.5° |
C32 | C30 | C41 | H13 | 180.0° | 39.4° |
C32 | C30 | C41 | H14 | 60.0° | 80.6° |
C32 | C30 | C41 | H15 | 60.0° | 159.3° |
C42 | C31 | C35 | C30 | 117.4° | 120.5° |
C42 | C31 | C35 | C34 | 133.7° | 126.8° |
C42 | C31 | C30 | C34 | 117.9° | 116.9° |
C42 | C31 | C30 | C36 | 61.1° | 72.4° |
C42 | C31 | C30 | C41 | 170.5° | 170.6° |
C42 | C31 | C34 | C39 | 65.4° | 75.3° |
C42 | C31 | C34 | C43 | 60.4° | 43.1° |
C42 | C31 | C34 | H2 | 175.7° | 166.2° |
C42 | C31 | C35 | H3 | 174.6° | 63.0° |
C42 | C31 | C35 | H4 | 65.9° | 176.1° |
C31 | C42 | H16 | H17 | 120.0° | 119.9° |
C31 | C42 | H16 | H18 | 120.0° | 120.1° |
C31 | C42 | H17 | H18 | 120.0° | 120.0° |
C40 | C47 | C44 | C38 | 6.3° | 0.6° |
C40 | C47 | C44 | H25 | 180.0° | 180.0° |
C40 | C47 | C44 | C48 | 164.5° | 179.3° |
C47 | C40 | C32 | H1 | 151.2° | 175.2° |
C47 | C40 | H11 | H12 | 114.4° | 119.9° |
C38 | C44 | C47 | C48 | 170.8° | 179.9° |
C38 | C44 | C48 | C50 | 54.0° | 51.8° |
C38 | C44 | C48 | C54 | 174.8° | 171.5° |
C38 | C44 | C48 | C53 | 67.3° | 67.9° |
C44 | C38 | C46 | H23 | 62.1° | 65.6° |
C44 | C38 | C46 | H24 | 176.0° | 174.3° |
C38 | C44 | C47 | H25 | 173.7° | 179.4° |
C47 | C44 | C48 | C50 | 135.4° | 128.1° |
C47 | C44 | C48 | C54 | 14.6° | 8.4° |
C47 | C44 | C48 | C53 | 103.3° | 112.2° |
C47 | C44 | C38 | H8 | 117.7° | 115.2° |
C44 | C47 | C40 | H11 | 130.6° | 146.4° |
C44 | C47 | C40 | H12 | 112.8° | 93.6° |
C49 | C50 | C48 | C44 | 48.2° | 55.3° |
C49 | C50 | C48 | H28 | 121.1° | 120.0° |
C49 | C50 | C48 | C54 | 165.9° | 175.0° |
C49 | C50 | C48 | C53 | 74.9° | 64.5° |
C50 | C49 | C46 | H23 | 53.2° | 57.3° |
C50 | C49 | C46 | H24 | 175.1° | 177.4° |
C50 | C49 | H26 | H27 | 117.4° | 119.9° |
C44 | C48 | C50 | C54 | 117.7° | 119.7° |
C44 | C48 | C50 | C53 | 123.1° | 119.7° |
C44 | C48 | C54 | C53 | 120.6° | 120.6° |
C48 | C44 | C38 | H8 | 52.9° | 64.9° |
C48 | C44 | C47 | H25 | 15.6° | 0.7° |
C44 | C48 | C50 | H28 | 169.3° | 175.3° |
C44 | C48 | C53 | H34 | 180.0° | 60.0° |
C44 | C48 | C53 | H35 | 60.0° | 180.0° |
C44 | C48 | C53 | H36 | 60.0° | 60.0° |
C44 | C48 | C54 | H37 | 180.0° | 59.9° |
C44 | C48 | C54 | H38 | 60.0° | 180.0° |
C44 | C48 | C54 | H39 | 60.0° | 60.0° |
C50 | C48 | C54 | C53 | 119.9° | 120.6° |
C48 | C50 | C49 | H26 | 179.1° | 176.4° |
C48 | C50 | C49 | H27 | 60.8° | 56.5° |
C50 | C48 | C53 | H34 | 58.5° | 178.9° |
C50 | C48 | C53 | H35 | 61.5° | 61.1° |
C50 | C48 | C53 | H36 | 178.5° | 58.8° |
C50 | C48 | C54 | H37 | 60.5° | 58.9° |
C50 | C48 | C54 | H38 | 179.5° | 61.2° |
C50 | C48 | C54 | H39 | 59.5° | 178.9° |
C35 | C31 | C30 | C34 | 122.5° | 122.3° |
C35 | C31 | C30 | C36 | 179.4° | 166.8° |
C35 | C31 | C30 | C41 | 70.0° | 49.8° |
C35 | C31 | C34 | C39 | 161.6° | 157.6° |
C35 | C31 | C34 | C43 | 72.5° | 84.0° |
C35 | C31 | C34 | H2 | 51.3° | 39.1° |
C31 | C35 | H3 | H4 | 119.2° | 120.9° |
C31 | C35 | C37 | H7 | 56.0° | 61.9° |
C35 | C31 | C42 | H16 | 180.0° | 179.8° |
C35 | C31 | C42 | H17 | 60.0° | 59.8° |
C35 | C31 | C42 | H18 | 60.0° | 60.2° |
C31 | C30 | C36 | C41 | 112.6° | 117.0° |
C31 | C30 | C36 | C39 | 41.4° | 29.4° |
C30 | C31 | C34 | C39 | 48.7° | 41.7° |
C30 | C31 | C34 | C43 | 174.6° | 160.1° |
C31 | C30 | C32 | H1 | 61.1° | 53.3° |
C30 | C31 | C34 | H2 | 61.6° | 76.9° |
C30 | C31 | C35 | H3 | 57.2° | 176.6° |
C30 | C31 | C35 | H4 | 176.7° | 55.6° |
C31 | C30 | C36 | H5 | 77.3° | 89.6° |
C31 | C30 | C36 | H6 | 160.2° | 148.4° |
C31 | C30 | C41 | H13 | 51.9° | 156.7° |
C31 | C30 | C41 | H14 | 172.0° | 36.7° |
C31 | C30 | C41 | H15 | 68.0° | 83.4° |
C30 | C31 | C42 | H16 | 64.2° | 61.6° |
C30 | C31 | C42 | H17 | 175.7° | 178.4° |
C30 | C31 | C42 | H18 | 55.8° | 58.4° |
C34 | C31 | C30 | C36 | 56.9° | 44.5° |
C34 | C31 | C30 | C41 | 52.5° | 72.5° |
C31 | C34 | C39 | C36 | 23.1° | 23.9° |
C31 | C34 | C43 | C52 | 11.7° | 175.5° |
C31 | C34 | C39 | C43 | 134.0° | 118.4° |
C31 | C34 | C39 | H2 | 110.9° | 118.4° |
C31 | C34 | C43 | H2 | 124.0° | 123.1° |
C31 | C34 | C43 | C51 | 117.4° | 64.4° |
C34 | C31 | C35 | H3 | 51.7° | 63.8° |
C34 | C31 | C35 | H4 | 67.7° | 57.1° |
C31 | C34 | C39 | H9 | 96.0° | 143.2° |
C31 | C34 | C39 | H10 | 142.2° | 95.3° |
C34 | C31 | C42 | H16 | 43.9° | 49.8° |
C34 | C31 | C42 | H17 | 76.1° | 70.2° |
C34 | C31 | C42 | H18 | 163.9° | 169.9° |
C31 | C34 | C43 | H19 | 129.7° | 55.5° |
C30 | C36 | C39 | H5 | 118.7° | 119.0° |
C30 | C36 | C39 | H6 | 118.7° | 118.9° |
C30 | C36 | C39 | C34 | 9.5° | 3.6° |
C36 | C30 | C32 | H1 | 54.4° | 61.8° |
C30 | C36 | H5 | H6 | 123.7° | 122.0° |
C30 | C36 | C39 | H9 | 128.6° | 115.6° |
C30 | C36 | C39 | H10 | 109.6° | 122.9° |
C36 | C30 | C41 | H13 | 56.6° | 90.5° |
C36 | C30 | C41 | H14 | 63.5° | 149.5° |
C36 | C30 | C41 | H15 | 176.5° | 29.4° |
C41 | C30 | C36 | C39 | 71.1° | 87.5° |
C41 | C30 | C32 | H1 | 173.4° | 172.3° |
C41 | C30 | C36 | H5 | 170.2° | 153.4° |
C41 | C30 | C36 | H6 | 47.6° | 31.4° |
C30 | C41 | H13 | H14 | 120.0° | 120.1° |
C30 | C41 | H13 | H15 | 120.0° | 120.0° |
C30 | C41 | H14 | H15 | 120.0° | 120.1° |
C36 | C39 | C34 | H9 | 119.1° | 119.3° |
C36 | C39 | C34 | H10 | 119.1° | 119.3° |
C36 | C39 | C34 | C43 | 157.2° | 142.3° |
C36 | C39 | C34 | H2 | 87.8° | 94.5° |
C39 | C36 | H5 | H6 | 123.6° | 122.1° |
C36 | C39 | H9 | H10 | 122.5° | 121.5° |
C54 | C48 | C50 | H28 | 73.0° | 65.0° |
C54 | C48 | C53 | H34 | 63.0° | 60.6° |
C54 | C48 | C53 | H35 | 177.1° | 59.4° |
C54 | C48 | C53 | H36 | 57.0° | 179.4° |
C48 | C54 | H37 | H38 | 120.0° | 120.0° |
C48 | C54 | H37 | H39 | 120.0° | 120.0° |
C48 | C54 | H38 | H39 | 120.0° | 119.9° |
C53 | C48 | C50 | H28 | 46.2° | 55.6° |
C48 | C53 | H34 | H35 | 120.0° | 120.0° |
C48 | C53 | H34 | H36 | 120.0° | 120.0° |
C48 | C53 | H35 | H36 | 120.0° | 120.0° |
C53 | C48 | C54 | H37 | 59.4° | 179.4° |
C53 | C48 | C54 | H38 | 60.6° | 59.4° |
C53 | C48 | C54 | H39 | 179.4° | 60.6° |
C52 | C43 | C34 | C39 | 132.9° | 62.0° |
C52 | C43 | C34 | C51 | 129.1° | 120.0° |
C52 | C43 | C34 | H19 | 118.0° | 120.0° |
C52 | C43 | C51 | H19 | 114.5° | 120.1° |
C52 | C43 | C51 | C55 | 44.6° | 66.1° |
C52 | C43 | C34 | H2 | 112.3° | 61.4° |
C52 | C43 | C51 | H29 | 75.6° | 173.8° |
C52 | C43 | C51 | H30 | 164.8° | 53.8° |
C43 | C52 | H31 | H32 | 120.0° | 120.0° |
C43 | C52 | H31 | H33 | 120.0° | 120.0° |
C43 | C52 | H32 | H33 | 120.0° | 120.1° |
C39 | C34 | C43 | H2 | 114.8° | 123.4° |
C39 | C34 | C43 | C51 | 3.9° | 178.0° |
C34 | C39 | C36 | H5 | 109.2° | 115.4° |
C34 | C39 | C36 | H6 | 128.3° | 122.5° |
C34 | C39 | H9 | H10 | 122.5° | 121.5° |
C39 | C34 | C43 | H19 | 109.1° | 58.0° |
C34 | C43 | C51 | H19 | 113.1° | 119.9° |
C34 | C43 | C51 | C55 | 177.0° | 53.9° |
C43 | C34 | C39 | H9 | 38.0° | 98.4° |
C43 | C34 | C39 | H10 | 83.7° | 23.1° |
C34 | C43 | C51 | H29 | 56.8° | 66.2° |
C34 | C43 | C51 | H30 | 62.8° | 173.8° |
C34 | C43 | C52 | H31 | 180.0° | 180.0° |
C34 | C43 | C52 | H32 | 60.0° | 60.0° |
C34 | C43 | C52 | H33 | 60.0° | 60.0° |
C43 | C51 | C55 | H29 | 120.2° | 120.0° |
C43 | C51 | C55 | H30 | 120.2° | 120.0° |
C43 | C51 | C55 | C56 | 132.3° | 179.7° |
C51 | C43 | C34 | H2 | 118.6° | 58.7° |
C43 | C51 | H29 | H30 | 119.4° | 120.0° |
C51 | C43 | C52 | H31 | 51.8° | 60.0° |
C51 | C43 | C52 | H32 | 171.8° | 180.0° |
C51 | C43 | C52 | H33 | 68.2° | 60.0° |
C43 | C51 | C55 | H40 | 11.9° | 60.3° |
C43 | C51 | C55 | H41 | 107.3° | 59.6° |
C51 | C55 | C56 | H40 | 120.4° | 120.0° |
C51 | C55 | C56 | H41 | 120.4° | 120.0° |
C51 | C55 | C56 | C58 | 146.9° | 174.5° |
C51 | C55 | C56 | O03 | 92.0° | 65.5° |
C55 | C51 | C43 | H19 | 69.9° | 173.8° |
C55 | C51 | H29 | H30 | 119.4° | 120.0° |
C51 | C55 | H40 | H41 | 118.8° | 119.9° |
C51 | C55 | C56 | H42 | 28.6° | 54.6° |
C61 | C58 | C56 | C55 | 60.2° | 178.6° |
C61 | C58 | C62 | C56 | 120.1° | 120.0° |
C61 | C58 | C62 | O05 | 118.0° | 120.1° |
C61 | C58 | C56 | O05 | 117.7° | 120.0° |
C61 | C58 | C56 | O03 | 178.1° | 61.4° |
C61 | C58 | C56 | H42 | 58.3° | 58.6° |
C58 | C61 | H46 | H47 | 120.0° | 119.9° |
C58 | C61 | H46 | H48 | 120.0° | 120.0° |
C58 | C61 | H47 | H48 | 120.0° | 120.1° |
C61 | C58 | C62 | H49 | 180.0° | 179.9° |
C61 | C58 | C62 | H50 | 60.0° | 60.0° |
C61 | C58 | C62 | H51 | 60.0° | 59.9° |
C61 | C58 | O05 | H85 | 180.0° | 60.0° |
C55 | C56 | C58 | C62 | 60.6° | 61.4° |
C55 | C56 | C58 | O03 | 117.9° | 120.0° |
C55 | C56 | C58 | H42 | 118.6° | 119.9° |
C55 | C56 | C58 | O05 | 177.9° | 58.5° |
C55 | C56 | O03 | H42 | 119.4° | 120.0° |
C55 | C56 | O03 | C65 | 154.0° | 123.8° |
C56 | C55 | C51 | H29 | 107.5° | 59.7° |
C56 | C55 | C51 | H30 | 12.1° | 60.3° |
C56 | C55 | H40 | H41 | 118.8° | 120.1° |
C62 | C58 | C56 | O05 | 121.4° | 120.0° |
C62 | C58 | C56 | O03 | 57.2° | 58.6° |
C62 | C58 | C56 | H42 | 179.2° | 178.6° |
C62 | C58 | C61 | H46 | 180.0° | 61.8° |
C62 | C58 | C61 | H47 | 60.0° | 178.2° |
C62 | C58 | C61 | H48 | 60.0° | 58.1° |
C58 | C62 | H49 | H50 | 120.0° | 120.0° |
C58 | C62 | H49 | H51 | 120.0° | 120.0° |
C58 | C62 | H50 | H51 | 120.0° | 120.0° |
C62 | C58 | O05 | H85 | 60.2° | 180.0° |
C58 | C56 | O03 | H42 | 122.2° | 120.0° |
C58 | C56 | O03 | C65 | 87.6° | 116.2° |
C58 | C56 | C55 | H40 | 92.7° | 65.5° |
C58 | C56 | C55 | H41 | 26.5° | 54.5° |
C56 | C58 | C61 | H46 | 59.3° | 178.2° |
C56 | C58 | C61 | H47 | 179.3° | 58.3° |
C56 | C58 | C61 | H48 | 60.7° | 61.8° |
C56 | C58 | C62 | H49 | 59.9° | 60.0° |
C56 | C58 | C62 | H50 | 60.1° | 180.0° |
C56 | C58 | C62 | H51 | 180.0° | 60.0° |
C56 | C58 | O05 | H85 | 61.3° | 60.0° |
O05 | C58 | C56 | O03 | 64.2° | 178.6° |
O05 | C58 | C56 | H42 | 59.3° | 61.4° |
O05 | C58 | C61 | H46 | 60.5° | 58.2° |
O05 | C58 | C61 | H47 | 59.5° | 61.7° |
O05 | C58 | C61 | H48 | 179.5° | 178.2° |
O05 | C58 | C62 | H49 | 62.0° | 60.0° |
O05 | C58 | C62 | H50 | 178.0° | 60.1° |
O05 | C58 | C62 | H51 | 58.0° | 180.0° |
C56 | O03 | C65 | O08 | 96.4° | 64.3° |
C56 | O03 | C65 | C66 | 144.2° | 175.8° |
O03 | C56 | C55 | H40 | 28.4° | 54.5° |
O03 | C56 | C55 | H41 | 147.6° | 174.6° |
C56 | O03 | C65 | H54 | 24.4° | 55.8° |
C78 | C84 | O25 | H75 | 120.2° | 120.0° |
C78 | C84 | O25 | H76 | 120.2° | 120.0° |
C84 | C78 | C80 | O15 | 123.8° | 119.9° |
C84 | C78 | C80 | H69 | 115.1° | 120.0° |
C84 | C78 | O15 | H69 | 113.9° | 120.1° |
C84 | C78 | C80 | O22 | 15.7° | 57.7° |
C84 | C78 | C80 | C76 | 138.8° | 177.6° |
C84 | C78 | O15 | C72 | 163.7° | 178.9° |
C84 | C78 | C80 | H71 | 103.3° | 62.4° |
C78 | C84 | H75 | H76 | 119.5° | 120.0° |
C78 | C84 | O25 | H98 | 180.0° | 175.0° |
O25 | C84 | C78 | C80 | 134.8° | 174.7° |
O25 | C84 | C78 | O15 | 4.8° | 65.4° |
O25 | C84 | C78 | H69 | 110.1° | 54.7° |
O25 | C84 | H75 | H76 | 119.5° | 120.0° |
C80 | C78 | O15 | H69 | 120.4° | 120.0° |
C78 | C80 | O22 | C76 | 126.2° | 119.7° |
C78 | C80 | O22 | H71 | 118.4° | 120.1° |
C78 | C80 | C76 | H71 | 118.1° | 119.9° |
C80 | C78 | O15 | C72 | 38.0° | 61.2° |
C78 | C80 | C76 | C74 | 36.6° | 57.0° |
C78 | C80 | C76 | O19 | 154.9° | 62.9° |
C78 | C80 | C76 | H67 | 83.4° | 176.9° |
C80 | C78 | C84 | H75 | 14.7° | 65.3° |
C80 | C78 | C84 | H76 | 105.0° | 54.7° |
C78 | C80 | O22 | H95 | 180.0° | 175.3° |
O15 | C78 | C80 | O22 | 108.2° | 62.3° |
O15 | C78 | C80 | C76 | 15.0° | 57.7° |
C78 | O15 | C72 | O10 | 115.2° | 58.8° |
C78 | O15 | C72 | C74 | 6.2° | 61.2° |
C78 | O15 | C72 | H63 | 124.3° | 178.8° |
O15 | C78 | C80 | H71 | 132.9° | 177.6° |
O15 | C78 | C84 | H75 | 115.4° | 54.6° |
O15 | C78 | C84 | H76 | 124.9° | 174.6° |
O03 | C65 | O08 | C66 | 118.2° | 120.0° |
O03 | C65 | O08 | H54 | 120.2° | 120.1° |
O03 | C65 | C66 | H54 | 120.3° | 120.0° |
O03 | C65 | C66 | O10 | 67.0° | 62.5° |
O03 | C65 | O08 | C69 | 173.5° | 178.8° |
O03 | C65 | C66 | C68 | 171.9° | 177.6° |
C65 | O03 | C56 | H42 | 34.7° | 3.8° |
O03 | C65 | C66 | H55 | 52.9° | 57.7° |
O22 | C80 | C76 | H71 | 116.3° | 120.1° |
O22 | C80 | C76 | C74 | 162.2° | 62.9° |
O22 | C80 | C76 | O19 | 79.5° | 177.1° |
O22 | C80 | C76 | H67 | 42.2° | 56.9° |
O22 | C80 | C78 | H69 | 130.7° | 177.7° |
C80 | C76 | C74 | O19 | 117.5° | 120.0° |
C80 | C76 | C74 | H67 | 119.7° | 119.9° |
C80 | C76 | C74 | C72 | 66.3° | 57.0° |
C80 | C76 | C74 | O17 | 176.4° | 62.9° |
C80 | C76 | O19 | H67 | 120.2° | 120.2° |
C80 | C76 | C74 | H65 | 52.9° | 177.0° |
C76 | C80 | C78 | H69 | 106.1° | 62.3° |
C80 | C76 | O19 | H93 | 180.0° | 175.2° |
C76 | C80 | O22 | H95 | 53.8° | 55.7° |
O24 | C83 | C86 | O27 | 73.8° | 177.2° |
O24 | C83 | C86 | C82 | 118.4° | 119.9° |
O24 | C83 | C86 | H74 | 119.3° | 120.1° |
O24 | C83 | C82 | H74 | 120.5° | 120.2° |
O24 | C83 | C86 | C88 | 164.9° | 63.0° |
O24 | C83 | C82 | O14 | 65.4° | 177.7° |
O24 | C83 | C82 | O21 | 173.6° | 62.4° |
O24 | C83 | C82 | H73 | 53.9° | 57.7° |
O24 | C83 | C86 | H79 | 46.7° | 56.9° |
O27 | C86 | C83 | C88 | 121.3° | 119.8° |
O27 | C86 | C83 | H79 | 120.5° | 120.3° |
O27 | C86 | C83 | C82 | 167.8° | 62.9° |
O27 | C86 | C88 | H79 | 120.1° | 120.3° |
O27 | C86 | C88 | C87 | 112.1° | 62.9° |
O27 | C86 | C88 | O28 | 126.5° | 177.2° |
O27 | C86 | C83 | H74 | 45.5° | 57.1° |
O27 | C86 | C88 | H81 | 6.2° | 57.1° |
O15 | C72 | O10 | C74 | 123.7° | 120.0° |
O15 | C72 | O10 | H63 | 120.1° | 120.0° |
O15 | C72 | O10 | C66 | 91.6° | 74.8° |
O15 | C72 | C74 | C76 | 45.7° | 57.6° |
O15 | C72 | C74 | H63 | 118.9° | 120.0° |
O15 | C72 | C74 | O17 | 165.1° | 62.2° |
O15 | C72 | C74 | H65 | 74.0° | 177.6° |
C72 | O15 | C78 | H69 | 82.4° | 58.8° |
O08 | C65 | C66 | H54 | 122.5° | 120.0° |
O08 | C65 | C66 | O10 | 175.7° | 177.5° |
O08 | C65 | C66 | C68 | 54.7° | 57.6° |
C65 | O08 | C69 | C71 | 172.0° | 178.8° |
C65 | O08 | C69 | C70 | 68.6° | 61.2° |
O08 | C65 | C66 | H55 | 64.3° | 62.3° |
C65 | O08 | C69 | H59 | 51.5° | 58.8° |
C65 | C66 | O10 | C72 | 152.4° | 148.8° |
C65 | C66 | O10 | C68 | 119.6° | 119.7° |
C65 | C66 | O10 | H55 | 118.9° | 120.2° |
C66 | C65 | O08 | C69 | 68.3° | 61.2° |
C65 | C66 | C68 | H55 | 119.4° | 119.9° |
C65 | C66 | C68 | C70 | 47.3° | 57.0° |
C65 | C66 | C68 | O12 | 168.6° | 176.9° |
C65 | C66 | C68 | H58 | 70.9° | 62.8° |
O10 | C72 | C74 | C76 | 169.4° | 62.4° |
O10 | C72 | C74 | H63 | 117.5° | 120.0° |
O10 | C72 | C74 | O17 | 71.2° | 177.7° |
C72 | O10 | C66 | C68 | 88.0° | 91.5° |
C72 | O10 | C66 | H55 | 33.4° | 28.6° |
O10 | C72 | C74 | H65 | 49.7° | 57.5° |
C66 | O10 | C72 | C74 | 144.6° | 165.2° |
O10 | C66 | C68 | H55 | 122.7° | 120.2° |
O10 | C66 | C68 | C70 | 165.2° | 176.9° |
O10 | C66 | C68 | O12 | 73.5° | 63.2° |
O10 | C66 | C65 | H54 | 53.2° | 57.5° |
O10 | C66 | C68 | H58 | 47.1° | 57.1° |
C66 | O10 | C72 | H63 | 28.4° | 45.3° |
C86 | C83 | C82 | H74 | 122.8° | 119.9° |
C83 | C86 | C88 | H79 | 118.8° | 119.9° |
C86 | C83 | C82 | O14 | 177.9° | 62.3° |
C86 | C83 | C82 | O21 | 56.9° | 57.6° |
C83 | C86 | C88 | C87 | 9.0° | 57.0° |
C83 | C86 | C88 | O28 | 112.4° | 62.9° |
C86 | C83 | C82 | H73 | 62.8° | 177.6° |
C83 | C86 | C88 | H81 | 127.4° | 176.9° |
C86 | C83 | O24 | H97 | 180.0° | 180.0° |
C83 | C86 | O27 | H100 | 180.0° | 60.1° |
C82 | C83 | C86 | C88 | 46.5° | 57.0° |
C83 | C82 | O14 | O21 | 121.1° | 119.9° |
C83 | C82 | O14 | H73 | 118.2° | 120.1° |
C83 | C82 | O14 | C71 | 171.1° | 175.1° |
C83 | C82 | O21 | H73 | 118.4° | 120.1° |
C83 | C82 | O21 | C87 | 6.0° | 61.1° |
C82 | C83 | C86 | H79 | 71.7° | 176.8° |
C82 | C83 | O24 | H97 | 58.5° | 60.3° |
C76 | C74 | C72 | O17 | 119.4° | 119.8° |
C76 | C74 | C72 | H65 | 119.7° | 120.0° |
C76 | C74 | O17 | H65 | 122.6° | 120.2° |
C74 | C76 | O19 | H67 | 121.7° | 120.1° |
C76 | C74 | C72 | H63 | 73.1° | 177.6° |
C74 | C76 | C80 | H71 | 81.5° | 176.9° |
C76 | C74 | O17 | H91 | 180.0° | 180.0° |
C74 | C76 | O19 | H93 | 61.9° | 65.1° |
C72 | C74 | O17 | H65 | 119.4° | 120.2° |
C72 | C74 | C76 | O19 | 176.2° | 63.0° |
C72 | C74 | C76 | H67 | 53.4° | 176.9° |
C72 | C74 | O17 | H91 | 62.1° | 60.4° |
O17 | C74 | C76 | O19 | 58.9° | 177.1° |
O17 | C74 | C72 | H63 | 46.3° | 57.7° |
O17 | C74 | C76 | H67 | 63.9° | 57.0° |
O19 | C76 | C74 | H65 | 64.6° | 57.0° |
O19 | C76 | C80 | H71 | 36.9° | 57.0° |
C86 | C88 | C87 | O28 | 121.8° | 119.9° |
C86 | C88 | C87 | H81 | 117.6° | 119.9° |
C86 | C88 | O28 | H81 | 119.4° | 120.2° |
C86 | C88 | C87 | O21 | 60.9° | 57.6° |
C86 | C88 | C87 | C89 | 177.1° | 177.6° |
C88 | C86 | C83 | H74 | 75.8° | 176.9° |
C86 | C88 | C87 | H80 | 59.9° | 62.4° |
C88 | C86 | O27 | H100 | 58.8° | 179.6° |
C86 | C88 | O28 | H101 | 180.0° | 59.9° |
O08 | C69 | C71 | O14 | 55.8° | 65.1° |
O08 | C69 | C71 | C70 | 117.3° | 119.9° |
O08 | C69 | C71 | H59 | 122.3° | 120.1° |
O08 | C69 | C70 | H59 | 121.5° | 120.0° |
O08 | C69 | C70 | C68 | 58.3° | 57.6° |
O08 | C69 | C70 | O13 | 179.1° | 177.5° |
C69 | O08 | C65 | H54 | 53.3° | 58.7° |
O08 | C69 | C70 | H60 | 60.6° | 62.3° |
O08 | C69 | C71 | H61 | 63.7° | 174.9° |
O08 | C69 | C71 | H62 | 175.3° | 54.9° |
C66 | C68 | C70 | C69 | 49.8° | 57.0° |
C66 | C68 | C70 | O12 | 122.7° | 119.9° |
C66 | C68 | C70 | H58 | 118.2° | 119.8° |
C66 | C68 | O12 | H58 | 119.8° | 120.2° |
C66 | C68 | C70 | O13 | 169.7° | 176.9° |
C68 | C66 | C65 | H54 | 67.8° | 62.4° |
C66 | C68 | C70 | H60 | 69.3° | 63.0° |
C66 | C68 | O12 | H89 | 180.0° | 180.0° |
O14 | C82 | O21 | H73 | 120.4° | 120.0° |
C82 | O14 | C71 | C69 | 168.6° | 180.0° |
O14 | C82 | O21 | C87 | 127.3° | 58.9° |
C82 | O14 | C71 | H61 | 49.1° | 60.1° |
C82 | O14 | C71 | H62 | 72.0° | 60.0° |
O14 | C82 | C83 | H74 | 55.1° | 57.6° |
C71 | O14 | C82 | O21 | 67.8° | 65.0° |
O14 | C71 | C69 | H61 | 119.5° | 120.0° |
O14 | C71 | C69 | H62 | 119.5° | 120.0° |
O14 | C71 | C69 | C70 | 173.2° | 175.0° |
O14 | C71 | C69 | H59 | 66.5° | 55.0° |
O14 | C71 | H61 | H62 | 121.5° | 120.1° |
C71 | O14 | C82 | H73 | 52.8° | 55.0° |
C82 | O21 | C87 | C88 | 53.3° | 61.1° |
C82 | O21 | C87 | C89 | 176.4° | 178.9° |
O21 | C82 | C83 | H74 | 65.9° | 177.5° |
C82 | O21 | C87 | H80 | 67.2° | 58.9° |
C87 | C88 | O28 | H81 | 120.5° | 120.1° |
C88 | C87 | O21 | C89 | 123.1° | 120.0° |
C88 | C87 | O21 | H80 | 120.6° | 120.0° |
C88 | C87 | C89 | H80 | 117.7° | 120.0° |
C88 | C87 | C89 | O29 | 141.2° | 175.1° |
C87 | C88 | C86 | H79 | 127.8° | 176.8° |
C88 | C87 | C89 | H82 | 99.4° | 64.9° |
C88 | C87 | C89 | H83 | 21.7° | 55.1° |
C87 | C88 | O28 | H101 | 59.9° | 179.6° |
O28 | C88 | C87 | O21 | 60.9° | 62.3° |
O28 | C88 | C87 | C89 | 61.2° | 57.6° |
O28 | C88 | C86 | H79 | 6.4° | 56.9° |
O28 | C88 | C87 | H80 | 178.3° | 177.7° |
C71 | C69 | C70 | H59 | 119.9° | 120.0° |
C71 | C69 | C70 | C68 | 176.9° | 177.6° |
C71 | C69 | C70 | O13 | 62.3° | 62.5° |
C71 | C69 | C70 | H60 | 58.0° | 57.7° |
C69 | C71 | H61 | H62 | 121.5° | 120.0° |
C69 | C70 | C68 | O13 | 119.9° | 119.9° |
C69 | C70 | C68 | H60 | 119.1° | 119.9° |
C69 | C70 | C68 | O12 | 172.5° | 176.8° |
C69 | C70 | O13 | H60 | 119.3° | 120.2° |
C69 | C70 | C68 | H58 | 68.4° | 62.8° |
C70 | C69 | C71 | H61 | 53.7° | 55.0° |
C70 | C69 | C71 | H62 | 67.3° | 65.0° |
C69 | C70 | O13 | H90 | 180.0° | 179.7° |
O21 | C87 | C89 | H80 | 117.2° | 120.0° |
O21 | C87 | C89 | O29 | 93.8° | 65.0° |
C87 | O21 | C82 | H73 | 112.4° | 178.9° |
O21 | C87 | C88 | H81 | 178.5° | 177.5° |
O21 | C87 | C89 | H82 | 25.7° | 55.1° |
O21 | C87 | C89 | H83 | 146.8° | 175.1° |
C87 | C89 | O29 | H82 | 119.4° | 120.1° |
C87 | C89 | O29 | H83 | 119.5° | 120.0° |
C89 | C87 | C88 | H81 | 59.5° | 62.5° |
C87 | C89 | H82 | H83 | 121.6° | 120.0° |
C87 | C89 | O29 | H102 | 180.0° | 180.0° |
C70 | C68 | O12 | H58 | 118.3° | 120.3° |
C68 | C70 | O13 | H60 | 119.8° | 120.1° |
C70 | C68 | C66 | H55 | 72.1° | 63.0° |
C68 | C70 | C69 | H59 | 63.2° | 62.4° |
C70 | C68 | O12 | H89 | 58.1° | 60.4° |
C68 | C70 | O13 | H90 | 59.2° | 60.0° |
O12 | C68 | C70 | O13 | 67.7° | 63.3° |
O12 | C68 | C66 | H55 | 49.2° | 56.9° |
O12 | C68 | C70 | H60 | 53.4° | 56.9° |
O13 | C70 | C68 | H58 | 51.5° | 57.1° |
O13 | C70 | C69 | H59 | 57.6° | 57.5° |
O29 | C89 | C87 | H80 | 23.4° | 55.0° |
O29 | C89 | H82 | H83 | 121.6° | 119.9° |
H1 | C32 | C40 | H11 | 87.1° | 64.8° |
H1 | C32 | C40 | H12 | 29.5° | 55.2° |
H2 | C34 | C39 | H9 | 153.1° | 24.8° |
H2 | C34 | C39 | H10 | 31.3° | 146.3° |
H2 | C34 | C43 | H19 | 5.7° | 178.6° |
H3 | C35 | C37 | H7 | 176.2° | 57.6° |
H4 | C35 | C37 | H7 | 64.2° | 178.6° |
H5 | C36 | C39 | H9 | 9.9° | 125.4° |
H5 | C36 | C39 | H10 | 131.7° | 3.9° |
H6 | C36 | C39 | H9 | 112.6° | 3.3° |
H6 | C36 | C39 | H10 | 9.2° | 118.2° |
H7 | C37 | O01 | H84 | 60.2° | 55.4° |
H8 | C38 | C46 | H23 | 174.8° | 177.5° |
H8 | C38 | C46 | H24 | 63.3° | 57.4° |
H11 | C40 | C47 | H25 | 49.4° | 33.6° |
H12 | C40 | C47 | H25 | 67.2° | 86.3° |
H13 | C41 | H14 | H15 | 120.0° | 119.9° |
H16 | C42 | H17 | H18 | 120.0° | 120.1° |
H19 | C43 | C51 | H29 | 169.9° | 53.8° |
H19 | C43 | C51 | H30 | 50.3° | 66.3° |
H19 | C43 | C52 | H31 | 62.3° | 60.0° |
H19 | C43 | C52 | H32 | 57.7° | 60.0° |
H19 | C43 | C52 | H33 | 177.7° | 180.0° |
H20 | C45 | H21 | H22 | 120.0° | 120.0° |
H23 | C46 | C49 | H26 | 67.7° | 62.7° |
H23 | C46 | C49 | H27 | 174.0° | 177.4° |
H24 | C46 | C49 | H26 | 54.3° | 57.4° |
H24 | C46 | C49 | H27 | 64.0° | 62.6° |
H26 | C49 | C50 | H28 | 57.6° | 56.3° |
H27 | C49 | C50 | H28 | 60.7° | 63.6° |
H29 | C51 | C55 | H40 | 132.1° | 179.6° |
H29 | C51 | C55 | H41 | 12.9° | 60.4° |
H30 | C51 | C55 | H40 | 108.3° | 59.6° |
H30 | C51 | C55 | H41 | 132.5° | 179.6° |
H31 | C52 | H32 | H33 | 120.0° | 119.9° |
H34 | C53 | H35 | H36 | 120.0° | 120.1° |
H37 | C54 | H38 | H39 | 119.9° | 120.0° |
H40 | C55 | C56 | H42 | 149.0° | 174.6° |
H41 | C55 | C56 | H42 | 91.8° | 65.4° |
H43 | C57 | C59 | H44 | 168.2° | 177.6° |
H44 | C59 | C60 | H45 | 168.7° | 177.1° |
H44 | C59 | O06 | H86 | 62.5° | 60.1° |
H45 | C60 | C64 | H53 | 176.8° | 177.3° |
H45 | C60 | O07 | H87 | 56.1° | 60.1° |
H46 | C61 | H47 | H48 | 120.0° | 120.0° |
H49 | C62 | H50 | H51 | 120.0° | 120.0° |
H52 | C63 | C64 | H53 | 175.0° | 177.8° |
H52 | C63 | C67 | H56 | 73.2° | 65.0° |
H52 | C63 | C67 | H57 | 47.2° | 175.1° |
H53 | C64 | O09 | H88 | 59.1° | 60.2° |
H54 | C65 | C66 | H55 | 173.2° | 177.7° |
H55 | C66 | C68 | H58 | 169.7° | 177.2° |
H58 | C68 | C70 | H60 | 172.5° | 177.3° |
H58 | C68 | O12 | H89 | 60.3° | 59.8° |
H59 | C69 | C70 | H60 | 177.9° | 177.7° |
H59 | C69 | C71 | H61 | 174.0° | 65.0° |
H59 | C69 | C71 | H62 | 53.0° | 175.0° |
H60 | C70 | O13 | H90 | 60.7° | 60.1° |
H63 | C72 | C74 | H65 | 167.1° | 62.5° |
H64 | C73 | C75 | H66 | 163.4° | 62.5° |
H65 | C74 | C76 | H67 | 172.6° | 63.2° |
H65 | C74 | O17 | H91 | 57.3° | 59.9° |
H66 | C75 | C77 | H68 | 173.8° | 63.3° |
H66 | C75 | O18 | H92 | 60.0° | 60.1° |
H67 | C76 | C80 | H71 | 158.5° | 63.2° |
H67 | C76 | O19 | H93 | 59.8° | 55.0° |
H68 | C77 | C81 | H72 | 148.1° | 63.3° |
H68 | C77 | O20 | H94 | 59.3° | 59.8° |
H69 | C78 | C80 | H71 | 11.8° | 57.6° |
H69 | C78 | C84 | H75 | 129.8° | 174.7° |
H69 | C78 | C84 | H76 | 10.1° | 65.3° |
H70 | C79 | C81 | H72 | 25.1° | 57.5° |
H70 | C79 | C85 | H77 | 124.1° | 175.0° |
H70 | C79 | C85 | H78 | 3.9° | 65.0° |
H71 | C80 | O22 | H95 | 61.6° | 64.5° |
H72 | C81 | O23 | H96 | 65.2° | 60.2° |
H73 | C82 | C83 | H74 | 174.4° | 62.5° |
H74 | C83 | C86 | H79 | 166.0° | 63.2° |
H74 | C83 | O24 | H97 | 61.0° | 59.9° |
H75 | C84 | O25 | H98 | 59.8° | 65.0° |
H76 | C84 | O25 | H98 | 59.8° | 54.9° |
H77 | C85 | O26 | H99 | 60.1° | 59.9° |
H78 | C85 | O26 | H99 | 60.1° | 60.0° |
H79 | C86 | C88 | H81 | 113.8° | 63.3° |
H79 | C86 | O27 | H100 | 60.1° | 60.2° |
H80 | C87 | C88 | H81 | 57.7° | 57.5° |
H80 | C87 | C89 | H82 | 142.9° | 175.1° |
H80 | C87 | C89 | H83 | 96.0° | 64.9° |
H81 | C88 | O28 | H101 | 60.6° | 60.2° |
H82 | C89 | O29 | H102 | 60.5° | 60.0° |
H83 | C89 | O29 | H102 | 60.6° | 60.0° |