E6J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C73 | C79 | sing | 1.53Å | 1.51Å | |
| C73 | C75 | sing | 1.53Å | 1.52Å | |
| C73 | C66 | sing | 1.51Å | 1.53Å | |
| C67 | C66 | doub | 1.38Å | 1.39Å | Aromatic |
| C67 | C69 | sing | 1.38Å | 1.39Å | Aromatic |
| C66 | C64 | sing | 1.38Å | 1.39Å | Aromatic |
| C69 | C71 | doub | 1.38Å | 1.38Å | Aromatic |
| C64 | C63 | doub | 1.38Å | 1.40Å | Aromatic |
| C71 | C63 | sing | 1.38Å | 1.39Å | Aromatic |
| C63 | C60 | sing | 1.51Å | 1.53Å | |
| C60 | N58 | sing | 1.47Å | 1.47Å | |
| N58 | C55 | sing | 1.47Å | 1.48Å | |
| C55 | C51 | sing | 1.53Å | 1.54Å | |
| O53 | C51 | sing | 1.43Å | 1.43Å | |
| O50 | C49 | doub | 1.21Å | 1.22Å | |
| C51 | C3 | sing | 1.53Å | 1.53Å | |
| C3 | C5 | sing | 1.53Å | 1.54Å | |
| C3 | N1 | sing | 1.48Å | 1.45Å | |
| C16 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C49 | N1 | sing | 1.37Å | 1.33Å | |
| C49 | C35 | sing | 1.48Å | 1.50Å | |
| C5 | C8 | sing | 1.51Å | 1.51Å | |
| C14 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C36 | C35 | doub | 1.40Å | 1.39Å | Aromatic |
| C36 | C38 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C35 | C33 | sing | 1.40Å | 1.40Å | Aromatic |
| C41 | C38 | sing | 1.51Å | 1.51Å | |
| C41 | O44 | sing | 1.43Å | 1.43Å | |
| C38 | C39 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C45 | O44 | sing | 1.43Å | 1.41Å | |
| C11 | O18 | sing | 1.36Å | 1.37Å | |
| C39 | C32 | sing | 1.39Å | 1.39Å | Aromatic |
| C32 | O31 | sing | 1.36Å | 1.37Å | |
| O18 | C19 | sing | 1.43Å | 1.44Å | |
| O31 | C28 | sing | 1.43Å | 1.43Å | |
| C28 | C25 | sing | 1.53Å | 1.50Å | |
| C19 | C22 | sing | 1.53Å | 1.51Å | |
| C25 | C22 | sing | 1.53Å | 1.53Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.08Å | 1.08Å | |
| C14 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C25 | H11 | sing | 1.09Å | 1.10Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C33 | H15 | sing | 1.08Å | 1.08Å | |
| C36 | H16 | sing | 1.08Å | 1.08Å | |
| C39 | H17 | sing | 1.08Å | 1.08Å | |
| C41 | H18 | sing | 1.09Å | 1.10Å | |
| C41 | 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 | |
| C51 | H23 | sing | 1.09Å | 1.10Å | |
| C55 | H24 | sing | 1.09Å | 1.10Å | |
| C55 | H25 | sing | 1.09Å | 1.10Å | |
| C60 | H26 | sing | 1.09Å | 1.10Å | |
| C60 | H27 | sing | 1.09Å | 1.10Å | |
| C64 | H28 | sing | 1.08Å | 1.08Å | |
| C67 | H29 | sing | 1.08Å | 1.08Å | |
| C69 | H30 | sing | 1.08Å | 1.08Å | |
| C71 | H31 | sing | 1.08Å | 1.08Å | |
| C73 | H32 | sing | 1.09Å | 1.10Å | |
| C75 | H33 | sing | 1.09Å | 1.10Å | |
| C75 | H34 | sing | 1.09Å | 1.10Å | |
| C75 | H35 | sing | 1.09Å | 1.10Å | |
| C79 | H36 | sing | 1.09Å | 1.10Å | |
| C79 | H37 | sing | 1.09Å | 1.10Å | |
| C79 | H38 | sing | 1.09Å | 1.10Å | |
| C9 | H39 | sing | 1.08Å | 1.08Å | |
| N1 | H40 | sing | 0.97Å | 1.00Å | |
| N58 | H41 | sing | 1.01Å | 1.00Å | |
| O53 | H43 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C79 | C73 | C75 | 110.3° | 109.4° |
| C79 | C73 | C66 | 112.8° | 109.5° |
| C79 | C73 | H32 | 107.1° | 109.5° |
| C73 | C79 | H36 | 109.5° | 109.5° |
| C73 | C79 | H37 | 109.5° | 109.5° |
| C73 | C79 | H38 | 109.4° | 109.5° |
| C75 | C73 | C66 | 112.6° | 109.5° |
| C75 | C73 | H32 | 106.9° | 109.5° |
| C73 | C75 | H33 | 109.5° | 109.5° |
| C73 | C75 | H34 | 109.5° | 109.5° |
| C73 | C75 | H35 | 109.5° | 109.5° |
| C73 | C66 | C67 | 119.7° | 120.0° |
| C73 | C66 | C64 | 121.6° | 120.0° |
| C66 | C73 | H32 | 106.8° | 109.5° |
| C66 | C67 | C69 | 120.6° | 120.0° |
| C67 | C66 | C64 | 118.6° | 120.0° |
| C66 | C67 | H29 | 119.7° | 120.0° |
| C67 | C69 | C71 | 120.2° | 120.0° |
| C69 | C67 | H29 | 119.7° | 120.0° |
| C67 | C69 | H30 | 119.9° | 120.0° |
| C66 | C64 | C63 | 121.5° | 120.0° |
| C66 | C64 | H28 | 119.2° | 120.0° |
| C69 | C71 | C63 | 120.7° | 120.0° |
| C71 | C69 | H30 | 119.9° | 120.0° |
| C69 | C71 | H31 | 119.7° | 120.0° |
| C64 | C63 | C71 | 118.4° | 120.0° |
| C64 | C63 | C60 | 121.2° | 120.0° |
| C63 | C64 | H28 | 119.2° | 120.0° |
| C71 | C63 | C60 | 120.4° | 120.0° |
| C63 | C71 | H31 | 119.7° | 120.0° |
| C63 | C60 | N58 | 113.5° | 109.5° |
| C63 | C60 | H26 | 108.4° | 109.4° |
| C63 | C60 | H27 | 108.4° | 109.5° |
| C60 | N58 | C55 | 113.3° | 111.0° |
| N58 | C60 | H26 | 108.5° | 109.5° |
| N58 | C60 | H27 | 108.5° | 109.5° |
| C60 | N58 | H41 | 108.5° | 111.0° |
| N58 | C55 | C51 | 107.2° | 109.5° |
| N58 | C55 | H24 | 110.0° | 109.5° |
| N58 | C55 | H25 | 110.0° | 109.5° |
| C55 | N58 | H41 | 108.5° | 111.0° |
| C55 | C51 | O53 | 108.5° | 109.5° |
| C55 | C51 | C3 | 111.2° | 109.5° |
| C55 | C51 | H23 | 109.2° | 109.4° |
| C51 | C55 | H24 | 110.0° | 109.5° |
| C51 | C55 | H25 | 110.0° | 109.4° |
| O53 | C51 | C3 | 107.9° | 109.5° |
| O53 | C51 | H23 | 110.7° | 109.5° |
| C51 | O53 | H43 | 109.5° | 113.9° |
| O50 | C49 | N1 | 121.7° | 120.8° |
| O50 | C49 | C35 | 121.1° | 120.8° |
| C51 | C3 | C5 | 110.9° | 109.4° |
| C51 | C3 | N1 | 112.1° | 109.4° |
| C51 | C3 | H1 | 108.0° | 109.4° |
| C3 | C51 | H23 | 109.3° | 109.5° |
| C5 | C3 | N1 | 109.0° | 109.8° |
| C3 | C5 | C8 | 111.8° | 109.7° |
| C5 | C3 | H1 | 107.8° | 109.4° |
| C3 | C5 | H2 | 108.9° | 109.5° |
| C3 | C5 | H3 | 108.9° | 109.5° |
| C3 | N1 | C49 | 122.9° | 115.1° |
| N1 | C3 | H1 | 108.9° | 109.4° |
| C3 | N1 | H40 | 118.6° | 122.5° |
| C14 | C16 | C8 | 121.0° | 119.8° |
| C16 | C14 | C12 | 120.5° | 120.5° |
| C16 | C14 | H5 | 119.8° | 119.8° |
| C14 | C16 | H6 | 119.5° | 120.1° |
| C16 | C8 | C5 | 120.8° | 120.3° |
| C16 | C8 | C9 | 118.6° | 120.1° |
| C8 | C16 | H6 | 119.5° | 120.1° |
| N1 | C49 | C35 | 117.2° | 118.4° |
| C49 | N1 | H40 | 118.5° | 122.4° |
| C49 | C35 | C36 | 120.3° | 120.5° |
| C49 | C35 | C33 | 120.0° | 119.7° |
| C5 | C8 | C9 | 120.5° | 119.6° |
| C8 | C5 | H2 | 108.9° | 109.5° |
| C8 | C5 | H3 | 108.9° | 109.4° |
| C14 | C12 | C11 | 119.0° | 119.6° |
| C14 | C12 | H4 | 120.5° | 120.2° |
| C12 | C14 | H5 | 119.8° | 119.7° |
| C35 | C36 | C38 | 120.9° | 119.8° |
| C36 | C35 | C33 | 119.6° | 119.8° |
| C35 | C36 | H16 | 119.6° | 120.1° |
| C36 | C38 | C41 | 120.4° | 119.8° |
| C36 | C38 | C39 | 119.2° | 120.4° |
| C38 | C36 | H16 | 119.6° | 120.1° |
| C8 | C9 | C11 | 120.1° | 120.1° |
| C8 | C9 | H39 | 120.0° | 119.9° |
| C35 | C33 | C32 | 119.3° | 119.8° |
| C35 | C33 | H15 | 120.4° | 120.1° |
| C38 | C41 | O44 | 111.0° | 109.5° |
| C41 | C38 | C39 | 120.4° | 119.8° |
| C38 | C41 | H18 | 109.1° | 109.5° |
| C38 | C41 | H19 | 109.1° | 109.5° |
| C41 | O44 | C45 | 112.9° | 114.0° |
| O44 | C41 | H18 | 109.1° | 109.5° |
| O44 | C41 | H19 | 109.1° | 109.5° |
| C38 | C39 | C32 | 119.8° | 120.1° |
| C38 | C39 | H17 | 120.1° | 120.0° |
| C12 | C11 | C9 | 120.9° | 119.9° |
| C12 | C11 | O18 | 116.3° | 119.6° |
| C11 | C12 | H4 | 120.5° | 120.2° |
| C9 | C11 | O18 | 122.8° | 120.5° |
| C11 | C9 | H39 | 120.0° | 120.0° |
| C33 | C32 | C39 | 121.3° | 120.1° |
| C33 | C32 | O31 | 125.1° | 119.8° |
| C32 | C33 | H15 | 120.3° | 120.1° |
| O44 | C45 | H20 | 109.5° | 109.5° |
| O44 | C45 | H21 | 109.4° | 109.5° |
| O44 | C45 | H22 | 109.5° | 109.5° |
| C11 | O18 | C19 | 118.3° | 117.7° |
| C39 | C32 | O31 | 113.7° | 120.1° |
| C32 | C39 | H17 | 120.1° | 119.9° |
| C32 | O31 | C28 | 118.6° | 116.7° |
| O18 | C19 | C22 | 107.4° | 109.6° |
| O18 | C19 | H7 | 110.0° | 109.5° |
| O18 | C19 | H8 | 110.0° | 109.5° |
| O31 | C28 | C25 | 107.6° | 109.9° |
| O31 | C28 | H13 | 109.9° | 109.4° |
| O31 | C28 | H14 | 110.0° | 109.3° |
| C28 | C25 | C22 | 112.3° | 109.6° |
| C28 | C25 | H11 | 108.8° | 109.5° |
| C28 | C25 | H12 | 108.8° | 109.4° |
| C25 | C28 | H13 | 110.0° | 109.4° |
| C25 | C28 | H14 | 109.9° | 109.4° |
| C19 | C22 | C25 | 113.5° | 109.8° |
| C22 | C19 | H7 | 110.0° | 109.4° |
| C22 | C19 | H8 | 110.0° | 109.4° |
| C19 | C22 | H9 | 108.4° | 109.4° |
| C19 | C22 | H10 | 108.5° | 109.5° |
| C25 | C22 | H9 | 108.4° | 109.4° |
| C25 | C22 | H10 | 108.4° | 109.4° |
| C22 | C25 | H11 | 108.8° | 109.5° |
| C22 | C25 | H12 | 108.7° | 109.4° |
| H2 | C5 | H3 | 109.5° | 109.3° |
| H7 | C19 | H8 | 109.4° | 109.5° |
| H9 | C22 | H10 | 109.5° | 109.4° |
| H11 | C25 | H12 | 109.4° | 109.4° |
| H13 | C28 | H14 | 109.5° | 109.4° |
| H18 | C41 | H19 | 109.5° | 109.5° |
| H20 | C45 | H21 | 109.5° | 109.5° |
| H20 | C45 | H22 | 109.4° | 109.4° |
| H21 | C45 | H22 | 109.5° | 109.5° |
| H24 | C55 | H25 | 109.5° | 109.4° |
| H26 | C60 | H27 | 109.5° | 109.4° |
| H33 | C75 | H34 | 109.5° | 109.4° |
| H33 | C75 | H35 | 109.5° | 109.5° |
| H34 | C75 | H35 | 109.4° | 109.4° |
| H36 | C79 | H37 | 109.5° | 109.5° |
| H36 | C79 | H38 | 109.5° | 109.5° |
| H37 | C79 | H38 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C79 | C73 | C75 | C66 | 126.9° | 120.0° |
| C79 | C73 | C75 | H32 | 116.1° | 120.0° |
| C79 | C73 | C66 | H32 | 117.4° | 120.0° |
| C79 | C73 | C66 | C67 | 145.2° | 60.0° |
| C79 | C73 | C66 | C64 | 33.4° | 120.0° |
| C79 | C73 | C75 | H33 | 180.0° | 60.0° |
| C79 | C73 | C75 | H34 | 60.0° | 180.0° |
| C79 | C73 | C75 | H35 | 60.0° | 60.1° |
| C73 | C79 | H36 | H37 | 120.0° | 120.0° |
| C73 | C79 | H36 | H38 | 120.0° | 120.0° |
| C73 | C79 | H37 | H38 | 120.0° | 120.0° |
| C75 | C73 | C66 | H32 | 117.1° | 120.0° |
| C75 | C73 | C66 | C67 | 89.3° | 60.0° |
| C75 | C73 | C66 | C64 | 92.1° | 120.0° |
| C73 | C75 | H33 | H34 | 120.0° | 120.0° |
| C73 | C75 | H33 | H35 | 120.0° | 120.1° |
| C73 | C75 | H34 | H35 | 120.0° | 120.0° |
| C75 | C73 | C79 | H36 | 180.0° | 60.0° |
| C75 | C73 | C79 | H37 | 60.0° | 180.0° |
| C75 | C73 | C79 | H38 | 60.0° | 60.0° |
| C73 | C66 | C67 | C64 | 178.7° | 180.0° |
| C73 | C66 | C67 | C69 | 179.3° | 180.0° |
| C73 | C66 | C64 | C63 | 179.3° | 180.0° |
| C73 | C66 | C64 | H28 | 0.7° | 0.1° |
| C73 | C66 | C67 | H29 | 0.7° | 0.0° |
| C66 | C73 | C75 | H33 | 53.1° | 180.0° |
| C66 | C73 | C75 | H34 | 66.9° | 60.0° |
| C66 | C73 | C75 | H35 | 173.1° | 60.0° |
| C66 | C73 | C79 | H36 | 53.2° | 60.0° |
| C66 | C73 | C79 | H37 | 173.2° | 60.0° |
| C66 | C73 | C79 | H38 | 66.8° | 180.0° |
| C66 | C67 | C69 | H29 | 180.0° | 180.0° |
| C66 | C67 | C69 | C71 | 0.4° | 0.2° |
| C67 | C66 | C64 | C63 | 0.6° | 0.0° |
| C67 | C66 | C64 | H28 | 179.4° | 180.0° |
| C66 | C67 | C69 | H30 | 179.6° | 180.0° |
| C67 | C66 | C73 | H32 | 27.8° | 180.0° |
| C69 | C67 | C66 | C64 | 0.6° | 0.0° |
| C67 | C69 | C71 | H30 | 180.0° | 179.8° |
| C67 | C69 | C71 | C63 | 0.1° | 0.5° |
| C67 | C69 | C71 | H31 | 179.9° | 180.0° |
| C66 | C64 | C63 | H28 | 180.0° | 180.0° |
| C66 | C64 | C63 | C71 | 0.4° | 0.2° |
| C66 | C64 | C63 | C60 | 179.2° | 180.0° |
| C64 | C66 | C67 | H29 | 179.4° | 180.0° |
| C64 | C66 | C73 | H32 | 150.8° | 0.0° |
| C69 | C71 | C63 | C64 | 0.1° | 0.5° |
| C69 | C71 | C63 | H31 | 180.0° | 179.5° |
| C69 | C71 | C63 | C60 | 179.5° | 179.7° |
| C71 | C69 | C67 | H29 | 179.6° | 179.8° |
| C64 | C63 | C71 | C60 | 179.6° | 179.8° |
| C64 | C63 | C60 | N58 | 61.0° | 89.9° |
| C64 | C63 | C60 | H26 | 178.4° | 150.0° |
| C64 | C63 | C60 | H27 | 59.6° | 30.1° |
| C64 | C63 | C71 | H31 | 179.9° | 180.0° |
| C71 | C63 | C60 | N58 | 118.6° | 90.3° |
| C71 | C63 | C60 | H26 | 2.0° | 29.8° |
| C71 | C63 | C60 | H27 | 120.8° | 149.8° |
| C71 | C63 | C64 | H28 | 179.6° | 179.7° |
| C63 | C71 | C69 | H30 | 179.9° | 179.7° |
| C63 | C60 | N58 | H26 | 120.6° | 120.0° |
| C63 | C60 | N58 | H27 | 120.6° | 120.0° |
| C63 | C60 | N58 | C55 | 67.1° | 180.0° |
| C63 | C60 | H26 | H27 | 118.1° | 120.0° |
| C60 | C63 | C64 | H28 | 0.8° | 0.1° |
| C60 | C63 | C71 | H31 | 0.5° | 0.2° |
| C63 | C60 | N58 | H41 | 172.4° | 56.1° |
| C60 | N58 | C55 | H41 | 120.6° | 123.9° |
| C60 | N58 | C55 | C51 | 166.7° | 180.0° |
| C60 | N58 | C55 | H24 | 47.0° | 60.0° |
| C60 | N58 | C55 | H25 | 73.7° | 60.0° |
| N58 | C60 | H26 | H27 | 118.2° | 120.0° |
| N58 | C55 | C51 | H24 | 119.6° | 120.1° |
| N58 | C55 | C51 | H25 | 119.6° | 120.0° |
| N58 | C55 | C51 | O53 | 51.8° | 64.9° |
| N58 | C55 | C51 | C3 | 170.3° | 175.0° |
| N58 | C55 | C51 | H23 | 68.9° | 55.0° |
| N58 | C55 | H24 | H25 | 121.1° | 120.0° |
| C55 | N58 | C60 | H26 | 53.5° | 60.0° |
| C55 | N58 | C60 | H27 | 172.3° | 60.0° |
| C55 | C51 | O53 | C3 | 120.5° | 120.1° |
| C55 | C51 | O53 | H23 | 119.8° | 120.0° |
| C55 | C51 | C3 | H23 | 120.7° | 120.0° |
| C55 | C51 | C3 | C5 | 172.1° | 180.0° |
| C55 | C51 | C3 | N1 | 65.7° | 59.6° |
| C55 | C51 | C3 | H1 | 54.2° | 60.2° |
| C51 | C55 | H24 | H25 | 121.1° | 119.9° |
| C51 | C55 | N58 | H41 | 72.8° | 56.1° |
| C55 | C51 | O53 | H43 | 180.0° | 60.0° |
| O53 | C51 | C3 | H23 | 120.5° | 120.0° |
| O53 | C51 | C3 | C5 | 53.3° | 60.0° |
| O53 | C51 | C3 | N1 | 175.5° | 179.7° |
| O53 | C51 | C3 | H1 | 64.6° | 59.8° |
| O53 | C51 | C55 | H24 | 67.8° | 175.0° |
| O53 | C51 | C55 | H25 | 171.5° | 55.1° |
| O50 | C49 | N1 | C3 | 2.3° | 12.5° |
| O50 | C49 | N1 | C35 | 179.0° | 180.0° |
| O50 | C49 | C35 | C36 | 36.2° | 12.9° |
| O50 | C49 | C35 | C33 | 140.3° | 166.7° |
| O50 | C49 | N1 | H40 | 177.7° | 167.6° |
| C51 | C3 | C5 | N1 | 123.9° | 120.1° |
| C51 | C3 | C5 | H1 | 118.0° | 119.8° |
| C51 | C3 | N1 | H1 | 119.4° | 119.8° |
| C51 | C3 | N1 | C49 | 102.2° | 82.7° |
| C51 | C3 | C5 | C8 | 164.7° | 37.4° |
| C51 | C3 | C5 | H2 | 44.4° | 82.7° |
| C51 | C3 | C5 | H3 | 74.9° | 157.5° |
| C3 | C51 | C55 | H24 | 50.7° | 55.0° |
| C3 | C51 | C55 | H25 | 70.0° | 65.0° |
| C51 | C3 | N1 | H40 | 77.8° | 97.2° |
| C3 | C51 | O53 | H43 | 59.5° | 60.0° |
| C5 | C3 | N1 | H1 | 117.4° | 120.1° |
| C3 | C5 | C8 | C16 | 73.4° | 114.9° |
| C5 | C3 | N1 | C49 | 134.6° | 157.2° |
| C3 | C5 | C8 | H2 | 120.3° | 120.1° |
| C3 | C5 | C8 | H3 | 120.4° | 120.1° |
| C3 | C5 | C8 | C9 | 104.2° | 65.2° |
| C3 | C5 | H2 | H3 | 119.0° | 119.9° |
| C5 | C3 | C51 | H23 | 67.2° | 60.0° |
| C5 | C3 | N1 | H40 | 45.4° | 22.9° |
| C3 | N1 | C49 | H40 | 180.0° | 179.9° |
| C3 | N1 | C49 | C35 | 176.7° | 167.6° |
| N1 | C3 | C5 | C8 | 40.8° | 82.7° |
| N1 | C3 | C5 | H2 | 79.5° | 157.2° |
| N1 | C3 | C5 | H3 | 161.2° | 37.3° |
| N1 | C3 | C51 | H23 | 54.9° | 60.4° |
| C14 | C16 | C8 | H6 | 180.0° | 180.0° |
| C14 | C16 | C8 | C5 | 178.2° | 179.2° |
| C16 | C14 | C12 | H5 | 180.0° | 180.0° |
| C14 | C16 | C8 | C9 | 0.7° | 0.8° |
| C16 | C14 | C12 | C11 | 0.4° | 0.9° |
| C16 | C14 | C12 | H4 | 179.6° | 179.1° |
| C16 | C8 | C5 | C9 | 177.5° | 180.0° |
| C8 | C16 | C14 | C12 | 0.1° | 0.3° |
| C16 | C8 | C9 | C11 | 1.1° | 0.1° |
| C16 | C8 | C5 | H2 | 166.3° | 5.2° |
| C16 | C8 | C5 | H3 | 47.0° | 125.0° |
| C8 | C16 | C14 | H5 | 179.9° | 179.7° |
| C16 | C8 | C9 | H39 | 178.9° | 180.0° |
| N1 | C49 | C35 | C36 | 144.8° | 167.1° |
| N1 | C49 | C35 | C33 | 38.8° | 13.3° |
| C49 | N1 | C3 | H1 | 17.2° | 37.1° |
| C49 | C35 | C36 | C33 | 176.5° | 179.6° |
| C49 | C35 | C36 | C38 | 178.2° | 178.6° |
| C49 | C35 | C33 | C32 | 177.8° | 178.0° |
| C49 | C35 | C33 | H15 | 2.2° | 1.9° |
| C49 | C35 | C36 | H16 | 1.8° | 1.5° |
| C35 | C49 | N1 | H40 | 3.3° | 12.3° |
| C5 | C8 | C9 | C11 | 178.7° | 179.8° |
| C8 | C5 | C3 | H1 | 77.3° | 157.2° |
| C8 | C5 | H2 | H3 | 118.9° | 119.9° |
| C5 | C8 | C16 | H6 | 1.8° | 0.9° |
| C5 | C8 | C9 | H39 | 1.3° | 0.1° |
| C14 | C12 | C11 | H4 | 180.0° | 179.9° |
| C14 | C12 | C11 | C9 | 0.1° | 1.6° |
| C14 | C12 | C11 | O18 | 179.8° | 179.2° |
| C12 | C14 | C16 | H6 | 179.9° | 179.7° |
| C35 | C36 | C38 | H16 | 180.0° | 180.0° |
| C35 | C36 | C38 | C41 | 178.5° | 179.9° |
| C35 | C36 | C38 | C39 | 0.9° | 0.1° |
| C36 | C35 | C33 | C32 | 1.3° | 1.6° |
| C36 | C35 | C33 | H15 | 178.7° | 178.5° |
| C38 | C36 | C35 | C33 | 1.7° | 1.0° |
| C36 | C38 | C41 | C39 | 179.4° | 180.0° |
| C36 | C38 | C41 | O44 | 135.3° | 90.0° |
| C36 | C38 | C39 | C32 | 0.2° | 0.7° |
| C36 | C38 | C39 | H17 | 179.8° | 179.3° |
| C36 | C38 | C41 | H18 | 104.5° | 150.0° |
| C36 | C38 | C41 | H19 | 15.1° | 30.0° |
| C8 | C9 | C11 | C12 | 0.8° | 1.1° |
| C8 | C9 | C11 | H39 | 180.0° | 179.9° |
| C8 | C9 | C11 | O18 | 179.0° | 179.6° |
| C9 | C8 | C5 | H2 | 16.1° | 174.7° |
| C9 | C8 | C5 | H3 | 135.4° | 54.9° |
| C9 | C8 | C16 | H6 | 179.4° | 179.2° |
| C35 | C33 | C32 | H15 | 180.0° | 180.0° |
| C35 | C33 | C32 | C39 | 0.2° | 1.0° |
| C35 | C33 | C32 | O31 | 179.4° | 179.5° |
| C33 | C35 | C36 | H16 | 178.3° | 178.9° |
| C38 | C41 | O44 | H18 | 120.2° | 120.0° |
| C38 | C41 | O44 | H19 | 120.2° | 120.0° |
| C38 | C41 | O44 | C45 | 167.3° | 180.0° |
| C41 | C38 | C39 | C32 | 179.6° | 179.3° |
| C41 | C38 | C36 | H16 | 1.6° | 0.1° |
| C41 | C38 | C39 | H17 | 0.4° | 0.7° |
| C38 | C41 | H18 | H19 | 119.3° | 120.0° |
| O44 | C41 | C38 | C39 | 44.1° | 90.0° |
| O44 | C41 | H18 | H19 | 119.3° | 120.0° |
| C41 | O44 | C45 | H20 | 180.0° | 60.0° |
| C41 | O44 | C45 | H21 | 60.0° | 180.0° |
| C41 | O44 | C45 | H22 | 60.0° | 60.0° |
| C38 | C39 | C32 | C33 | 0.5° | 0.2° |
| C38 | C39 | C32 | H17 | 180.0° | 180.0° |
| C38 | C39 | C32 | O31 | 179.8° | 179.4° |
| C39 | C38 | C36 | H16 | 179.0° | 179.9° |
| C39 | C38 | C41 | H18 | 76.2° | 30.0° |
| C39 | C38 | C41 | H19 | 164.3° | 150.0° |
| C12 | C11 | C9 | O18 | 179.9° | 179.3° |
| C12 | C11 | O18 | C19 | 178.1° | 161.7° |
| C11 | C12 | C14 | H5 | 179.6° | 179.2° |
| C12 | C11 | C9 | H39 | 179.2° | 178.8° |
| C9 | C11 | O18 | C19 | 2.0° | 17.5° |
| C9 | C11 | C12 | H4 | 180.0° | 178.4° |
| C33 | C32 | C39 | O31 | 179.6° | 179.6° |
| C33 | C32 | O31 | C28 | 10.8° | 41.7° |
| C33 | C32 | C39 | H17 | 179.4° | 179.8° |
| C45 | O44 | C41 | H18 | 47.1° | 60.0° |
| C45 | O44 | C41 | H19 | 72.4° | 60.0° |
| O44 | C45 | H20 | H21 | 120.0° | 120.0° |
| O44 | C45 | H20 | H22 | 120.0° | 120.0° |
| O44 | C45 | H21 | H22 | 120.0° | 120.0° |
| C11 | O18 | C19 | C22 | 134.1° | 145.8° |
| O18 | C11 | C12 | H4 | 0.2° | 0.9° |
| C11 | O18 | C19 | H7 | 14.4° | 25.8° |
| C11 | O18 | C19 | H8 | 106.2° | 94.1° |
| O18 | C11 | C9 | H39 | 1.0° | 0.4° |
| C39 | C32 | O31 | C28 | 169.6° | 138.8° |
| C39 | C32 | C33 | H15 | 179.8° | 179.1° |
| C32 | O31 | C28 | C25 | 98.6° | 121.6° |
| C32 | O31 | C28 | H13 | 21.1° | 1.5° |
| C32 | O31 | C28 | H14 | 141.7° | 118.3° |
| O31 | C32 | C33 | H15 | 0.6° | 0.5° |
| O31 | C32 | C39 | H17 | 0.2° | 0.6° |
| O18 | C19 | C22 | H7 | 119.7° | 120.0° |
| O18 | C19 | C22 | H8 | 119.7° | 120.0° |
| O18 | C19 | C22 | C25 | 80.0° | 165.1° |
| O18 | C19 | H7 | H8 | 120.9° | 120.0° |
| O18 | C19 | C22 | H9 | 159.5° | 45.0° |
| O18 | C19 | C22 | H10 | 40.7° | 74.9° |
| O31 | C28 | C25 | H13 | 119.7° | 120.1° |
| O31 | C28 | C25 | H14 | 119.7° | 120.0° |
| O31 | C28 | C25 | C22 | 173.3° | 156.9° |
| O31 | C28 | C25 | H11 | 52.9° | 83.0° |
| O31 | C28 | C25 | H12 | 66.3° | 36.9° |
| O31 | C28 | H13 | H14 | 120.9° | 119.8° |
| C28 | C25 | C22 | C19 | 81.4° | 110.8° |
| C28 | C25 | C22 | H11 | 120.4° | 120.1° |
| C28 | C25 | C22 | H12 | 120.5° | 120.0° |
| C28 | C25 | C22 | H9 | 158.0° | 9.2° |
| C28 | C25 | C22 | H10 | 39.2° | 129.1° |
| C28 | C25 | H11 | H12 | 118.7° | 119.9° |
| C25 | C28 | H13 | H14 | 120.9° | 119.9° |
| C19 | C22 | C25 | H9 | 120.6° | 120.1° |
| C19 | C22 | C25 | H10 | 120.6° | 120.1° |
| C22 | C19 | H7 | H8 | 121.0° | 119.9° |
| C19 | C22 | H9 | H10 | 118.2° | 119.9° |
| C19 | C22 | C25 | H11 | 158.2° | 129.1° |
| C19 | C22 | C25 | H12 | 39.1° | 9.1° |
| C25 | C22 | C19 | H7 | 39.7° | 45.0° |
| C25 | C22 | C19 | H8 | 160.4° | 74.9° |
| C25 | C22 | H9 | H10 | 118.2° | 119.8° |
| C22 | C25 | H11 | H12 | 118.7° | 119.9° |
| C22 | C25 | C28 | H13 | 67.0° | 36.8° |
| C22 | C25 | C28 | H14 | 53.6° | 83.1° |
| H1 | C3 | C5 | H2 | 162.4° | 37.1° |
| H1 | C3 | C5 | H3 | 43.1° | 82.8° |
| H1 | C3 | C51 | H23 | 174.9° | 179.8° |
| H1 | C3 | N1 | H40 | 162.8° | 143.0° |
| H4 | C12 | C14 | H5 | 0.4° | 0.9° |
| H5 | C14 | C16 | H6 | 0.1° | 0.4° |
| H7 | C19 | C22 | H9 | 80.8° | 75.0° |
| H7 | C19 | C22 | H10 | 160.3° | 165.1° |
| H8 | C19 | C22 | H9 | 39.8° | 165.0° |
| H8 | C19 | C22 | H10 | 79.0° | 45.1° |
| H9 | C22 | C25 | H11 | 37.6° | 110.9° |
| H9 | C22 | C25 | H12 | 81.5° | 129.2° |
| H10 | C22 | C25 | H11 | 81.2° | 8.9° |
| H10 | C22 | C25 | H12 | 159.7° | 111.0° |
| H11 | C25 | C28 | H13 | 172.6° | 156.9° |
| H11 | C25 | C28 | H14 | 66.8° | 37.0° |
| H12 | C25 | C28 | H13 | 53.4° | 83.2° |
| H12 | C25 | C28 | H14 | 174.0° | 157.0° |
| H20 | C45 | H21 | H22 | 120.0° | 119.9° |
| H23 | C51 | C55 | H24 | 171.4° | 65.0° |
| H23 | C51 | C55 | H25 | 50.7° | 175.0° |
| H23 | C51 | O53 | H43 | 60.2° | 180.0° |
| H24 | C55 | N58 | H41 | 167.6° | 63.9° |
| H25 | C55 | N58 | H41 | 46.8° | 176.1° |
| H26 | C60 | N58 | H41 | 67.0° | 176.1° |
| H27 | C60 | N58 | H41 | 51.7° | 63.9° |
| H29 | C67 | C69 | H30 | 0.4° | 0.0° |
| H30 | C69 | C71 | H31 | 0.1° | 0.2° |
| H32 | C73 | C75 | H33 | 63.9° | 60.0° |
| H32 | C73 | C75 | H34 | 176.1° | 60.0° |
| H32 | C73 | C75 | H35 | 56.1° | 180.0° |
| H32 | C73 | C79 | H36 | 64.0° | 180.0° |
| H32 | C73 | C79 | H37 | 56.0° | 60.0° |
| H32 | C73 | C79 | H38 | 176.0° | 59.9° |
| H33 | C75 | H34 | H35 | 120.0° | 119.9° |
| H36 | C79 | H37 | H38 | 120.0° | 120.0° |
