E5P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C89 | C95 | sing | 1.53Å | 1.50Å | |
| C89 | C91 | sing | 1.53Å | 1.49Å | |
| C89 | C82 | sing | 1.51Å | 1.54Å | |
| C83 | C82 | doub | 1.38Å | 1.39Å | Aromatic |
| C83 | C85 | sing | 1.38Å | 1.38Å | Aromatic |
| C82 | C80 | sing | 1.38Å | 1.39Å | Aromatic |
| C85 | C87 | doub | 1.38Å | 1.39Å | Aromatic |
| C80 | C79 | doub | 1.38Å | 1.39Å | Aromatic |
| C87 | C79 | sing | 1.38Å | 1.39Å | Aromatic |
| C79 | C76 | sing | 1.51Å | 1.51Å | |
| C76 | N74 | sing | 1.47Å | 1.47Å | |
| N74 | C71 | sing | 1.47Å | 1.48Å | |
| C71 | C67 | sing | 1.53Å | 1.53Å | |
| O69 | C67 | sing | 1.43Å | 1.43Å | |
| O44 | C43 | doub | 1.23Å | 1.23Å | |
| C67 | C3 | sing | 1.54Å | 1.52Å | |
| C63 | C8 | sing | 1.52Å | 1.53Å | |
| C3 | C5 | sing | 1.53Å | 1.53Å | |
| C3 | N1 | sing | 1.46Å | 1.46Å | |
| C43 | N1 | sing | 1.33Å | 1.33Å | |
| C43 | C30 | sing | 1.47Å | 1.48Å | |
| O42 | C40 | sing | 1.35Å | 1.37Å | Aromatic |
| O42 | C36 | sing | 1.34Å | 1.37Å | Aromatic |
| C5 | C8 | sing | 1.53Å | 1.54Å | |
| C40 | C38 | doub | 1.35Å | 1.33Å | Aromatic |
| C8 | C10 | sing | 1.52Å | 1.55Å | |
| C31 | C30 | doub | 1.40Å | 1.39Å | Aromatic |
| C31 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
| C30 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
| C36 | C33 | sing | 1.48Å | 1.46Å | |
| C36 | N37 | doub | 1.31Å | 1.30Å | Aromatic |
| C38 | N37 | sing | 1.34Å | 1.38Å | Aromatic |
| C33 | C34 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C13 | sing | 1.52Å | 1.53Å | |
| C13 | C16 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C19 | sing | 1.53Å | 1.55Å | |
| C34 | C27 | sing | 1.40Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.48Å | 1.51Å | |
| C19 | C22 | sing | 1.53Å | 1.57Å | |
| C22 | N25 | sing | 1.48Å | 1.51Å | |
| C26 | N25 | sing | 1.37Å | 1.37Å | |
| C26 | O45 | doub | 1.22Å | 1.21Å | |
| N25 | C46 | sing | 1.47Å | 1.50Å | |
| C61 | C59 | doub | 1.38Å | 1.38Å | Aromatic |
| C61 | C52 | sing | 1.38Å | 1.39Å | Aromatic |
| C46 | C48 | sing | 1.53Å | 1.52Å | |
| C46 | C52 | sing | 1.51Å | 1.53Å | |
| C59 | C57 | sing | 1.38Å | 1.38Å | Aromatic |
| C52 | C53 | doub | 1.38Å | 1.39Å | Aromatic |
| C57 | C55 | doub | 1.38Å | 1.38Å | Aromatic |
| C53 | C55 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | H1 | sing | 1.08Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.11Å | 1.10Å | |
| C10 | H5 | sing | 1.10Å | 1.10Å | |
| C10 | H6 | sing | 1.10Å | 1.10Å | |
| C13 | H7 | sing | 1.08Å | 1.10Å | |
| C13 | H8 | sing | 1.11Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.10Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C28 | H15 | sing | 1.08Å | 1.08Å | |
| C31 | H16 | sing | 1.08Å | 1.08Å | |
| C34 | H17 | sing | 1.08Å | 1.08Å | |
| C38 | H18 | sing | 1.08Å | 1.08Å | |
| C40 | H19 | sing | 1.08Å | 1.08Å | |
| C46 | H20 | sing | 1.09Å | 1.10Å | |
| C48 | H21 | sing | 1.09Å | 1.10Å | |
| C48 | H22 | sing | 1.09Å | 1.10Å | |
| C48 | H23 | sing | 1.09Å | 1.10Å | |
| C53 | H24 | sing | 1.08Å | 1.08Å | |
| C55 | H25 | sing | 1.08Å | 1.08Å | |
| C57 | H26 | sing | 1.08Å | 1.08Å | |
| C59 | H27 | sing | 1.08Å | 1.08Å | |
| C61 | H28 | sing | 1.08Å | 1.08Å | |
| C63 | H29 | sing | 1.09Å | 1.10Å | |
| C63 | H30 | sing | 1.09Å | 1.10Å | |
| C63 | H31 | sing | 1.09Å | 1.10Å | |
| C67 | H32 | sing | 1.09Å | 1.10Å | |
| C71 | H33 | sing | 1.09Å | 1.10Å | |
| C71 | H34 | sing | 1.09Å | 1.10Å | |
| C76 | H35 | sing | 1.09Å | 1.10Å | |
| C76 | H36 | sing | 1.09Å | 1.10Å | |
| C80 | H37 | sing | 1.08Å | 1.08Å | |
| C83 | H38 | sing | 1.08Å | 1.08Å | |
| C85 | H39 | sing | 1.08Å | 1.08Å | |
| C87 | H40 | sing | 1.08Å | 1.08Å | |
| C89 | H41 | sing | 1.09Å | 1.10Å | |
| C91 | H42 | sing | 1.09Å | 1.10Å | |
| C91 | H43 | sing | 1.09Å | 1.10Å | |
| C91 | H44 | sing | 1.09Å | 1.10Å | |
| C95 | H45 | sing | 1.09Å | 1.10Å | |
| C95 | H46 | sing | 1.09Å | 1.10Å | |
| C95 | H47 | sing | 1.09Å | 1.10Å | |
| N1 | H48 | sing | 0.98Å | 1.00Å | |
| N74 | H49 | sing | 1.01Å | 1.00Å | |
| O69 | H51 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C95 | C89 | C91 | 110.4° | 109.5° |
| C95 | C89 | C82 | 112.4° | 109.5° |
| C95 | C89 | H41 | 107.0° | 109.5° |
| C89 | C95 | H45 | 109.5° | 109.5° |
| C89 | C95 | H46 | 109.4° | 109.5° |
| C89 | C95 | H47 | 109.5° | 109.5° |
| C91 | C89 | C82 | 113.0° | 109.5° |
| C91 | C89 | H41 | 107.1° | 109.5° |
| C89 | C91 | H42 | 109.5° | 109.5° |
| C89 | C91 | H43 | 109.5° | 109.5° |
| C89 | C91 | H44 | 109.4° | 109.4° |
| C89 | C82 | C83 | 120.1° | 120.0° |
| C89 | C82 | C80 | 121.2° | 120.0° |
| C82 | C89 | H41 | 106.6° | 109.5° |
| C82 | C83 | C85 | 120.5° | 120.0° |
| C83 | C82 | C80 | 118.6° | 120.0° |
| C82 | C83 | H38 | 119.7° | 120.0° |
| C83 | C85 | C87 | 120.1° | 120.0° |
| C85 | C83 | H38 | 119.7° | 120.0° |
| C83 | C85 | H39 | 119.9° | 120.0° |
| C82 | C80 | C79 | 121.7° | 120.0° |
| C82 | C80 | H37 | 119.1° | 120.0° |
| C85 | C87 | C79 | 120.6° | 120.0° |
| C87 | C85 | H39 | 119.9° | 120.0° |
| C85 | C87 | H40 | 119.7° | 120.0° |
| C80 | C79 | C87 | 118.4° | 120.0° |
| C80 | C79 | C76 | 120.9° | 120.0° |
| C79 | C80 | H37 | 119.1° | 120.0° |
| C87 | C79 | C76 | 120.7° | 120.0° |
| C79 | C87 | H40 | 119.7° | 120.0° |
| C79 | C76 | N74 | 114.1° | 109.5° |
| C79 | C76 | H35 | 108.3° | 109.5° |
| C79 | C76 | H36 | 108.3° | 109.5° |
| C76 | N74 | C71 | 113.1° | 111.1° |
| N74 | C76 | H35 | 108.3° | 109.4° |
| N74 | C76 | H36 | 108.3° | 109.4° |
| C76 | N74 | H49 | 108.6° | 111.0° |
| N74 | C71 | C67 | 106.2° | 109.5° |
| N74 | C71 | H33 | 110.3° | 109.5° |
| N74 | C71 | H34 | 110.3° | 109.4° |
| C71 | N74 | H49 | 108.6° | 111.0° |
| C71 | C67 | O69 | 109.4° | 109.4° |
| C71 | C67 | C3 | 113.0° | 109.5° |
| C71 | C67 | H32 | 108.0° | 109.5° |
| C67 | C71 | H33 | 110.3° | 109.5° |
| C67 | C71 | H34 | 110.3° | 109.5° |
| O69 | C67 | C3 | 108.7° | 109.5° |
| O69 | C67 | H32 | 109.4° | 109.5° |
| C67 | O69 | H51 | 109.5° | 114.0° |
| O44 | C43 | N1 | 122.9° | 116.8° |
| O44 | C43 | C30 | 121.4° | 116.7° |
| C67 | C3 | C5 | 111.3° | 108.5° |
| C67 | C3 | N1 | 112.6° | 108.8° |
| C67 | C3 | H1 | 107.8° | 108.2° |
| C3 | C67 | H32 | 108.2° | 109.5° |
| C63 | C8 | C5 | 110.2° | 110.5° |
| C63 | C8 | C10 | 112.1° | 114.1° |
| C63 | C8 | H4 | 107.4° | 107.5° |
| C8 | C63 | H29 | 109.5° | 109.5° |
| C8 | C63 | H30 | 109.5° | 109.5° |
| C8 | C63 | H31 | 109.5° | 109.4° |
| C5 | C3 | N1 | 108.6° | 108.9° |
| C3 | C5 | C8 | 110.5° | 111.4° |
| C5 | C3 | H1 | 107.7° | 110.6° |
| C3 | C5 | H2 | 109.2° | 108.9° |
| C3 | C5 | H3 | 109.2° | 109.4° |
| C3 | N1 | C43 | 123.1° | 127.8° |
| N1 | C3 | H1 | 108.6° | 111.8° |
| C3 | N1 | H48 | 118.5° | 115.9° |
| N1 | C43 | C30 | 115.7° | 126.5° |
| C43 | N1 | H48 | 118.5° | 116.2° |
| C43 | C30 | C31 | 122.0° | 118.6° |
| C43 | C30 | C28 | 117.9° | 121.9° |
| C40 | O42 | C36 | 105.0° | 107.6° |
| O42 | C40 | C38 | 107.8° | 107.3° |
| O42 | C40 | H19 | 126.1° | 126.3° |
| O42 | C36 | C33 | 118.7° | 125.7° |
| O42 | C36 | N37 | 112.1° | 108.6° |
| C5 | C8 | C10 | 112.4° | 110.2° |
| C8 | C5 | H2 | 109.2° | 108.8° |
| C8 | C5 | H3 | 109.2° | 109.5° |
| C5 | C8 | H4 | 107.3° | 106.8° |
| C40 | C38 | N37 | 109.3° | 107.8° |
| C40 | C38 | H18 | 125.3° | 126.1° |
| C38 | C40 | H19 | 126.0° | 126.3° |
| C8 | C10 | C13 | 115.6° | 115.3° |
| C10 | C8 | H4 | 107.2° | 107.3° |
| C8 | C10 | H5 | 107.9° | 108.7° |
| C8 | C10 | H6 | 107.9° | 109.2° |
| C30 | C31 | C33 | 119.9° | 119.6° |
| C31 | C30 | C28 | 120.1° | 119.5° |
| C30 | C31 | H16 | 120.0° | 120.0° |
| C31 | C33 | C36 | 120.0° | 119.5° |
| C31 | C33 | C34 | 119.8° | 120.9° |
| C33 | C31 | H16 | 120.0° | 120.4° |
| C30 | C28 | C27 | 120.3° | 121.0° |
| C30 | C28 | H15 | 119.8° | 119.4° |
| C33 | C36 | N37 | 129.0° | 125.8° |
| C36 | C33 | C34 | 120.0° | 119.6° |
| C36 | N37 | C38 | 105.7° | 108.6° |
| N37 | C38 | H18 | 125.4° | 126.0° |
| C33 | C34 | C27 | 120.5° | 119.2° |
| C33 | C34 | H17 | 119.8° | 120.4° |
| C10 | C13 | C16 | 114.6° | 110.6° |
| C13 | C10 | H5 | 107.9° | 108.5° |
| C13 | C10 | H6 | 107.9° | 108.9° |
| C10 | C13 | H7 | 108.2° | 114.8° |
| C10 | C13 | H8 | 108.2° | 107.6° |
| C13 | C16 | C19 | 115.8° | 109.5° |
| C16 | C13 | H7 | 108.2° | 111.2° |
| C16 | C13 | H8 | 108.1° | 106.7° |
| C13 | C16 | H9 | 107.8° | 109.1° |
| C13 | C16 | H10 | 107.9° | 109.5° |
| C28 | C27 | C34 | 119.2° | 119.7° |
| C28 | C27 | C26 | 124.1° | 121.6° |
| C27 | C28 | H15 | 119.9° | 119.6° |
| C16 | C19 | C22 | 110.5° | 110.2° |
| C19 | C16 | H9 | 107.9° | 109.7° |
| C19 | C16 | H10 | 107.8° | 110.0° |
| C16 | C19 | H11 | 109.2° | 110.3° |
| C16 | C19 | H12 | 109.2° | 108.5° |
| C34 | C27 | C26 | 116.0° | 118.7° |
| C27 | C34 | H17 | 119.7° | 120.3° |
| C27 | C26 | N25 | 123.5° | 120.9° |
| C27 | C26 | O45 | 117.2° | 118.8° |
| C19 | C22 | N25 | 114.9° | 109.4° |
| C22 | C19 | H11 | 109.2° | 110.5° |
| C22 | C19 | H12 | 109.2° | 108.7° |
| C19 | C22 | H13 | 108.1° | 110.0° |
| C19 | C22 | H14 | 108.1° | 109.7° |
| C22 | N25 | C26 | 119.9° | 113.6° |
| C22 | N25 | C46 | 119.2° | 122.9° |
| N25 | C22 | H13 | 108.1° | 109.7° |
| N25 | C22 | H14 | 108.1° | 109.3° |
| N25 | C26 | O45 | 119.1° | 120.1° |
| C26 | N25 | C46 | 120.7° | 123.4° |
| N25 | C46 | C48 | 112.1° | 109.5° |
| N25 | C46 | C52 | 110.6° | 109.4° |
| N25 | C46 | H20 | 106.9° | 109.5° |
| C59 | C61 | C52 | 120.6° | 120.0° |
| C61 | C59 | C57 | 120.3° | 120.0° |
| C61 | C59 | H27 | 119.8° | 120.0° |
| C59 | C61 | H28 | 119.7° | 119.9° |
| C61 | C52 | C46 | 121.2° | 120.0° |
| C61 | C52 | C53 | 118.5° | 120.0° |
| C52 | C61 | H28 | 119.7° | 120.0° |
| C48 | C46 | C52 | 113.6° | 109.5° |
| C48 | C46 | H20 | 106.6° | 109.5° |
| C46 | C48 | H21 | 109.5° | 109.4° |
| C46 | C48 | H22 | 109.5° | 109.5° |
| C46 | C48 | H23 | 109.5° | 109.4° |
| C46 | C52 | C53 | 120.3° | 120.0° |
| C52 | C46 | H20 | 106.5° | 109.5° |
| C59 | C57 | C55 | 119.7° | 120.0° |
| C59 | C57 | H26 | 120.2° | 120.0° |
| C57 | C59 | H27 | 119.9° | 120.0° |
| C52 | C53 | C55 | 120.8° | 120.0° |
| C52 | C53 | H24 | 119.6° | 120.0° |
| C57 | C55 | C53 | 120.1° | 120.0° |
| C57 | C55 | H25 | 119.9° | 120.0° |
| C55 | C57 | H26 | 120.1° | 120.0° |
| C55 | C53 | H24 | 119.6° | 120.0° |
| C53 | C55 | H25 | 119.9° | 120.0° |
| H2 | C5 | H3 | 109.5° | 108.7° |
| H5 | C10 | H6 | 109.5° | 105.8° |
| H7 | C13 | H8 | 109.5° | 105.4° |
| H9 | C16 | H10 | 109.5° | 108.9° |
| H11 | C19 | H12 | 109.5° | 108.5° |
| H13 | C22 | H14 | 109.5° | 108.8° |
| H21 | C48 | H22 | 109.5° | 109.5° |
| H21 | C48 | H23 | 109.4° | 109.5° |
| H22 | C48 | H23 | 109.5° | 109.5° |
| H29 | C63 | H30 | 109.5° | 109.5° |
| H29 | C63 | H31 | 109.5° | 109.4° |
| H30 | C63 | H31 | 109.5° | 109.5° |
| H33 | C71 | H34 | 109.5° | 109.5° |
| H35 | C76 | H36 | 109.4° | 109.6° |
| H42 | C91 | H43 | 109.5° | 109.5° |
| H42 | C91 | H44 | 109.5° | 109.5° |
| H43 | C91 | H44 | 109.5° | 109.4° |
| H45 | C95 | H46 | 109.5° | 109.5° |
| H45 | C95 | H47 | 109.5° | 109.5° |
| H46 | C95 | H47 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C95 | C89 | C91 | C82 | 126.8° | 120.0° |
| C95 | C89 | C91 | H41 | 116.1° | 120.0° |
| C95 | C89 | C82 | H41 | 116.8° | 120.0° |
| C95 | C89 | C82 | C83 | 141.4° | 59.9° |
| C95 | C89 | C82 | C80 | 36.4° | 120.0° |
| C95 | C89 | C91 | H42 | 180.0° | 60.0° |
| C95 | C89 | C91 | H43 | 60.0° | 180.0° |
| C95 | C89 | C91 | H44 | 60.0° | 60.1° |
| C89 | C95 | H45 | H46 | 120.0° | 120.0° |
| C89 | C95 | H45 | H47 | 120.0° | 120.0° |
| C89 | C95 | H46 | H47 | 120.0° | 120.0° |
| C91 | C89 | C82 | H41 | 117.4° | 120.0° |
| C91 | C89 | C82 | C83 | 92.8° | 60.1° |
| C91 | C89 | C82 | C80 | 89.3° | 120.0° |
| C89 | C91 | H42 | H43 | 120.0° | 120.0° |
| C89 | C91 | H42 | H44 | 120.0° | 120.0° |
| C89 | C91 | H43 | H44 | 120.0° | 119.9° |
| C91 | C89 | C95 | H45 | 180.0° | 180.0° |
| C91 | C89 | C95 | H46 | 60.0° | 60.0° |
| C91 | C89 | C95 | H47 | 60.0° | 60.0° |
| C89 | C82 | C83 | C80 | 177.9° | 179.9° |
| C89 | C82 | C83 | C85 | 179.0° | 180.0° |
| C89 | C82 | C80 | C79 | 179.3° | 179.9° |
| C89 | C82 | C80 | H37 | 0.7° | 0.0° |
| C89 | C82 | C83 | H38 | 1.0° | 0.0° |
| C82 | C89 | C91 | H42 | 53.2° | 180.0° |
| C82 | C89 | C91 | H43 | 66.8° | 60.0° |
| C82 | C89 | C91 | H44 | 173.2° | 59.9° |
| C82 | C89 | C95 | H45 | 52.9° | 60.0° |
| C82 | C89 | C95 | H46 | 172.9° | 180.0° |
| C82 | C89 | C95 | H47 | 67.2° | 60.0° |
| C82 | C83 | C85 | H38 | 180.0° | 180.0° |
| C82 | C83 | C85 | C87 | 0.3° | 0.2° |
| C83 | C82 | C80 | C79 | 1.4° | 0.0° |
| C83 | C82 | C80 | H37 | 178.6° | 179.9° |
| C82 | C83 | C85 | H39 | 179.7° | 180.0° |
| C83 | C82 | C89 | H41 | 24.6° | 179.9° |
| C85 | C83 | C82 | C80 | 1.1° | 0.1° |
| C83 | C85 | C87 | H39 | 180.0° | 179.8° |
| C83 | C85 | C87 | C79 | 0.1° | 0.5° |
| C83 | C85 | C87 | H40 | 179.9° | 180.0° |
| C82 | C80 | C79 | H37 | 180.0° | 179.9° |
| C82 | C80 | C79 | C87 | 1.0° | 0.3° |
| C82 | C80 | C79 | C76 | 179.8° | 180.0° |
| C80 | C82 | C83 | H38 | 178.9° | 180.0° |
| C80 | C82 | C89 | H41 | 153.3° | 0.0° |
| C85 | C87 | C79 | C80 | 0.2° | 0.5° |
| C85 | C87 | C79 | H40 | 180.0° | 179.5° |
| C85 | C87 | C79 | C76 | 179.4° | 179.7° |
| C87 | C85 | C83 | H38 | 179.6° | 179.8° |
| C80 | C79 | C87 | C76 | 179.2° | 179.7° |
| C80 | C79 | C76 | N74 | 66.7° | 90.0° |
| C80 | C79 | C76 | H35 | 172.7° | 150.0° |
| C80 | C79 | C76 | H36 | 54.0° | 29.9° |
| C80 | C79 | C87 | H40 | 179.8° | 180.0° |
| C87 | C79 | C76 | N74 | 114.1° | 90.3° |
| C87 | C79 | C76 | H35 | 6.5° | 29.7° |
| C87 | C79 | C76 | H36 | 125.2° | 149.8° |
| C87 | C79 | C80 | H37 | 179.1° | 179.8° |
| C79 | C87 | C85 | H39 | 179.9° | 179.7° |
| C79 | C76 | N74 | H35 | 120.7° | 120.0° |
| C79 | C76 | N74 | H36 | 120.7° | 120.0° |
| C79 | C76 | N74 | C71 | 50.9° | 180.0° |
| C79 | C76 | H35 | H36 | 117.9° | 120.0° |
| C76 | C79 | C80 | H37 | 0.2° | 0.0° |
| C76 | C79 | C87 | H40 | 0.6° | 0.2° |
| C79 | C76 | N74 | H49 | 171.4° | 56.0° |
| C76 | N74 | C71 | H49 | 120.6° | 124.0° |
| C76 | N74 | C71 | C67 | 163.9° | 180.0° |
| C76 | N74 | C71 | H33 | 44.4° | 60.0° |
| C76 | N74 | C71 | H34 | 76.7° | 60.0° |
| N74 | C76 | H35 | H36 | 117.9° | 120.0° |
| N74 | C71 | C67 | H33 | 119.5° | 120.0° |
| N74 | C71 | C67 | H34 | 119.5° | 120.0° |
| N74 | C71 | C67 | O69 | 60.5° | 65.0° |
| N74 | C71 | C67 | C3 | 178.2° | 175.0° |
| N74 | C71 | C67 | H32 | 58.6° | 55.0° |
| N74 | C71 | H33 | H34 | 121.5° | 119.9° |
| C71 | N74 | C76 | H35 | 69.8° | 60.0° |
| C71 | N74 | C76 | H36 | 171.6° | 60.0° |
| C71 | C67 | O69 | C3 | 123.8° | 120.0° |
| C71 | C67 | O69 | H32 | 118.2° | 120.0° |
| C71 | C67 | C3 | H32 | 119.6° | 120.0° |
| C71 | C67 | C3 | C5 | 170.4° | 180.0° |
| C71 | C67 | C3 | N1 | 67.4° | 61.7° |
| C71 | C67 | C3 | H1 | 52.4° | 60.0° |
| C67 | C71 | H33 | H34 | 121.5° | 120.0° |
| C67 | C71 | N74 | H49 | 75.6° | 56.0° |
| C71 | C67 | O69 | H51 | 180.0° | 60.1° |
| O69 | C67 | C3 | H32 | 118.8° | 120.0° |
| O69 | C67 | C3 | C5 | 48.7° | 60.1° |
| O69 | C67 | C3 | N1 | 170.9° | 178.4° |
| O69 | C67 | C3 | H1 | 69.3° | 59.9° |
| O69 | C67 | C71 | H33 | 59.0° | 175.0° |
| O69 | C67 | C71 | H34 | 180.0° | 55.0° |
| O44 | C43 | N1 | C3 | 6.1° | 155.4° |
| O44 | C43 | N1 | C30 | 178.1° | 180.0° |
| O44 | C43 | C30 | C31 | 27.3° | 21.5° |
| O44 | C43 | C30 | C28 | 151.1° | 159.1° |
| O44 | C43 | N1 | H48 | 173.9° | 24.0° |
| C67 | C3 | C5 | N1 | 124.5° | 118.2° |
| C67 | C3 | C5 | H1 | 118.0° | 118.5° |
| C67 | C3 | N1 | H1 | 119.4° | 119.5° |
| C67 | C3 | N1 | C43 | 103.6° | 65.2° |
| C67 | C3 | C5 | C8 | 174.2° | 142.2° |
| C67 | C3 | C5 | H2 | 54.0° | 97.8° |
| C67 | C3 | C5 | H3 | 65.6° | 20.9° |
| C3 | C67 | C71 | H33 | 62.3° | 55.0° |
| C3 | C67 | C71 | H34 | 58.7° | 65.0° |
| C67 | C3 | N1 | H48 | 76.4° | 114.3° |
| C3 | C67 | O69 | H51 | 56.2° | 59.9° |
| C63 | C8 | C5 | C3 | 77.3° | 44.0° |
| C63 | C8 | C5 | C10 | 125.8° | 127.1° |
| C63 | C8 | C5 | H4 | 116.6° | 116.6° |
| C63 | C8 | C10 | H4 | 117.6° | 119.0° |
| C63 | C8 | C10 | C13 | 52.0° | 4.2° |
| C63 | C8 | C5 | H2 | 162.5° | 76.1° |
| C63 | C8 | C5 | H3 | 42.9° | 165.2° |
| C63 | C8 | C10 | H5 | 172.9° | 126.3° |
| C63 | C8 | C10 | H6 | 68.9° | 118.7° |
| C8 | C63 | H29 | H30 | 120.0° | 120.0° |
| C8 | C63 | H29 | H31 | 120.0° | 120.0° |
| C8 | C63 | H30 | H31 | 120.0° | 120.0° |
| C5 | C3 | N1 | H1 | 116.9° | 122.5° |
| C5 | C3 | N1 | C43 | 132.7° | 176.8° |
| C3 | C5 | C8 | H2 | 120.2° | 120.1° |
| C3 | C5 | C8 | H3 | 120.2° | 121.2° |
| C3 | C5 | C8 | C10 | 156.9° | 83.1° |
| C3 | C5 | H2 | H3 | 119.5° | 119.1° |
| C3 | C5 | C8 | H4 | 39.3° | 160.6° |
| C5 | C3 | C67 | H32 | 70.0° | 60.0° |
| C5 | C3 | N1 | H48 | 47.3° | 3.8° |
| C3 | N1 | C43 | H48 | 180.0° | 179.5° |
| C3 | N1 | C43 | C30 | 175.7° | 24.6° |
| N1 | C3 | C5 | C8 | 49.7° | 99.6° |
| N1 | C3 | C5 | H2 | 70.5° | 20.5° |
| N1 | C3 | C5 | H3 | 169.9° | 139.1° |
| N1 | C3 | C67 | H32 | 52.2° | 58.3° |
| N1 | C43 | C30 | C31 | 150.8° | 158.6° |
| N1 | C43 | C30 | C28 | 30.7° | 20.8° |
| C43 | N1 | C3 | H1 | 15.8° | 54.3° |
| C43 | C30 | C31 | C28 | 178.4° | 179.4° |
| C43 | C30 | C31 | C33 | 179.4° | 179.2° |
| C43 | C30 | C28 | C27 | 177.1° | 178.3° |
| C43 | C30 | C28 | H15 | 2.9° | 1.9° |
| C43 | C30 | C31 | H16 | 0.6° | 0.5° |
| C30 | C43 | N1 | H48 | 4.2° | 155.9° |
| O42 | C40 | C38 | H19 | 180.0° | 180.0° |
| C40 | O42 | C36 | C33 | 177.8° | 180.0° |
| C40 | O42 | C36 | N37 | 2.9° | 0.2° |
| O42 | C40 | C38 | N37 | 0.3° | 0.0° |
| O42 | C40 | C38 | H18 | 179.7° | 179.8° |
| C36 | O42 | C40 | C38 | 1.8° | 0.1° |
| O42 | C36 | C33 | C31 | 15.3° | 179.7° |
| O42 | C36 | C33 | N37 | 173.9° | 179.7° |
| O42 | C36 | N37 | C38 | 2.7° | 0.2° |
| O42 | C36 | C33 | C34 | 168.5° | 0.3° |
| C36 | O42 | C40 | H19 | 178.2° | 179.9° |
| C5 | C8 | C10 | H4 | 117.6° | 115.9° |
| C5 | C8 | C10 | C13 | 176.7° | 129.3° |
| C8 | C5 | C3 | H1 | 67.8° | 23.6° |
| C8 | C5 | H2 | H3 | 119.5° | 119.2° |
| C5 | C8 | C10 | H5 | 62.4° | 108.6° |
| C5 | C8 | C10 | H6 | 55.9° | 6.4° |
| C5 | C8 | C63 | H29 | 180.0° | 53.6° |
| C5 | C8 | C63 | H30 | 60.0° | 173.6° |
| C5 | C8 | C63 | H31 | 60.0° | 66.4° |
| C40 | C38 | N37 | C36 | 1.5° | 0.1° |
| C40 | C38 | N37 | H18 | 180.0° | 179.8° |
| C8 | C10 | C13 | H5 | 120.9° | 122.2° |
| C8 | C10 | C13 | H6 | 120.9° | 123.1° |
| C8 | C10 | C13 | C16 | 58.5° | 97.2° |
| C10 | C8 | C5 | H2 | 36.8° | 156.8° |
| C10 | C8 | C5 | H3 | 82.9° | 38.1° |
| C8 | C10 | H5 | H6 | 117.3° | 117.2° |
| C8 | C10 | C13 | H7 | 179.3° | 29.7° |
| C8 | C10 | C13 | H8 | 62.2° | 146.7° |
| C10 | C8 | C63 | H29 | 54.1° | 178.5° |
| C10 | C8 | C63 | H30 | 66.0° | 61.5° |
| C10 | C8 | C63 | H31 | 174.0° | 58.5° |
| C30 | C31 | C33 | H16 | 180.0° | 179.8° |
| C30 | C31 | C33 | C36 | 176.4° | 179.6° |
| C30 | C31 | C33 | C34 | 0.1° | 0.4° |
| C31 | C30 | C28 | C27 | 1.4° | 1.1° |
| C31 | C30 | C28 | H15 | 178.6° | 178.8° |
| C33 | C31 | C30 | C28 | 1.0° | 0.1° |
| C31 | C33 | C36 | C34 | 176.2° | 180.0° |
| C31 | C33 | C36 | N37 | 158.6° | 0.0° |
| C31 | C33 | C34 | C27 | 3.6° | 0.1° |
| C31 | C33 | C34 | H17 | 176.4° | 180.0° |
| C30 | C28 | C27 | H15 | 180.0° | 179.8° |
| C30 | C28 | C27 | C34 | 4.8° | 1.4° |
| C30 | C28 | C27 | C26 | 174.4° | 179.3° |
| C28 | C30 | C31 | H16 | 179.0° | 179.9° |
| C33 | C36 | N37 | C38 | 176.9° | 180.0° |
| C36 | C33 | C34 | C27 | 179.9° | 179.9° |
| C36 | C33 | C31 | H16 | 3.6° | 0.6° |
| C36 | C33 | C34 | H17 | 0.1° | 0.0° |
| N37 | C36 | C33 | C34 | 17.6° | 180.0° |
| C36 | N37 | C38 | H18 | 178.6° | 180.0° |
| N37 | C38 | C40 | H19 | 179.7° | 180.0° |
| C33 | C34 | C27 | C28 | 5.9° | 0.8° |
| C33 | C34 | C27 | H17 | 180.0° | 179.9° |
| C33 | C34 | C27 | C26 | 176.4° | 179.8° |
| C34 | C33 | C31 | H16 | 179.9° | 179.3° |
| C10 | C13 | C16 | H7 | 120.7° | 128.8° |
| C10 | C13 | C16 | H8 | 120.8° | 116.7° |
| C10 | C13 | C16 | C19 | 48.2° | 174.6° |
| C13 | C10 | C8 | H4 | 65.6° | 114.8° |
| C13 | C10 | H5 | H6 | 117.2° | 116.7° |
| C10 | C13 | H7 | H8 | 117.7° | 118.2° |
| C10 | C13 | C16 | H9 | 169.1° | 54.5° |
| C10 | C13 | C16 | H10 | 72.7° | 64.7° |
| C13 | C16 | C19 | H9 | 120.9° | 119.8° |
| C13 | C16 | C19 | H10 | 120.9° | 120.4° |
| C13 | C16 | C19 | C22 | 169.7° | 161.2° |
| C16 | C13 | C10 | H5 | 62.4° | 140.6° |
| C16 | C13 | C10 | H6 | 179.4° | 26.0° |
| C16 | C13 | H7 | H8 | 117.6° | 115.3° |
| C13 | C16 | H9 | H10 | 117.1° | 119.5° |
| C13 | C16 | C19 | H11 | 49.6° | 38.9° |
| C13 | C16 | C19 | H12 | 70.1° | 79.9° |
| C28 | C27 | C34 | C26 | 170.4° | 179.3° |
| C28 | C27 | C26 | N25 | 49.1° | 27.9° |
| C28 | C27 | C26 | O45 | 126.2° | 148.2° |
| C28 | C27 | C34 | H17 | 174.1° | 179.1° |
| C16 | C19 | C22 | H11 | 120.2° | 122.2° |
| C16 | C19 | C22 | H12 | 120.2° | 118.8° |
| C16 | C19 | C22 | N25 | 175.9° | 60.9° |
| C19 | C16 | C13 | H7 | 72.5° | 56.5° |
| C19 | C16 | C13 | H8 | 169.0° | 58.0° |
| C19 | C16 | H9 | H10 | 117.1° | 120.5° |
| C16 | C19 | H11 | H12 | 119.5° | 118.8° |
| C16 | C19 | C22 | H13 | 55.1° | 178.6° |
| C16 | C19 | C22 | H14 | 63.3° | 59.0° |
| C34 | C27 | C26 | N25 | 141.0° | 151.4° |
| C34 | C27 | C26 | O45 | 43.7° | 32.5° |
| C34 | C27 | C28 | H15 | 175.2° | 178.4° |
| C27 | C26 | N25 | C22 | 6.2° | 142.7° |
| C27 | C26 | N25 | O45 | 175.2° | 176.1° |
| C27 | C26 | N25 | C46 | 178.7° | 40.2° |
| C26 | C27 | C28 | H15 | 5.6° | 0.9° |
| C26 | C27 | C34 | H17 | 3.6° | 0.2° |
| C19 | C22 | N25 | H13 | 120.8° | 120.7° |
| C19 | C22 | N25 | H14 | 120.8° | 120.1° |
| C19 | C22 | N25 | C26 | 113.1° | 141.2° |
| C19 | C22 | N25 | C46 | 71.8° | 41.7° |
| C22 | C19 | C16 | H9 | 69.4° | 79.0° |
| C22 | C19 | C16 | H10 | 48.8° | 40.8° |
| C22 | C19 | H11 | H12 | 119.5° | 119.1° |
| C19 | C22 | H13 | H14 | 117.5° | 120.1° |
| C22 | N25 | C26 | C46 | 175.1° | 177.1° |
| C22 | N25 | C26 | O45 | 178.6° | 33.4° |
| C22 | N25 | C46 | C48 | 15.4° | 151.9° |
| C22 | N25 | C46 | C52 | 112.6° | 31.8° |
| N25 | C22 | C19 | H11 | 63.9° | 61.3° |
| N25 | C22 | C19 | H12 | 55.7° | 179.7° |
| N25 | C22 | H13 | H14 | 117.5° | 119.5° |
| C22 | N25 | C46 | H20 | 131.8° | 88.1° |
| C26 | N25 | C46 | C48 | 159.8° | 24.9° |
| C26 | N25 | C46 | C52 | 72.3° | 145.0° |
| C26 | N25 | C22 | H13 | 126.2° | 98.1° |
| C26 | N25 | C22 | H14 | 7.7° | 21.1° |
| C26 | N25 | C46 | H20 | 43.3° | 95.1° |
| O45 | C26 | N25 | C46 | 3.5° | 143.7° |
| N25 | C46 | C52 | C61 | 15.0° | 46.3° |
| N25 | C46 | C48 | C52 | 126.4° | 120.0° |
| N25 | C46 | C48 | H20 | 116.7° | 120.0° |
| N25 | C46 | C52 | H20 | 115.8° | 120.0° |
| N25 | C46 | C52 | C53 | 165.5° | 133.5° |
| C46 | N25 | C22 | H13 | 49.0° | 79.0° |
| C46 | N25 | C22 | H14 | 167.4° | 161.8° |
| N25 | C46 | C48 | H21 | 180.0° | 51.6° |
| N25 | C46 | C48 | H22 | 60.0° | 68.4° |
| N25 | C46 | C48 | H23 | 60.0° | 171.5° |
| C59 | C61 | C52 | H28 | 180.0° | 179.4° |
| C59 | C61 | C52 | C46 | 179.0° | 179.7° |
| C61 | C59 | C57 | H27 | 180.0° | 179.7° |
| C59 | C61 | C52 | C53 | 1.5° | 0.6° |
| C61 | C59 | C57 | C55 | 0.5° | 0.4° |
| C61 | C59 | C57 | H26 | 179.5° | 179.8° |
| C61 | C52 | C46 | C48 | 112.1° | 73.7° |
| C61 | C52 | C46 | C53 | 179.5° | 179.8° |
| C52 | C61 | C59 | C57 | 1.3° | 0.6° |
| C61 | C52 | C53 | C55 | 1.0° | 0.3° |
| C61 | C52 | C46 | H20 | 130.9° | 166.3° |
| C61 | C52 | C53 | H24 | 179.0° | 179.7° |
| C52 | C61 | C59 | H27 | 178.7° | 179.7° |
| C48 | C46 | C52 | H20 | 117.0° | 120.0° |
| C48 | C46 | C52 | C53 | 67.3° | 106.5° |
| C46 | C48 | H21 | H22 | 120.0° | 120.0° |
| C46 | C48 | H21 | H23 | 120.0° | 119.9° |
| C46 | C48 | H22 | H23 | 120.0° | 120.0° |
| C46 | C52 | C53 | C55 | 179.6° | 180.0° |
| C52 | C46 | C48 | H21 | 53.6° | 68.4° |
| C52 | C46 | C48 | H22 | 66.4° | 171.6° |
| C52 | C46 | C48 | H23 | 173.6° | 51.6° |
| C46 | C52 | C53 | H24 | 0.4° | 0.0° |
| C46 | C52 | C61 | H28 | 0.9° | 0.3° |
| C59 | C57 | C55 | H26 | 180.0° | 179.9° |
| C59 | C57 | C55 | C53 | 0.0° | 0.1° |
| C59 | C57 | C55 | H25 | 180.0° | 180.0° |
| C57 | C59 | C61 | H28 | 178.8° | 180.0° |
| C52 | C53 | C55 | C57 | 0.2° | 0.0° |
| C52 | C53 | C55 | H24 | 180.0° | 180.0° |
| C53 | C52 | C46 | H20 | 49.7° | 13.5° |
| C52 | C53 | C55 | H25 | 179.8° | 180.0° |
| C53 | C52 | C61 | H28 | 178.6° | 180.0° |
| C57 | C55 | C53 | H25 | 180.0° | 179.9° |
| C57 | C55 | C53 | H24 | 179.8° | 180.0° |
| C55 | C57 | C59 | H27 | 179.5° | 180.0° |
| C53 | C55 | C57 | H26 | 180.0° | 179.9° |
| H1 | C3 | C5 | H2 | 172.1° | 143.7° |
| H1 | C3 | C5 | H3 | 52.4° | 97.6° |
| H1 | C3 | C67 | H32 | 172.0° | 180.0° |
| H1 | C3 | N1 | H48 | 164.2° | 126.2° |
| H2 | C5 | C8 | H4 | 80.8° | 40.5° |
| H3 | C5 | C8 | H4 | 159.5° | 78.2° |
| H4 | C8 | C10 | H5 | 55.3° | 7.3° |
| H4 | C8 | C10 | H6 | 173.5° | 122.3° |
| H4 | C8 | C63 | H29 | 63.4° | 62.6° |
| H4 | C8 | C63 | H30 | 176.6° | 57.4° |
| H4 | C8 | C63 | H31 | 56.6° | 177.4° |
| H5 | C10 | C13 | H7 | 58.4° | 92.5° |
| H5 | C10 | C13 | H8 | 176.9° | 24.5° |
| H6 | C10 | C13 | H7 | 59.8° | 152.8° |
| H6 | C10 | C13 | H8 | 58.7° | 90.2° |
| H7 | C13 | C16 | H9 | 48.4° | 176.6° |
| H7 | C13 | C16 | H10 | 166.5° | 64.2° |
| H8 | C13 | C16 | H9 | 70.1° | 62.2° |
| H8 | C13 | C16 | H10 | 48.1° | 178.7° |
| H9 | C16 | C19 | H11 | 170.5° | 158.6° |
| H9 | C16 | C19 | H12 | 50.8° | 39.9° |
| H10 | C16 | C19 | H11 | 71.4° | 81.5° |
| H10 | C16 | C19 | H12 | 168.9° | 159.8° |
| H11 | C19 | C22 | H13 | 175.3° | 59.2° |
| H11 | C19 | C22 | H14 | 56.9° | 178.8° |
| H12 | C19 | C22 | H13 | 65.1° | 59.7° |
| H12 | C19 | C22 | H14 | 176.5° | 59.9° |
| H18 | C38 | C40 | H19 | 0.3° | 0.2° |
| H20 | C46 | C48 | H21 | 63.3° | 171.6° |
| H20 | C46 | C48 | H22 | 176.7° | 51.5° |
| H20 | C46 | C48 | H23 | 56.6° | 68.5° |
| H21 | C48 | H22 | H23 | 120.0° | 120.1° |
| H24 | C53 | C55 | H25 | 0.2° | 0.0° |
| H25 | C55 | C57 | H26 | 0.0° | 0.1° |
| H26 | C57 | C59 | H27 | 0.5° | 0.1° |
| H27 | C59 | C61 | H28 | 1.2° | 0.3° |
| H29 | C63 | H30 | H31 | 120.0° | 120.0° |
| H32 | C67 | C71 | H33 | 178.1° | 65.0° |
| H32 | C67 | C71 | H34 | 60.9° | 175.0° |
| H32 | C67 | O69 | H51 | 61.8° | 180.0° |
| H33 | C71 | N74 | H49 | 164.9° | 64.0° |
| H34 | C71 | N74 | H49 | 43.9° | 176.1° |
| H35 | C76 | N74 | H49 | 50.7° | 176.0° |
| H36 | C76 | N74 | H49 | 67.9° | 63.9° |
| H38 | C83 | C85 | H39 | 0.3° | 0.0° |
| H39 | C85 | C87 | H40 | 0.1° | 0.2° |
| H41 | C89 | C91 | H42 | 63.9° | 60.0° |
| H41 | C89 | C91 | H43 | 176.1° | 60.1° |
| H41 | C89 | C91 | H44 | 56.1° | 180.0° |
| H41 | C89 | C95 | H45 | 63.7° | 60.0° |
| H41 | C89 | C95 | H46 | 56.3° | 60.0° |
| H41 | C89 | C95 | H47 | 176.3° | NaN° |
| H42 | C91 | H43 | H44 | 120.0° | 120.0° |
| H45 | C95 | H46 | H47 | 120.0° | 120.0° |
