A1DCL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| O1 | C9 | sing | 1.43Å | 1.44Å | |
| C7 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C2 | sing | 1.38Å | 1.44Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.54Å | 1.54Å | |
| C9 | N1 | sing | 1.49Å | 1.50Å | |
| C10 | C11 | sing | 1.55Å | 1.53Å | |
| C1 | C2 | sing | 1.51Å | 1.50Å | |
| C2 | C3 | doub | 1.38Å | 1.37Å | Aromatic |
| C5 | N1 | sing | 1.40Å | 1.43Å | |
| C5 | C4 | doub | 1.39Å | 1.41Å | Aromatic |
| N1 | C60 | sing | 1.47Å | 1.47Å | |
| O13 | C61 | doub | 1.21Å | 1.23Å | |
| C11 | C60 | sing | 1.55Å | 1.57Å | |
| C11 | C12 | sing | 1.51Å | 1.49Å | |
| C3 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C4 | N19 | sing | 1.40Å | 1.42Å | |
| C60 | C61 | sing | 1.50Å | 1.51Å | |
| C60 | C63 | sing | 1.49Å | 1.54Å | |
| C61 | N17 | sing | 1.34Å | 1.36Å | |
| C12 | C13 | doub | 1.34Å | 1.35Å | Aromatic |
| C12 | N16 | sing | 1.32Å | 1.32Å | Aromatic |
| C13 | S1 | sing | 1.76Å | 1.71Å | Aromatic |
| N16 | C14 | doub | 1.29Å | 1.32Å | Aromatic |
| N19 | C63 | sing | 1.36Å | 1.37Å | |
| N19 | C64 | sing | 1.46Å | 1.50Å | |
| C63 | N18 | doub | 1.31Å | 1.30Å | |
| N17 | C62 | sing | 1.34Å | 1.36Å | |
| C14 | S1 | sing | 1.71Å | 1.75Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.45Å | |
| O15 | C65 | sing | 1.43Å | 1.42Å | |
| C64 | C65 | sing | 1.53Å | 1.53Å | |
| N18 | C62 | sing | 1.34Å | 1.32Å | |
| C62 | O14 | doub | 1.22Å | 1.21Å | |
| C16 | C15 | sing | 1.53Å | 1.39Å | |
| C65 | C66 | sing | 1.53Å | 1.53Å | |
| O26 | C77 | sing | 1.43Å | 1.41Å | |
| C66 | O16 | sing | 1.43Å | 1.41Å | |
| C66 | C67 | sing | 1.53Å | 1.53Å | |
| O17 | C67 | sing | 1.43Å | 1.43Å | |
| C77 | C78 | sing | 1.55Å | 1.53Å | |
| C77 | C71 | sing | 1.55Å | 1.52Å | |
| O22 | P2 | doub | 1.48Å | 1.50Å | |
| C78 | O27 | sing | 1.43Å | 1.42Å | |
| C78 | C70 | sing | 1.54Å | 1.54Å | |
| C72 | N21 | doub | 1.30Å | 1.31Å | Aromatic |
| C72 | N20 | sing | 1.36Å | 1.37Å | Aromatic |
| C67 | C68 | sing | 1.53Å | 1.51Å | |
| O23 | P2 | sing | 1.61Å | 1.50Å | |
| N21 | C73 | sing | 1.36Å | 1.39Å | Aromatic |
| P2 | O21 | sing | 1.61Å | 1.60Å | |
| P2 | O24 | sing | 1.61Å | 1.61Å | |
| C68 | O18 | sing | 1.43Å | 1.45Å | |
| N20 | C71 | sing | 1.46Å | 1.45Å | |
| N20 | C76 | sing | 1.37Å | 1.37Å | Aromatic |
| C71 | O25 | sing | 1.44Å | 1.40Å | |
| C73 | C76 | doub | 1.41Å | 1.38Å | Aromatic |
| C73 | C74 | sing | 1.40Å | 1.41Å | Aromatic |
| N22 | C74 | sing | 1.38Å | 1.33Å | |
| C76 | N24 | sing | 1.33Å | 1.34Å | Aromatic |
| C70 | O25 | sing | 1.44Å | 1.45Å | |
| C70 | C69 | sing | 1.53Å | 1.51Å | |
| C74 | N23 | doub | 1.33Å | 1.35Å | Aromatic |
| O21 | P1 | sing | 1.61Å | 1.60Å | |
| O24 | C69 | sing | 1.43Å | 1.45Å | |
| O18 | P1 | sing | 1.61Å | 1.61Å | |
| N24 | C75 | doub | 1.32Å | 1.33Å | Aromatic |
| N23 | C75 | sing | 1.32Å | 1.34Å | Aromatic |
| P1 | O19 | doub | 1.48Å | 1.49Å | |
| P1 | O20 | sing | 1.61Å | 1.50Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C3 | H13 | sing | 1.08Å | 1.08Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C64 | H23 | sing | 1.09Å | 1.10Å | |
| C64 | H24 | sing | 1.09Å | 1.10Å | |
| C65 | H25 | sing | 1.09Å | 1.10Å | |
| C66 | H26 | sing | 1.09Å | 1.10Å | |
| C67 | H27 | sing | 1.09Å | 1.10Å | |
| C68 | H28 | sing | 1.09Å | 1.10Å | |
| C68 | H29 | sing | 1.09Å | 1.10Å | |
| C69 | H30 | sing | 1.09Å | 1.10Å | |
| C69 | H31 | sing | 1.09Å | 1.10Å | |
| C70 | H32 | sing | 1.09Å | 1.10Å | |
| C71 | H33 | sing | 1.09Å | 1.10Å | |
| C72 | H34 | sing | 1.08Å | 1.08Å | |
| C75 | H35 | sing | 1.08Å | 1.08Å | |
| C77 | H36 | sing | 1.09Å | 1.10Å | |
| C78 | H37 | sing | 1.09Å | 1.10Å | |
| N17 | H40 | sing | 0.97Å | 1.00Å | |
| N22 | H42 | sing | 0.97Å | 1.00Å | |
| N22 | H43 | sing | 0.97Å | 1.00Å | |
| O1 | H44 | sing | 0.97Å | 0.95Å | |
| O15 | H45 | sing | 0.97Å | 0.95Å | |
| O16 | H46 | sing | 0.97Å | 0.95Å | |
| O17 | H47 | sing | 0.97Å | 0.95Å | |
| O20 | H48 | sing | 0.97Å | 0.95Å | |
| O23 | H49 | sing | 0.97Å | 0.95Å | |
| O26 | H50 | sing | 0.97Å | 0.95Å | |
| O27 | H51 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C7 | C6 | 120.9° | 119.9° |
| C8 | C7 | C2 | 119.7° | 119.9° |
| C7 | C8 | H4 | 109.5° | 109.5° |
| C7 | C8 | H5 | 109.5° | 109.5° |
| C7 | C8 | H6 | 109.5° | 109.5° |
| O1 | C9 | C10 | 111.8° | 110.0° |
| O1 | C9 | N1 | 114.9° | 110.0° |
| O1 | C9 | H7 | 108.7° | 110.0° |
| C9 | O1 | H44 | 109.5° | 114.0° |
| C6 | C7 | C2 | 119.4° | 120.2° |
| C7 | C6 | C5 | 120.9° | 120.2° |
| C7 | C6 | H2 | 119.6° | 119.9° |
| C7 | C2 | C1 | 120.0° | 120.0° |
| C7 | C2 | C3 | 119.6° | 120.0° |
| C6 | C5 | N1 | 118.5° | 118.3° |
| C6 | C5 | C4 | 119.9° | 119.4° |
| C5 | C6 | H2 | 119.6° | 119.9° |
| C10 | C9 | N1 | 105.7° | 106.7° |
| C9 | C10 | C11 | 101.4° | 105.1° |
| C10 | C9 | H7 | 107.4° | 110.0° |
| C9 | C10 | H8 | 111.4° | 110.3° |
| C9 | C10 | H9 | 111.5° | 110.4° |
| C9 | N1 | C5 | 114.2° | 107.9° |
| C9 | N1 | C60 | 110.9° | 104.9° |
| N1 | C9 | H7 | 107.9° | 110.0° |
| C10 | C11 | C60 | 105.6° | 102.3° |
| C10 | C11 | C12 | 114.3° | 110.9° |
| C10 | C11 | H3 | 105.5° | 111.0° |
| C11 | C10 | H8 | 111.5° | 110.3° |
| C11 | C10 | H9 | 111.5° | 110.3° |
| C1 | C2 | C3 | 120.4° | 120.0° |
| C2 | C1 | H14 | 109.5° | 109.5° |
| C2 | C1 | H15 | 109.4° | 109.5° |
| C2 | C1 | H16 | 109.5° | 109.4° |
| C2 | C3 | C4 | 120.9° | 120.0° |
| C2 | C3 | H13 | 119.6° | 120.0° |
| N1 | C5 | C4 | 121.6° | 122.3° |
| C5 | N1 | C60 | 119.9° | 112.0° |
| C5 | C4 | C3 | 119.4° | 120.1° |
| C5 | C4 | N19 | 119.7° | 120.6° |
| N1 | C60 | C11 | 97.3° | 103.5° |
| N1 | C60 | C61 | 111.0° | 110.7° |
| N1 | C60 | C63 | 113.8° | 112.1° |
| O13 | C61 | C60 | 122.1° | 119.8° |
| O13 | C61 | N17 | 120.1° | 119.7° |
| C60 | C11 | C12 | 119.4° | 110.8° |
| C11 | C60 | C61 | 115.0° | 108.6° |
| C11 | C60 | C63 | 114.2° | 110.6° |
| C60 | C11 | H3 | 105.1° | 110.8° |
| C11 | C12 | C13 | 127.1° | 122.8° |
| C11 | C12 | N16 | 117.4° | 122.8° |
| C12 | C11 | H3 | 105.9° | 110.7° |
| C3 | C4 | N19 | 120.8° | 119.3° |
| C4 | C3 | H13 | 119.6° | 120.0° |
| C4 | N19 | C63 | 121.3° | 118.2° |
| C4 | N19 | C64 | 118.6° | 120.9° |
| C61 | C60 | C63 | 105.7° | 111.1° |
| C60 | C61 | N17 | 117.9° | 120.6° |
| C60 | C63 | N19 | 119.6° | 119.4° |
| C60 | C63 | N18 | 122.6° | 121.4° |
| C61 | N17 | C62 | 122.3° | 121.1° |
| C61 | N17 | H40 | 118.8° | 119.5° |
| C13 | C12 | N16 | 115.6° | 114.5° |
| C12 | C13 | S1 | 109.6° | 108.0° |
| C12 | C13 | H11 | 125.2° | 126.0° |
| C12 | N16 | C14 | 110.1° | 117.1° |
| C13 | S1 | C14 | 87.3° | 90.3° |
| S1 | C13 | H11 | 125.2° | 126.0° |
| N16 | C14 | S1 | 113.7° | 110.2° |
| N16 | C14 | C15 | 120.1° | 124.9° |
| C63 | N19 | C64 | 120.1° | 120.9° |
| N19 | C63 | N18 | 117.8° | 119.2° |
| N19 | C64 | C65 | 114.5° | 109.5° |
| N19 | C64 | H23 | 108.2° | 109.5° |
| N19 | C64 | H24 | 108.2° | 109.5° |
| C63 | N18 | C62 | 118.9° | 122.2° |
| N17 | C62 | N18 | 122.2° | 121.9° |
| N17 | C62 | O14 | 118.0° | 119.0° |
| C62 | N17 | H40 | 118.9° | 119.4° |
| S1 | C14 | C15 | 126.1° | 124.9° |
| C14 | C15 | C16 | 124.9° | 109.5° |
| C14 | C15 | H17 | 105.5° | 109.5° |
| C14 | C15 | H18 | 105.5° | 109.5° |
| O15 | C65 | C64 | 108.4° | 109.5° |
| O15 | C65 | C66 | 106.8° | 109.4° |
| O15 | C65 | H25 | 110.9° | 109.5° |
| C65 | O15 | H45 | 109.5° | 114.0° |
| C64 | C65 | C66 | 112.1° | 109.5° |
| C65 | C64 | H23 | 108.2° | 109.5° |
| C65 | C64 | H24 | 108.2° | 109.5° |
| C64 | C65 | H25 | 109.3° | 109.5° |
| N18 | C62 | O14 | 119.7° | 119.1° |
| C16 | C15 | H17 | 105.5° | 109.5° |
| C16 | C15 | H18 | 105.5° | 109.5° |
| C15 | C16 | H19 | 109.5° | 109.5° |
| C15 | C16 | H20 | 109.5° | 109.5° |
| C15 | C16 | H21 | 109.5° | 109.5° |
| C65 | C66 | O16 | 111.1° | 109.4° |
| C65 | C66 | C67 | 115.8° | 109.5° |
| C66 | C65 | H25 | 109.3° | 109.4° |
| C65 | C66 | H26 | 107.2° | 109.5° |
| O26 | C77 | C78 | 115.8° | 110.9° |
| O26 | C77 | C71 | 115.8° | 110.9° |
| O26 | C77 | H36 | 109.1° | 110.9° |
| C77 | O26 | H50 | 109.5° | 114.0° |
| O16 | C66 | C67 | 106.6° | 109.5° |
| O16 | C66 | H26 | 108.7° | 109.4° |
| C66 | O16 | H46 | 109.5° | 114.0° |
| C66 | C67 | O17 | 110.0° | 109.4° |
| C66 | C67 | C68 | 111.1° | 109.5° |
| C67 | C66 | H26 | 107.2° | 109.5° |
| C66 | C67 | H27 | 108.3° | 109.4° |
| O17 | C67 | C68 | 109.2° | 109.5° |
| O17 | C67 | H27 | 109.7° | 109.5° |
| C67 | O17 | H47 | 109.5° | 114.0° |
| C78 | C77 | C71 | 100.1° | 102.1° |
| C77 | C78 | O27 | 109.2° | 110.5° |
| C77 | C78 | C70 | 103.1° | 104.2° |
| C78 | C77 | H36 | 107.6° | 110.9° |
| C77 | C78 | H37 | 110.3° | 110.5° |
| C77 | C71 | N20 | 114.8° | 110.8° |
| C77 | C71 | O25 | 102.3° | 103.5° |
| C77 | C71 | H33 | 109.7° | 110.6° |
| C71 | C77 | H36 | 107.8° | 110.9° |
| O22 | P2 | O23 | 118.9° | 109.4° |
| O22 | P2 | O21 | 107.6° | 109.5° |
| O22 | P2 | O24 | 110.2° | 109.5° |
| O27 | C78 | C70 | 111.8° | 110.5° |
| O27 | C78 | H37 | 112.0° | 110.5° |
| C78 | O27 | H51 | 109.5° | 114.0° |
| C78 | C70 | O25 | 105.2° | 107.3° |
| C78 | C70 | C69 | 117.7° | 109.9° |
| C78 | C70 | H32 | 108.0° | 110.0° |
| C70 | C78 | H37 | 110.2° | 110.5° |
| N21 | C72 | N20 | 113.2° | 109.9° |
| C72 | N21 | C73 | 104.3° | 109.5° |
| N21 | C72 | H34 | 123.4° | 125.0° |
| C72 | N20 | C71 | 126.8° | 126.3° |
| C72 | N20 | C76 | 106.3° | 107.5° |
| N20 | C72 | H34 | 123.4° | 125.0° |
| C67 | C68 | O18 | 111.0° | 109.5° |
| C68 | C67 | H27 | 108.5° | 109.5° |
| C67 | C68 | H28 | 109.1° | 109.4° |
| C67 | C68 | H29 | 109.1° | 109.4° |
| O23 | P2 | O21 | 109.1° | 109.5° |
| O23 | P2 | O24 | 108.8° | 109.4° |
| P2 | O23 | H49 | 109.5° | 114.0° |
| N21 | C73 | C76 | 110.5° | 107.1° |
| N21 | C73 | C74 | 132.4° | 134.7° |
| O21 | P2 | O24 | 100.6° | 109.5° |
| P2 | O21 | P1 | 129.4° | 134.0° |
| P2 | O24 | C69 | 120.1° | 123.1° |
| C68 | O18 | P1 | 119.5° | 123.0° |
| O18 | C68 | H28 | 109.1° | 109.5° |
| O18 | C68 | H29 | 109.1° | 109.5° |
| C71 | N20 | C76 | 126.9° | 126.2° |
| N20 | C71 | O25 | 107.5° | 110.6° |
| N20 | C71 | H33 | 110.7° | 110.6° |
| N20 | C76 | C73 | 105.7° | 106.0° |
| N20 | C76 | N24 | 127.8° | 134.9° |
| C71 | O25 | C70 | 107.5° | 107.0° |
| O25 | C71 | H33 | 111.5° | 110.6° |
| C76 | C73 | C74 | 117.2° | 118.2° |
| C73 | C76 | N24 | 126.5° | 119.1° |
| C73 | C74 | N22 | 123.6° | 120.8° |
| C73 | C74 | N23 | 117.6° | 118.5° |
| N22 | C74 | N23 | 118.8° | 120.8° |
| C74 | N22 | H42 | 109.5° | 120.0° |
| C74 | N22 | H43 | 109.4° | 120.0° |
| C76 | N24 | C75 | 111.0° | 120.7° |
| O25 | C70 | C69 | 108.1° | 109.9° |
| O25 | C70 | H32 | 109.2° | 109.9° |
| C70 | C69 | O24 | 109.0° | 109.5° |
| C70 | C69 | H30 | 109.6° | 109.5° |
| C70 | C69 | H31 | 109.6° | 109.5° |
| C69 | C70 | H32 | 108.4° | 109.9° |
| C74 | N23 | C75 | 118.4° | 121.2° |
| O21 | P1 | O18 | 101.6° | 109.5° |
| O21 | P1 | O19 | 105.8° | 109.5° |
| O21 | P1 | O20 | 113.0° | 109.5° |
| O24 | C69 | H30 | 109.6° | 109.4° |
| O24 | C69 | H31 | 109.6° | 109.5° |
| O18 | P1 | O19 | 113.6° | 109.5° |
| O18 | P1 | O20 | 101.8° | 109.5° |
| N24 | C75 | N23 | 129.2° | 122.4° |
| N24 | C75 | H35 | 115.4° | 118.8° |
| N23 | C75 | H35 | 115.4° | 118.7° |
| O19 | P1 | O20 | 119.7° | 109.4° |
| P1 | O20 | H48 | 109.5° | 114.0° |
| H4 | C8 | H5 | 109.5° | 109.5° |
| H4 | C8 | H6 | 109.4° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 110.4° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H16 | 109.5° | 109.4° |
| H15 | C1 | H16 | 109.5° | 109.5° |
| H17 | C15 | H18 | 109.5° | 109.4° |
| H19 | C16 | H20 | 109.5° | 109.4° |
| H19 | C16 | H21 | 109.5° | 109.5° |
| H20 | C16 | H21 | 109.5° | 109.5° |
| H23 | C64 | H24 | 109.5° | 109.4° |
| H28 | C68 | H29 | 109.4° | 109.5° |
| H30 | C69 | H31 | 109.5° | 109.5° |
| H42 | N22 | H43 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C7 | C6 | C2 | 179.5° | 180.0° |
| C8 | C7 | C6 | C5 | 179.7° | 180.0° |
| C8 | C7 | C2 | C1 | 0.5° | 0.1° |
| C8 | C7 | C2 | C3 | 180.0° | 179.7° |
| C8 | C7 | C6 | H2 | 0.3° | 0.1° |
| C7 | C8 | H4 | H5 | 120.0° | 120.0° |
| C7 | C8 | H4 | H6 | 120.0° | 120.0° |
| C7 | C8 | H5 | H6 | 120.0° | 120.0° |
| O1 | C9 | C10 | N1 | 125.8° | 119.3° |
| O1 | C9 | C10 | H7 | 119.2° | 121.4° |
| O1 | C9 | N1 | H7 | 121.5° | 121.3° |
| O1 | C9 | C10 | C11 | 141.0° | 116.7° |
| O1 | C9 | N1 | C5 | 110.1° | 148.6° |
| O1 | C9 | N1 | C60 | 110.7° | 91.8° |
| O1 | C9 | C10 | H8 | 22.3° | 124.4° |
| O1 | C9 | C10 | H9 | 100.3° | 2.2° |
| C7 | C6 | C5 | H2 | 180.0° | 179.9° |
| C6 | C7 | C2 | C1 | 180.0° | 180.0° |
| C6 | C7 | C2 | C3 | 0.5° | 0.2° |
| C7 | C6 | C5 | N1 | 178.8° | 179.9° |
| C7 | C6 | C5 | C4 | 0.3° | 0.0° |
| C6 | C7 | C8 | H4 | 89.7° | 90.1° |
| C6 | C7 | C8 | H5 | 150.2° | 150.0° |
| C6 | C7 | C8 | H6 | 30.2° | 30.0° |
| C2 | C7 | C6 | C5 | 0.1° | 0.0° |
| C7 | C2 | C1 | C3 | 179.5° | 179.8° |
| C7 | C2 | C3 | C4 | 0.9° | 0.5° |
| C2 | C7 | C6 | H2 | 179.8° | 180.0° |
| C2 | C7 | C8 | H4 | 89.8° | 90.0° |
| C2 | C7 | C8 | H5 | 30.2° | 30.0° |
| C2 | C7 | C8 | H6 | 150.3° | 150.0° |
| C7 | C2 | C3 | H13 | 179.0° | 179.8° |
| C7 | C2 | C1 | H14 | 90.2° | 89.9° |
| C7 | C2 | C1 | H15 | 149.8° | 150.0° |
| C7 | C2 | C1 | H16 | 29.8° | 30.0° |
| C6 | C5 | N1 | C9 | 38.0° | 38.3° |
| C6 | C5 | N1 | C4 | 178.5° | 180.0° |
| C6 | C5 | N1 | C60 | 173.2° | 153.3° |
| C6 | C5 | C4 | C3 | 0.7° | 0.2° |
| C6 | C5 | C4 | N19 | 179.4° | 179.9° |
| C10 | C9 | N1 | H7 | 114.7° | 119.3° |
| C9 | C10 | C11 | H8 | 118.7° | 118.9° |
| C9 | C10 | C11 | H9 | 118.7° | 118.9° |
| C10 | C9 | N1 | C5 | 126.1° | 92.1° |
| C10 | C9 | N1 | C60 | 13.1° | 27.5° |
| C9 | C10 | C11 | C60 | 36.8° | 21.7° |
| C9 | C10 | C11 | C12 | 170.0° | 139.9° |
| C9 | C10 | C11 | H3 | 74.1° | 96.5° |
| C9 | C10 | H8 | H9 | 123.8° | 122.2° |
| C10 | C9 | O1 | H44 | 180.0° | 61.4° |
| N1 | C9 | C10 | C11 | 15.2° | 2.6° |
| C9 | N1 | C5 | C60 | 135.2° | 115.0° |
| C9 | N1 | C5 | C4 | 143.5° | 141.7° |
| C9 | N1 | C60 | C11 | 34.1° | 41.5° |
| C9 | N1 | C60 | C61 | 86.3° | 74.6° |
| C9 | N1 | C60 | C63 | 154.6° | 160.7° |
| N1 | C9 | C10 | H8 | 103.4° | 116.3° |
| N1 | C9 | C10 | H9 | 134.0° | 121.5° |
| N1 | C9 | O1 | H44 | 59.5° | 178.7° |
| C10 | C11 | C60 | N1 | 43.7° | 38.9° |
| C10 | C11 | C60 | C12 | 130.2° | 118.2° |
| C10 | C11 | C60 | H3 | 111.3° | 118.4° |
| C10 | C11 | C12 | H3 | 115.7° | 123.7° |
| C10 | C11 | C60 | C61 | 73.6° | 78.7° |
| C10 | C11 | C60 | C63 | 163.9° | 159.1° |
| C10 | C11 | C12 | C13 | 66.2° | 27.9° |
| C10 | C11 | C12 | N16 | 113.6° | 152.6° |
| C11 | C10 | C9 | H7 | 99.8° | 121.9° |
| C11 | C10 | H8 | H9 | 123.8° | 122.1° |
| C1 | C2 | C3 | C4 | 179.5° | 179.7° |
| C1 | C2 | C3 | H13 | 0.5° | 0.0° |
| C2 | C1 | H14 | H15 | 120.0° | 120.0° |
| C2 | C1 | H14 | H16 | 120.0° | 120.0° |
| C2 | C1 | H15 | H16 | 120.0° | 120.0° |
| C2 | C3 | C4 | C5 | 1.1° | 0.5° |
| C2 | C3 | C4 | H13 | 180.0° | 179.7° |
| C2 | C3 | C4 | N19 | 179.7° | 179.8° |
| C3 | C2 | C1 | H14 | 90.2° | 90.3° |
| C3 | C2 | C1 | H15 | 29.8° | 29.8° |
| C3 | C2 | C1 | H16 | 149.7° | 149.8° |
| C5 | N1 | C60 | C11 | 102.5° | 75.3° |
| N1 | C5 | C4 | C3 | 179.2° | 179.8° |
| N1 | C5 | C4 | N19 | 2.1° | 0.1° |
| C5 | N1 | C60 | C61 | 137.2° | 168.6° |
| C5 | N1 | C60 | C63 | 18.1° | 43.9° |
| N1 | C5 | C6 | H2 | 1.2° | 0.0° |
| C5 | N1 | C9 | H7 | 11.4° | 27.2° |
| C4 | C5 | N1 | C60 | 8.3° | 26.7° |
| C5 | C4 | C3 | N19 | 178.7° | 179.7° |
| C5 | C4 | N19 | C63 | 8.1° | 7.3° |
| C5 | C4 | N19 | C64 | 171.8° | 172.7° |
| C4 | C5 | C6 | H2 | 179.7° | 180.0° |
| C5 | C4 | C3 | H13 | 178.9° | 179.8° |
| N1 | C60 | C61 | O13 | 26.8° | 42.7° |
| N1 | C60 | C11 | C61 | 117.2° | 117.6° |
| N1 | C60 | C11 | C63 | 120.2° | 120.2° |
| N1 | C60 | C11 | C12 | 173.9° | 157.2° |
| N1 | C60 | C61 | C63 | 123.8° | 125.2° |
| N1 | C60 | C61 | N17 | 153.3° | 137.2° |
| N1 | C60 | C63 | N19 | 23.8° | 39.5° |
| N1 | C60 | C63 | N18 | 159.0° | 137.8° |
| N1 | C60 | C11 | H3 | 67.6° | 79.5° |
| C60 | N1 | C9 | H7 | 127.8° | 146.9° |
| O13 | C61 | C60 | C11 | 82.4° | 70.2° |
| O13 | C61 | C60 | N17 | 180.0° | 179.9° |
| O13 | C61 | C60 | C63 | 150.6° | 167.9° |
| O13 | C61 | N17 | C62 | 169.0° | 177.4° |
| O13 | C61 | N17 | H40 | 10.9° | 2.6° |
| C60 | C11 | C12 | H3 | 118.1° | 123.4° |
| C11 | C60 | C61 | C63 | 127.0° | 121.9° |
| C11 | C60 | C61 | N17 | 97.5° | 109.9° |
| C60 | C11 | C12 | C13 | 60.0° | 85.0° |
| C60 | C11 | C12 | N16 | 120.2° | 94.5° |
| C11 | C60 | C63 | N19 | 86.7° | 75.4° |
| C11 | C60 | C63 | N18 | 90.5° | 107.3° |
| C60 | C11 | C10 | H8 | 81.9° | 140.6° |
| C60 | C11 | C10 | H9 | 155.5° | 97.2° |
| C12 | C11 | C60 | C61 | 56.7° | 39.6° |
| C12 | C11 | C60 | C63 | 65.9° | 82.6° |
| C11 | C12 | C13 | N16 | 179.8° | 179.5° |
| C11 | C12 | C13 | S1 | 158.7° | 180.0° |
| C11 | C12 | N16 | C14 | 162.5° | 179.8° |
| C12 | C11 | C10 | H8 | 51.3° | 101.1° |
| C12 | C11 | C10 | H9 | 71.3° | 21.0° |
| C11 | C12 | C13 | H11 | 21.3° | 0.0° |
| C3 | C4 | N19 | C63 | 173.3° | 172.4° |
| C3 | C4 | N19 | C64 | 6.9° | 7.6° |
| C4 | N19 | C63 | C60 | 19.3° | 13.4° |
| C4 | N19 | C63 | C64 | 179.8° | 180.0° |
| C4 | N19 | C63 | N18 | 163.3° | 164.0° |
| C4 | N19 | C64 | C65 | 92.2° | 90.0° |
| N19 | C4 | C3 | H13 | 0.2° | 0.1° |
| C4 | N19 | C64 | H23 | 147.1° | 30.1° |
| C4 | N19 | C64 | H24 | 28.5° | 150.0° |
| C61 | C60 | C63 | N19 | 145.8° | 163.9° |
| C61 | C60 | C63 | N18 | 36.9° | 13.4° |
| C60 | C61 | N17 | C62 | 11.0° | 2.5° |
| C61 | C60 | C11 | H3 | 175.1° | 162.9° |
| C60 | C61 | N17 | H40 | 169.0° | 177.5° |
| C63 | C60 | C61 | N17 | 29.4° | 12.0° |
| C60 | C63 | N19 | N18 | 177.4° | 177.4° |
| C60 | C63 | N19 | C64 | 160.5° | 166.6° |
| C60 | C63 | N18 | C62 | 22.3° | 5.1° |
| C63 | C60 | C11 | H3 | 52.6° | 40.7° |
| C61 | N17 | C62 | H40 | 180.0° | 180.0° |
| C61 | N17 | C62 | N18 | 8.5° | 7.5° |
| C61 | N17 | C62 | O14 | 174.0° | 172.5° |
| C12 | C13 | S1 | H11 | 180.0° | 179.9° |
| C13 | C12 | N16 | C14 | 17.7° | 0.3° |
| C12 | C13 | S1 | C14 | 14.0° | 0.5° |
| C13 | C12 | C11 | H3 | 178.1° | 151.6° |
| N16 | C12 | C13 | S1 | 21.5° | 0.5° |
| C12 | N16 | C14 | S1 | 5.8° | 0.1° |
| C12 | N16 | C14 | C15 | 176.5° | 179.7° |
| N16 | C12 | C11 | H3 | 2.1° | 28.9° |
| N16 | C12 | C13 | H11 | 158.5° | 179.5° |
| C13 | S1 | C14 | N16 | 5.0° | 0.3° |
| C13 | S1 | C14 | C15 | 172.6° | 180.0° |
| N16 | C14 | S1 | C15 | 177.5° | 179.7° |
| N16 | C14 | C15 | C16 | 105.2° | 90.3° |
| N16 | C14 | C15 | H17 | 16.9° | 149.6° |
| N16 | C14 | C15 | H18 | 132.7° | 29.7° |
| C63 | N19 | C64 | C65 | 88.0° | 90.0° |
| N19 | C63 | N18 | C62 | 160.4° | 172.2° |
| C63 | N19 | C64 | H23 | 32.7° | 149.9° |
| C63 | N19 | C64 | H24 | 151.3° | 30.0° |
| C64 | N19 | C63 | N18 | 16.9° | 16.0° |
| N19 | C64 | C65 | O15 | 46.6° | 60.0° |
| N19 | C64 | C65 | H23 | 120.7° | 120.0° |
| N19 | C64 | C65 | H24 | 120.7° | 120.0° |
| N19 | C64 | C65 | C66 | 164.2° | 180.0° |
| N19 | C64 | H23 | H24 | 117.7° | 119.9° |
| N19 | C64 | C65 | H25 | 74.4° | 60.0° |
| C63 | N18 | C62 | N17 | 2.8° | 6.2° |
| C63 | N18 | C62 | O14 | 179.7° | 173.7° |
| N17 | C62 | N18 | O14 | 177.4° | 180.0° |
| S1 | C14 | C15 | C16 | 72.2° | 90.1° |
| C14 | S1 | C13 | H11 | 166.0° | 179.6° |
| S1 | C14 | C15 | H17 | 165.7° | 30.0° |
| S1 | C14 | C15 | H18 | 49.9° | 150.0° |
| C14 | C15 | C16 | H17 | 122.1° | 120.1° |
| C14 | C15 | C16 | H18 | 122.1° | 120.0° |
| C14 | C15 | H17 | H18 | 113.1° | 120.0° |
| C14 | C15 | C16 | H19 | 180.0° | 179.9° |
| C14 | C15 | C16 | H20 | 60.0° | 60.0° |
| C14 | C15 | C16 | H21 | 60.0° | 60.0° |
| O15 | C65 | C64 | C66 | 117.7° | 120.0° |
| O15 | C65 | C64 | H25 | 121.0° | 120.0° |
| O15 | C65 | C66 | H25 | 120.1° | 120.0° |
| O15 | C65 | C66 | O16 | 172.1° | 180.0° |
| O15 | C65 | C66 | C67 | 66.1° | 60.0° |
| O15 | C65 | C64 | H23 | 167.3° | 60.0° |
| O15 | C65 | C64 | H24 | 74.2° | 180.0° |
| O15 | C65 | C66 | H26 | 53.5° | 60.1° |
| C64 | C65 | C66 | H25 | 121.3° | 120.0° |
| C64 | C65 | C66 | O16 | 53.5° | 60.0° |
| C64 | C65 | C66 | C67 | 175.3° | 180.0° |
| C65 | C64 | H23 | H24 | 117.7° | 120.0° |
| C64 | C65 | C66 | H26 | 65.1° | 59.9° |
| C64 | C65 | O15 | H45 | 180.0° | 60.0° |
| N18 | C62 | N17 | H40 | 171.5° | 172.5° |
| O14 | C62 | N17 | H40 | 6.0° | 7.5° |
| C16 | C15 | H17 | H18 | 113.1° | 120.0° |
| C15 | C16 | H19 | H20 | 120.0° | 120.0° |
| C15 | C16 | H19 | H21 | 120.0° | 120.0° |
| C15 | C16 | H20 | H21 | 120.0° | 120.0° |
| C65 | C66 | O16 | C67 | 127.0° | 120.0° |
| C65 | C66 | O16 | H26 | 117.7° | 119.9° |
| C65 | C66 | C67 | H26 | 119.6° | 120.0° |
| C65 | C66 | C67 | O17 | 40.5° | 60.0° |
| C65 | C66 | C67 | C68 | 161.5° | 180.0° |
| C66 | C65 | C64 | H23 | 75.1° | 60.0° |
| C66 | C65 | C64 | H24 | 43.5° | 60.0° |
| C65 | C66 | C67 | H27 | 79.4° | 60.0° |
| C66 | C65 | O15 | H45 | 59.0° | 60.0° |
| C65 | C66 | O16 | H46 | 180.0° | 60.0° |
| O26 | C77 | C78 | C71 | 125.2° | 118.1° |
| O26 | C77 | C78 | H36 | 122.4° | 123.6° |
| O26 | C77 | C71 | H36 | 122.5° | 123.6° |
| O26 | C77 | C78 | O27 | 37.7° | 20.3° |
| O26 | C77 | C78 | C70 | 156.7° | 139.0° |
| O26 | C77 | C71 | N20 | 72.8° | 86.3° |
| O26 | C77 | C71 | O25 | 171.1° | 155.2° |
| O26 | C77 | C71 | H33 | 52.6° | 36.7° |
| O26 | C77 | C78 | H37 | 85.7° | 102.3° |
| O16 | C66 | C67 | H26 | 116.2° | 120.0° |
| O16 | C66 | C67 | O17 | 164.6° | 180.0° |
| O16 | C66 | C67 | C68 | 74.3° | 60.0° |
| O16 | C66 | C65 | H25 | 67.8° | 60.0° |
| O16 | C66 | C67 | H27 | 44.8° | 60.0° |
| C66 | C67 | O17 | C68 | 122.2° | 120.0° |
| C66 | C67 | O17 | H27 | 119.0° | 120.0° |
| C66 | C67 | C68 | H27 | 119.0° | 120.0° |
| C66 | C67 | C68 | O18 | 173.6° | 175.0° |
| C67 | C66 | C65 | H25 | 54.0° | 60.0° |
| C66 | C67 | C68 | H28 | 53.4° | 55.0° |
| C66 | C67 | C68 | H29 | 66.1° | 65.0° |
| C67 | C66 | O16 | H46 | 53.0° | 60.0° |
| C66 | C67 | O17 | H47 | 180.0° | 60.0° |
| O17 | C67 | C68 | H27 | 119.5° | 120.0° |
| O17 | C67 | C68 | O18 | 64.9° | 65.0° |
| O17 | C67 | C66 | H26 | 79.1° | 60.0° |
| O17 | C67 | C68 | H28 | 174.9° | 175.0° |
| O17 | C67 | C68 | H29 | 55.4° | 55.0° |
| C78 | C77 | C71 | H36 | 112.3° | 118.2° |
| C77 | C78 | O27 | C70 | 113.4° | 114.8° |
| C77 | C78 | O27 | H37 | 122.4° | 122.6° |
| C77 | C78 | C70 | H37 | 117.7° | 118.7° |
| C78 | C77 | C71 | N20 | 162.0° | 155.6° |
| C78 | C77 | C71 | O25 | 45.9° | 37.0° |
| C77 | C78 | C70 | O25 | 7.6° | 2.0° |
| C77 | C78 | C70 | C69 | 112.9° | 121.4° |
| C77 | C78 | C70 | H32 | 124.1° | 117.5° |
| C78 | C77 | C71 | H33 | 72.6° | 81.4° |
| C78 | C77 | O26 | H50 | 180.0° | 61.5° |
| C77 | C78 | O27 | H51 | 180.0° | 61.4° |
| C71 | C77 | C78 | O27 | 87.5° | 97.8° |
| C71 | C77 | C78 | C70 | 31.5° | 20.9° |
| C77 | C71 | N20 | C72 | 36.1° | 90.5° |
| C77 | C71 | N20 | O25 | 113.0° | 114.1° |
| C77 | C71 | N20 | H33 | 124.9° | 123.0° |
| C77 | C71 | N20 | C76 | 143.2° | 89.4° |
| C77 | C71 | O25 | H33 | 117.2° | 118.5° |
| C77 | C71 | O25 | C70 | 43.3° | 40.1° |
| C71 | C77 | C78 | H37 | 149.1° | 139.6° |
| C71 | C77 | O26 | H50 | 63.3° | 174.2° |
| O22 | P2 | O23 | O21 | 123.9° | 120.0° |
| O22 | P2 | O23 | O24 | 127.2° | 120.0° |
| O22 | P2 | O21 | O24 | 115.3° | 120.0° |
| O22 | P2 | O21 | P1 | 164.3° | 39.9° |
| O22 | P2 | O24 | C69 | 24.6° | 54.9° |
| O22 | P2 | O23 | H49 | 0.0° | 180.0° |
| O27 | C78 | C70 | H37 | 125.2° | 122.6° |
| O27 | C78 | C70 | O25 | 109.6° | 120.7° |
| O27 | C78 | C70 | C69 | 129.9° | 119.8° |
| O27 | C78 | C70 | H32 | 6.9° | 1.2° |
| O27 | C78 | C77 | H36 | 160.1° | 144.0° |
| C78 | C70 | O25 | C71 | 22.2° | 26.5° |
| C78 | C70 | O25 | C69 | 126.6° | 119.4° |
| C78 | C70 | O25 | H32 | 115.7° | 119.6° |
| C78 | C70 | C69 | H32 | 122.8° | 121.2° |
| C78 | C70 | C69 | O24 | 63.1° | 175.7° |
| C78 | C70 | C69 | H30 | 56.8° | 55.8° |
| C78 | C70 | C69 | H31 | 176.9° | 64.3° |
| C70 | C78 | C77 | H36 | 80.9° | 97.3° |
| C70 | C78 | O27 | H51 | 66.5° | 176.2° |
| N21 | C72 | N20 | H34 | 180.0° | 179.8° |
| N21 | C72 | N20 | C71 | 179.8° | 179.9° |
| N21 | C72 | N20 | C76 | 0.4° | 0.0° |
| C72 | N21 | C73 | C76 | 0.4° | 0.0° |
| C72 | N21 | C73 | C74 | 179.6° | 180.0° |
| N20 | C72 | N21 | C73 | 0.5° | 0.0° |
| C72 | N20 | C71 | C76 | 179.3° | 179.9° |
| C72 | N20 | C71 | O25 | 76.9° | 23.6° |
| C72 | N20 | C76 | C73 | 0.1° | 0.0° |
| C72 | N20 | C76 | N24 | 179.2° | 179.9° |
| C72 | N20 | C71 | H33 | 161.0° | 146.5° |
| C67 | C68 | O18 | H28 | 120.2° | 119.9° |
| C67 | C68 | O18 | H29 | 120.2° | 120.0° |
| C67 | C68 | O18 | P1 | 169.1° | 180.0° |
| C68 | C67 | C66 | H26 | 41.9° | 60.0° |
| C67 | C68 | H28 | H29 | 119.3° | 119.9° |
| C68 | C67 | O17 | H47 | 57.8° | 60.0° |
| O23 | P2 | O21 | O24 | 114.4° | 120.0° |
| O23 | P2 | O21 | P1 | 34.0° | 80.0° |
| O23 | P2 | O24 | C69 | 156.6° | 65.0° |
| N21 | C73 | C76 | N20 | 0.2° | 0.0° |
| N21 | C73 | C76 | C74 | 179.3° | 180.0° |
| N21 | C73 | C74 | N22 | 0.4° | 0.0° |
| N21 | C73 | C76 | N24 | 179.5° | 180.0° |
| N21 | C73 | C74 | N23 | 179.1° | 180.0° |
| C73 | N21 | C72 | H34 | 179.5° | 179.8° |
| O21 | P2 | O24 | C69 | 88.8° | 175.0° |
| P2 | O21 | P1 | O18 | 66.3° | 160.0° |
| P2 | O21 | P1 | O19 | 174.8° | 40.0° |
| P2 | O21 | P1 | O20 | 42.0° | 79.9° |
| O21 | P2 | O23 | H49 | 123.9° | 60.0° |
| P2 | O24 | C69 | C70 | 123.4° | 180.0° |
| O24 | P2 | O21 | P1 | 80.3° | 160.0° |
| P2 | O24 | C69 | H30 | 3.4° | 60.0° |
| P2 | O24 | C69 | H31 | 116.7° | 60.0° |
| O24 | P2 | O23 | H49 | 127.2° | 60.1° |
| C68 | O18 | P1 | O21 | 61.5° | 175.0° |
| C68 | O18 | P1 | O19 | 51.7° | 54.9° |
| C68 | O18 | P1 | O20 | 178.3° | 65.0° |
| O18 | C68 | C67 | H27 | 54.6° | 55.0° |
| O18 | C68 | H28 | H29 | 119.3° | 120.1° |
| N20 | C71 | O25 | H33 | 121.6° | 122.9° |
| C71 | N20 | C76 | C73 | 179.5° | 179.9° |
| C71 | N20 | C76 | N24 | 0.2° | 0.1° |
| N20 | C71 | O25 | C70 | 164.5° | 158.7° |
| C71 | N20 | C72 | H34 | 0.2° | 0.3° |
| N20 | C71 | C77 | H36 | 49.6° | 37.3° |
| C76 | N20 | C71 | O25 | 103.8° | 156.5° |
| N20 | C76 | C73 | N24 | 179.3° | 179.9° |
| N20 | C76 | C73 | C74 | 179.5° | 180.0° |
| N20 | C76 | N24 | C75 | 179.5° | 179.9° |
| C76 | N20 | C71 | H33 | 18.3° | 33.6° |
| C76 | N20 | C72 | H34 | 179.7° | 179.8° |
| C71 | O25 | C70 | C69 | 148.8° | 145.9° |
| C71 | O25 | C70 | H32 | 93.5° | 93.1° |
| O25 | C71 | C77 | H36 | 66.4° | 81.2° |
| C76 | C73 | C74 | N22 | 179.5° | 180.0° |
| C76 | C73 | C74 | N23 | 0.1° | 0.0° |
| C73 | C76 | N24 | C75 | 1.4° | 0.0° |
| C73 | C74 | N22 | N23 | 179.5° | 180.0° |
| C74 | C73 | C76 | N24 | 1.1° | 0.0° |
| C73 | C74 | N23 | C75 | 0.8° | 0.1° |
| C73 | C74 | N22 | H42 | 179.5° | 0.0° |
| C73 | C74 | N22 | H43 | 59.5° | 180.0° |
| N22 | C74 | N23 | C75 | 179.7° | 180.0° |
| C74 | N22 | H42 | H43 | 120.0° | 180.0° |
| C76 | N24 | C75 | N23 | 0.5° | 0.1° |
| C76 | N24 | C75 | H35 | 179.5° | 180.0° |
| O25 | C70 | C69 | H32 | 118.2° | 121.0° |
| O25 | C70 | C69 | O24 | 177.9° | 66.5° |
| O25 | C70 | C69 | H30 | 62.1° | 173.6° |
| O25 | C70 | C69 | H31 | 58.0° | 53.5° |
| C70 | O25 | C71 | H33 | 73.9° | 78.4° |
| O25 | C70 | C78 | H37 | 125.2° | 116.7° |
| C70 | C69 | O24 | H30 | 119.9° | 120.0° |
| C70 | C69 | O24 | H31 | 119.9° | 120.0° |
| C70 | C69 | H30 | H31 | 120.2° | 120.0° |
| C69 | C70 | C78 | H37 | 4.8° | 2.8° |
| C74 | N23 | C75 | N24 | 0.6° | 0.1° |
| C74 | N23 | C75 | H35 | 179.4° | 180.0° |
| N23 | C74 | N22 | H42 | 0.0° | 180.0° |
| N23 | C74 | N22 | H43 | 120.0° | 0.0° |
| O21 | P1 | O18 | O19 | 113.2° | 120.0° |
| O21 | P1 | O18 | O20 | 116.8° | 120.0° |
| O21 | P1 | O19 | O20 | 129.0° | 120.0° |
| O21 | P1 | O20 | H48 | 125.7° | 60.0° |
| O24 | C69 | H30 | H31 | 120.2° | 120.0° |
| O24 | C69 | C70 | H32 | 59.7° | 54.6° |
| O18 | P1 | O19 | O20 | 120.4° | 120.0° |
| P1 | O18 | C68 | H28 | 48.9° | 60.1° |
| P1 | O18 | C68 | H29 | 70.7° | 60.0° |
| O18 | P1 | O20 | H48 | 126.2° | 60.0° |
| N24 | C75 | N23 | H35 | 180.0° | 179.9° |
| O19 | P1 | O20 | H48 | 0.0° | 180.0° |
| H3 | C11 | C10 | H8 | 167.2° | 22.4° |
| H3 | C11 | C10 | H9 | 44.6° | 144.5° |
| H4 | C8 | H5 | H6 | 120.0° | 120.0° |
| H7 | C9 | C10 | H8 | 141.5° | 3.0° |
| H7 | C9 | C10 | H9 | 18.9° | 119.2° |
| H7 | C9 | O1 | H44 | 61.5° | 60.0° |
| H14 | C1 | H15 | H16 | 120.0° | 120.0° |
| H17 | C15 | C16 | H19 | 57.9° | 60.0° |
| H17 | C15 | C16 | H20 | 178.0° | 179.9° |
| H17 | C15 | C16 | H21 | 62.1° | 60.1° |
| H18 | C15 | C16 | H19 | 57.9° | 60.0° |
| H18 | C15 | C16 | H20 | 62.1° | 60.0° |
| H18 | C15 | C16 | H21 | 177.9° | 180.0° |
| H19 | C16 | H20 | H21 | 120.0° | 120.0° |
| H23 | C64 | C65 | H25 | 46.3° | 180.0° |
| H24 | C64 | C65 | H25 | 164.8° | 60.0° |
| H25 | C65 | C66 | H26 | 173.6° | 180.0° |
| H25 | C65 | O15 | H45 | 60.0° | 180.0° |
| H26 | C66 | C67 | H27 | 161.0° | 180.0° |
| H26 | C66 | O16 | H46 | 62.3° | 180.0° |
| H27 | C67 | C68 | H28 | 65.6° | 65.0° |
| H27 | C67 | C68 | H29 | 174.9° | 175.0° |
| H27 | C67 | O17 | H47 | 61.0° | 180.0° |
| H30 | C69 | C70 | H32 | 179.6° | 65.4° |
| H31 | C69 | C70 | H32 | 60.2° | 174.6° |
| H32 | C70 | C78 | H37 | 118.2° | 123.8° |
| H33 | C71 | C77 | H36 | 175.1° | 160.4° |
| H36 | C77 | C78 | H37 | 36.7° | 21.4° |
| H36 | C77 | O26 | H50 | 58.4° | 62.2° |
| H37 | C78 | O27 | H51 | 57.6° | 61.2° |
