E8E
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O48 | C47 | doub | 1.21Å | 1.24Å | |
| C47 | N49 | sing | 1.34Å | 1.34Å | |
| C47 | C45 | sing | 1.51Å | 1.47Å | |
| N49 | C51 | sing | 1.47Å | 1.51Å | |
| C42 | C45 | sing | 1.53Å | 1.54Å | |
| C42 | C40 | sing | 1.53Å | 1.56Å | |
| C45 | C54 | sing | 1.55Å | 1.55Å | |
| O67 | C66 | doub | 1.21Å | 1.23Å | |
| O01 | C02 | doub | 1.22Å | 1.29Å | |
| C34 | C25 | sing | 1.53Å | 1.51Å | |
| C57 | C40 | sing | 1.53Å | 1.52Å | |
| C57 | C66 | sing | 1.51Å | 1.50Å | |
| C57 | O58 | sing | 1.43Å | 1.49Å | |
| N38 | C40 | sing | 1.46Å | 1.48Å | |
| N38 | C36 | sing | 1.35Å | 1.37Å | |
| C51 | C54 | sing | 1.54Å | 1.52Å | |
| C66 | N68 | sing | 1.35Å | 1.36Å | |
| C20 | C36 | sing | 1.51Å | 1.45Å | |
| C20 | C22 | sing | 1.53Å | 1.54Å | |
| C20 | N18 | sing | 1.46Å | 1.45Å | |
| C02 | N18 | sing | 1.35Å | 1.33Å | |
| C02 | C03 | sing | 1.46Å | 1.54Å | |
| C36 | O37 | doub | 1.21Å | 1.23Å | |
| C25 | C22 | sing | 1.53Å | 1.55Å | |
| C25 | C26 | sing | 1.53Å | 1.57Å | |
| N68 | C70 | sing | 1.46Å | 1.49Å | |
| C05 | C03 | doub | 1.35Å | 1.49Å | |
| C05 | C07 | sing | 1.47Å | 1.39Å | |
| C16 | C07 | doub | 1.40Å | 1.42Å | Aromatic |
| C16 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C70 | C73 | sing | 1.51Å | 1.42Å | |
| C07 | C08 | sing | 1.40Å | 1.40Å | Aromatic |
| C14 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C73 | C74 | doub | 1.38Å | 1.41Å | Aromatic |
| C73 | C76 | sing | 1.38Å | 1.41Å | Aromatic |
| C74 | C82 | sing | 1.38Å | 1.42Å | Aromatic |
| C08 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C10 | sing | 1.38Å | 1.41Å | Aromatic |
| C76 | C78 | doub | 1.38Å | 1.40Å | Aromatic |
| C82 | C80 | doub | 1.38Å | 1.39Å | Aromatic |
| C78 | C80 | sing | 1.38Å | 1.41Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C20 | H2 | sing | 1.09Å | 1.10Å | |
| C03 | H3 | sing | 1.08Å | 1.08Å | |
| C05 | H4 | sing | 1.08Å | 1.08Å | |
| C08 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H6 | sing | 1.08Å | 1.08Å | |
| C14 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.08Å | 1.08Å | |
| C74 | H9 | sing | 1.08Å | 1.08Å | |
| C82 | H10 | sing | 1.08Å | 1.08Å | |
| C80 | H11 | sing | 1.08Å | 1.08Å | |
| C78 | H12 | sing | 1.08Å | 1.08Å | |
| C76 | H13 | sing | 1.08Å | 1.08Å | |
| C70 | H14 | sing | 1.09Å | 1.10Å | |
| C70 | H15 | sing | 1.09Å | 1.10Å | |
| N68 | H16 | sing | 0.97Å | 1.00Å | |
| C57 | H17 | sing | 1.09Å | 1.10Å | |
| O58 | H18 | sing | 0.97Å | 0.95Å | |
| C40 | H19 | sing | 1.09Å | 1.10Å | |
| C42 | H20 | sing | 1.09Å | 1.10Å | |
| C42 | H21 | sing | 1.09Å | 1.10Å | |
| C45 | H22 | sing | 1.09Å | 1.10Å | |
| C54 | H23 | sing | 1.09Å | 1.10Å | |
| C54 | H24 | sing | 1.09Å | 1.10Å | |
| C51 | H25 | sing | 1.09Å | 1.10Å | |
| C51 | H26 | sing | 1.09Å | 1.10Å | |
| N49 | H27 | sing | 0.97Å | 1.00Å | |
| N38 | H28 | sing | 0.97Å | 1.00Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H30 | sing | 1.09Å | 1.10Å | |
| C25 | H31 | sing | 1.09Å | 1.10Å | |
| C34 | H32 | sing | 1.09Å | 1.10Å | |
| C34 | H33 | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C26 | H35 | sing | 1.09Å | 1.10Å | |
| C26 | H36 | sing | 1.09Å | 1.10Å | |
| C26 | H37 | sing | 1.09Å | 1.10Å | |
| N18 | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O48 | C47 | N49 | 123.1° | 125.0° |
| O48 | C47 | C45 | 124.8° | 124.9° |
| N49 | C47 | C45 | 111.3° | 110.1° |
| C47 | N49 | C51 | 110.8° | 111.3° |
| C47 | N49 | H27 | 124.6° | 124.3° |
| C47 | C45 | C42 | 111.1° | 110.5° |
| C47 | C45 | C54 | 104.3° | 104.2° |
| C47 | C45 | H22 | 110.6° | 110.6° |
| N49 | C51 | C54 | 104.1° | 105.5° |
| N49 | C51 | H25 | 110.8° | 110.2° |
| N49 | C51 | H26 | 110.8° | 110.3° |
| C51 | N49 | H27 | 124.6° | 124.4° |
| C45 | C42 | C40 | 113.4° | 109.5° |
| C42 | C45 | C54 | 111.4° | 110.5° |
| C45 | C42 | H20 | 108.5° | 109.5° |
| C45 | C42 | H21 | 108.5° | 109.5° |
| C42 | C45 | H22 | 109.8° | 110.4° |
| C42 | C40 | C57 | 114.3° | 109.4° |
| C42 | C40 | N38 | 109.8° | 109.5° |
| C42 | C40 | H19 | 109.1° | 109.5° |
| C40 | C42 | H20 | 108.5° | 109.5° |
| C40 | C42 | H21 | 108.5° | 109.5° |
| C45 | C54 | C51 | 103.6° | 101.8° |
| C54 | C45 | H22 | 109.5° | 110.5° |
| C45 | C54 | H23 | 110.9° | 111.0° |
| C45 | C54 | H24 | 110.9° | 111.0° |
| O67 | C66 | C57 | 122.7° | 120.0° |
| O67 | C66 | N68 | 125.0° | 120.0° |
| O01 | C02 | N18 | 124.6° | 120.0° |
| O01 | C02 | C03 | 127.2° | 120.0° |
| C34 | C25 | C22 | 112.1° | 109.4° |
| C34 | C25 | C26 | 108.3° | 109.5° |
| C34 | C25 | H31 | 109.9° | 109.5° |
| C25 | C34 | H32 | 109.5° | 109.5° |
| C25 | C34 | H33 | 109.5° | 109.5° |
| C25 | C34 | H34 | 109.4° | 109.5° |
| C40 | C57 | C66 | 111.4° | 109.4° |
| C40 | C57 | O58 | 105.8° | 109.5° |
| C57 | C40 | N38 | 103.9° | 109.5° |
| C40 | C57 | H17 | 110.3° | 109.5° |
| C57 | C40 | H19 | 109.5° | 109.5° |
| C66 | C57 | O58 | 107.7° | 109.4° |
| C57 | C66 | N68 | 112.3° | 120.0° |
| C66 | C57 | H17 | 110.7° | 109.5° |
| O58 | C57 | H17 | 110.8° | 109.5° |
| C57 | O58 | H18 | 109.5° | 114.0° |
| C40 | N38 | C36 | 118.4° | 120.0° |
| N38 | C40 | H19 | 110.1° | 109.6° |
| C40 | N38 | H28 | 120.8° | 120.0° |
| N38 | C36 | C20 | 114.3° | 120.0° |
| N38 | C36 | O37 | 124.9° | 119.9° |
| C36 | N38 | H28 | 120.8° | 120.0° |
| C51 | C54 | H23 | 110.9° | 111.0° |
| C51 | C54 | H24 | 110.9° | 111.0° |
| C54 | C51 | H25 | 110.8° | 110.3° |
| C54 | C51 | H26 | 110.8° | 110.2° |
| C66 | N68 | C70 | 126.4° | 120.0° |
| C66 | N68 | H16 | 116.8° | 119.9° |
| C36 | C20 | C22 | 106.9° | 109.5° |
| C36 | C20 | N18 | 109.9° | 109.5° |
| C20 | C36 | O37 | 120.7° | 120.0° |
| C36 | C20 | H2 | 110.5° | 109.5° |
| C22 | C20 | N18 | 109.6° | 109.5° |
| C20 | C22 | C25 | 111.6° | 109.4° |
| C22 | C20 | H2 | 109.4° | 109.5° |
| C20 | C22 | H29 | 108.9° | 109.5° |
| C20 | C22 | H30 | 108.9° | 109.5° |
| C20 | N18 | C02 | 118.4° | 120.0° |
| N18 | C20 | H2 | 110.5° | 109.5° |
| C20 | N18 | H38 | 120.8° | 120.0° |
| N18 | C02 | C03 | 107.9° | 120.0° |
| C02 | N18 | H38 | 120.8° | 120.0° |
| C02 | C03 | C05 | 119.7° | 120.0° |
| C02 | C03 | H3 | 120.1° | 120.0° |
| C22 | C25 | C26 | 107.8° | 109.5° |
| C25 | C22 | H29 | 108.9° | 109.5° |
| C25 | C22 | H30 | 108.9° | 109.5° |
| C22 | C25 | H31 | 109.5° | 109.4° |
| C26 | C25 | H31 | 109.2° | 109.5° |
| C25 | C26 | H35 | 109.5° | 109.4° |
| C25 | C26 | H36 | 109.5° | 109.4° |
| C25 | C26 | H37 | 109.5° | 109.5° |
| N68 | C70 | C73 | 110.6° | 109.4° |
| N68 | C70 | H14 | 109.2° | 109.5° |
| N68 | C70 | H15 | 109.2° | 109.5° |
| C70 | N68 | H16 | 116.8° | 120.1° |
| C03 | C05 | C07 | 123.3° | 120.0° |
| C05 | C03 | H3 | 120.1° | 120.0° |
| C03 | C05 | H4 | 118.3° | 120.0° |
| C05 | C07 | C16 | 117.0° | 120.1° |
| C05 | C07 | C08 | 123.0° | 120.2° |
| C07 | C05 | H4 | 118.4° | 120.0° |
| C07 | C16 | C14 | 122.4° | 119.8° |
| C16 | C07 | C08 | 119.8° | 119.7° |
| C07 | C16 | H8 | 118.8° | 120.1° |
| C16 | C14 | C12 | 117.8° | 120.2° |
| C16 | C14 | H7 | 121.1° | 119.9° |
| C14 | C16 | H8 | 118.8° | 120.1° |
| C70 | C73 | C74 | 123.2° | 120.0° |
| C70 | C73 | C76 | 118.9° | 120.0° |
| C73 | C70 | H14 | 109.2° | 109.4° |
| C73 | C70 | H15 | 109.2° | 109.5° |
| C07 | C08 | C10 | 117.2° | 119.8° |
| C07 | C08 | H5 | 121.4° | 120.1° |
| C14 | C12 | C10 | 120.5° | 120.4° |
| C14 | C12 | H6 | 119.7° | 119.8° |
| C12 | C14 | H7 | 121.1° | 119.9° |
| C74 | C73 | C76 | 117.7° | 120.0° |
| C73 | C74 | C82 | 122.5° | 120.0° |
| C73 | C74 | H9 | 118.7° | 120.0° |
| C73 | C76 | C78 | 120.7° | 120.0° |
| C73 | C76 | H13 | 119.6° | 120.0° |
| C74 | C82 | C80 | 117.8° | 120.0° |
| C82 | C74 | H9 | 118.8° | 120.0° |
| C74 | C82 | H10 | 121.1° | 120.0° |
| C08 | C10 | C12 | 122.2° | 120.2° |
| C08 | C10 | H1 | 118.9° | 119.9° |
| C10 | C08 | H5 | 121.4° | 120.1° |
| C12 | C10 | H1 | 118.9° | 119.9° |
| C10 | C12 | H6 | 119.7° | 119.8° |
| C76 | C78 | C80 | 119.8° | 120.0° |
| C76 | C78 | H12 | 120.1° | 120.0° |
| C78 | C76 | H13 | 119.7° | 120.0° |
| C82 | C80 | C78 | 121.3° | 120.0° |
| C80 | C82 | H10 | 121.1° | 120.0° |
| C82 | C80 | H11 | 119.3° | 120.0° |
| C78 | C80 | H11 | 119.3° | 120.0° |
| C80 | C78 | H12 | 120.1° | 120.0° |
| H14 | C70 | H15 | 109.5° | 109.5° |
| H20 | C42 | H21 | 109.5° | 109.5° |
| H23 | C54 | H24 | 109.5° | 110.8° |
| H25 | C51 | H26 | 109.5° | 110.2° |
| H29 | C22 | H30 | 109.5° | 109.5° |
| H32 | C34 | H33 | 109.5° | 109.4° |
| H32 | C34 | H34 | 109.5° | 109.5° |
| H33 | C34 | H34 | 109.5° | 109.5° |
| H35 | C26 | H36 | 109.5° | 109.5° |
| H35 | C26 | H37 | 109.4° | 109.5° |
| H36 | C26 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O48 | C47 | N49 | C45 | 170.1° | 180.0° |
| O48 | C47 | N49 | C51 | 172.9° | 179.6° |
| O48 | C47 | C45 | C42 | 53.0° | 45.1° |
| O48 | C47 | C45 | C54 | 173.2° | 163.7° |
| O48 | C47 | C45 | H22 | 69.2° | 77.5° |
| O48 | C47 | N49 | H27 | 7.1° | 0.3° |
| C47 | N49 | C51 | H27 | 180.0° | 179.9° |
| N49 | C47 | C45 | C42 | 137.1° | 134.9° |
| N49 | C47 | C45 | C54 | 16.9° | 16.2° |
| C47 | N49 | C51 | C54 | 12.9° | 17.0° |
| N49 | C47 | C45 | H22 | 100.8° | 102.6° |
| C47 | N49 | C51 | H25 | 106.2° | 136.1° |
| C47 | N49 | C51 | H26 | 132.0° | 102.0° |
| C45 | C47 | N49 | C51 | 2.8° | 0.4° |
| C47 | C45 | C42 | C54 | 115.8° | 114.8° |
| C47 | C45 | C42 | H22 | 122.7° | 122.7° |
| C47 | C45 | C42 | C40 | 178.6° | 71.6° |
| C47 | C45 | C54 | H22 | 118.4° | 118.8° |
| C47 | C45 | C54 | C51 | 23.7° | 24.8° |
| C47 | C45 | C42 | H20 | 60.8° | 48.3° |
| C47 | C45 | C42 | H21 | 58.1° | 168.4° |
| C47 | C45 | C54 | H23 | 95.4° | 93.4° |
| C47 | C45 | C54 | H24 | 142.7° | 143.0° |
| C45 | C47 | N49 | H27 | 177.2° | 179.7° |
| N49 | C51 | C54 | C45 | 22.0° | 25.4° |
| N49 | C51 | C54 | H25 | 119.1° | 119.0° |
| N49 | C51 | C54 | H26 | 119.2° | 119.1° |
| N49 | C51 | C54 | H23 | 97.1° | 92.7° |
| N49 | C51 | C54 | H24 | 141.0° | 143.6° |
| N49 | C51 | H25 | H26 | 122.5° | 122.0° |
| C45 | C42 | C40 | H20 | 120.6° | 120.0° |
| C45 | C42 | C40 | H21 | 120.6° | 120.0° |
| C42 | C45 | C54 | H22 | 121.6° | 122.5° |
| C45 | C42 | C40 | C57 | 175.0° | 65.8° |
| C45 | C42 | C40 | N38 | 68.7° | 174.3° |
| C42 | C45 | C54 | C51 | 143.6° | 143.5° |
| C45 | C42 | C40 | H19 | 52.1° | 54.2° |
| C45 | C42 | H20 | H21 | 118.2° | 120.0° |
| C42 | C45 | C54 | H23 | 24.6° | 25.3° |
| C42 | C45 | C54 | H24 | 97.3° | 98.3° |
| C40 | C42 | C45 | C54 | 65.5° | 173.6° |
| C42 | C40 | C57 | N38 | 119.7° | 119.9° |
| C42 | C40 | C57 | H19 | 122.7° | 120.0° |
| C42 | C40 | C57 | C66 | 74.6° | 180.0° |
| C42 | C40 | C57 | O58 | 168.7° | 60.0° |
| C42 | C40 | N38 | H19 | 120.1° | 120.0° |
| C42 | C40 | N38 | C36 | 117.6° | 88.1° |
| C42 | C40 | C57 | H17 | 48.8° | 60.0° |
| C40 | C42 | H20 | H21 | 118.2° | 120.0° |
| C40 | C42 | C45 | H22 | 56.0° | 51.0° |
| C42 | C40 | N38 | H28 | 62.4° | 92.0° |
| C45 | C54 | C51 | H23 | 119.1° | 118.1° |
| C45 | C54 | C51 | H24 | 119.1° | 118.2° |
| C54 | C45 | C42 | H20 | 55.0° | 66.5° |
| C54 | C45 | C42 | H21 | 173.9° | 53.6° |
| C45 | C54 | H23 | H24 | 122.7° | 123.8° |
| C45 | C54 | C51 | H25 | 97.1° | 144.4° |
| C45 | C54 | C51 | H26 | 141.1° | 93.7° |
| O67 | C66 | C57 | C40 | 66.4° | 115.0° |
| O67 | C66 | C57 | N68 | 177.6° | 179.9° |
| O67 | C66 | C57 | O58 | 178.0° | 5.0° |
| O67 | C66 | N68 | C70 | 1.2° | 0.0° |
| O67 | C66 | N68 | H16 | 178.9° | 180.0° |
| O67 | C66 | C57 | H17 | 56.8° | 125.0° |
| O01 | C02 | N18 | C20 | 8.7° | 0.0° |
| O01 | C02 | N18 | C03 | 173.5° | 180.0° |
| O01 | C02 | C03 | C05 | 5.0° | 0.0° |
| O01 | C02 | C03 | H3 | 174.9° | 180.0° |
| O01 | C02 | N18 | H38 | 171.3° | 180.0° |
| C34 | C25 | C22 | C20 | 76.2° | 175.0° |
| C34 | C25 | C22 | C26 | 119.1° | 120.0° |
| C34 | C25 | C22 | H31 | 122.2° | 120.0° |
| C34 | C25 | C26 | H31 | 119.7° | 120.0° |
| C34 | C25 | C22 | H29 | 163.5° | 55.0° |
| C34 | C25 | C22 | H30 | 44.1° | 65.0° |
| C25 | C34 | H32 | H33 | 120.0° | 120.0° |
| C25 | C34 | H32 | H34 | 120.0° | 120.0° |
| C25 | C34 | H33 | H34 | 119.9° | 120.0° |
| C34 | C25 | C26 | H35 | 180.0° | 180.0° |
| C34 | C25 | C26 | H36 | 60.0° | 60.0° |
| C34 | C25 | C26 | H37 | 60.0° | 60.0° |
| C40 | C57 | C66 | O58 | 115.6° | 120.0° |
| C40 | C57 | C66 | H17 | 123.2° | 120.0° |
| C40 | C57 | O58 | H17 | 119.6° | 120.0° |
| C57 | C40 | N38 | H19 | 117.2° | 120.0° |
| C57 | C40 | N38 | C36 | 119.7° | 152.0° |
| C40 | C57 | C66 | N68 | 111.2° | 65.1° |
| C40 | C57 | O58 | H18 | 180.0° | 60.0° |
| C57 | C40 | C42 | H20 | 54.4° | 174.3° |
| C57 | C40 | C42 | H21 | 64.4° | 54.2° |
| C57 | C40 | N38 | H28 | 60.3° | 27.9° |
| C66 | C57 | O58 | H17 | 121.1° | 120.0° |
| C66 | C57 | C40 | N38 | 165.7° | 60.0° |
| C57 | C66 | N68 | C70 | 176.4° | 180.0° |
| C57 | C66 | N68 | H16 | 3.5° | 0.1° |
| C66 | C57 | O58 | H18 | 60.8° | 60.0° |
| C66 | C57 | C40 | H19 | 48.1° | 60.1° |
| O58 | C57 | C40 | N38 | 49.0° | 59.9° |
| O58 | C57 | C66 | N68 | 4.4° | 175.0° |
| O58 | C57 | C40 | H19 | 68.6° | 180.0° |
| C40 | N38 | C36 | H28 | 180.0° | 179.9° |
| C40 | N38 | C36 | C20 | 176.4° | 174.8° |
| C40 | N38 | C36 | O37 | 0.1° | 5.2° |
| N38 | C40 | C57 | H17 | 70.9° | 180.0° |
| N38 | C40 | C42 | H20 | 170.7° | 54.3° |
| N38 | C40 | C42 | H21 | 51.9° | 65.7° |
| N38 | C36 | C20 | O37 | 176.6° | 180.0° |
| N38 | C36 | C20 | C22 | 93.1° | 60.0° |
| N38 | C36 | C20 | N18 | 147.9° | 180.0° |
| N38 | C36 | C20 | H2 | 25.8° | 60.0° |
| C36 | N38 | C40 | H19 | 2.5° | 32.0° |
| C51 | C54 | C45 | H22 | 94.7° | 94.1° |
| C51 | C54 | H23 | H24 | 122.7° | 123.8° |
| C54 | C51 | H25 | H26 | 122.5° | 121.9° |
| C54 | C51 | N49 | H27 | 167.1° | 163.1° |
| C66 | N68 | C70 | H16 | 180.0° | 179.9° |
| C66 | N68 | C70 | C73 | 95.9° | 179.9° |
| C66 | N68 | C70 | H14 | 24.3° | 60.0° |
| C66 | N68 | C70 | H15 | 143.9° | 60.0° |
| N68 | C66 | C57 | H17 | 125.6° | 55.0° |
| C36 | C20 | C22 | N18 | 119.1° | 120.0° |
| C36 | C20 | C22 | H2 | 119.7° | 120.0° |
| C36 | C20 | N18 | H2 | 122.2° | 120.0° |
| C36 | C20 | N18 | C02 | 126.2° | 155.0° |
| C36 | C20 | C22 | C25 | 174.5° | 175.0° |
| C20 | C36 | N38 | H28 | 3.7° | 5.1° |
| C36 | C20 | C22 | H29 | 65.2° | 65.0° |
| C36 | C20 | C22 | H30 | 54.2° | 55.0° |
| C36 | C20 | N18 | H38 | 53.8° | 25.0° |
| C22 | C20 | N18 | H2 | 120.6° | 120.0° |
| C22 | C20 | N18 | C02 | 116.6° | 85.0° |
| C22 | C20 | C36 | O37 | 83.4° | 120.0° |
| C20 | C22 | C25 | H29 | 120.3° | 120.0° |
| C20 | C22 | C25 | H30 | 120.3° | 120.0° |
| C20 | C22 | C25 | C26 | 164.7° | 65.0° |
| C20 | C22 | H29 | H30 | 119.0° | 120.0° |
| C20 | C22 | C25 | H31 | 46.0° | 55.0° |
| C22 | C20 | N18 | H38 | 63.4° | 95.0° |
| C20 | N18 | C02 | H38 | 180.0° | 180.0° |
| C20 | N18 | C02 | C03 | 177.8° | 180.0° |
| N18 | C20 | C36 | O37 | 35.5° | 0.0° |
| N18 | C20 | C22 | C25 | 66.4° | 65.0° |
| N18 | C20 | C22 | H29 | 53.9° | 55.0° |
| N18 | C20 | C22 | H30 | 173.3° | 175.0° |
| N18 | C02 | C03 | C05 | 178.3° | 180.0° |
| C02 | N18 | C20 | H2 | 4.0° | 35.0° |
| N18 | C02 | C03 | H3 | 1.7° | 0.0° |
| C02 | C03 | C05 | H3 | 180.0° | 180.0° |
| C02 | C03 | C05 | C07 | 179.5° | 180.0° |
| C02 | C03 | C05 | H4 | 0.5° | 0.0° |
| C03 | C02 | N18 | H38 | 2.2° | 0.0° |
| O37 | C36 | C20 | H2 | 157.7° | 120.0° |
| O37 | C36 | N38 | H28 | 179.9° | 174.9° |
| C22 | C25 | C26 | H31 | 118.9° | 120.0° |
| C25 | C22 | C20 | H2 | 54.8° | 55.0° |
| C25 | C22 | H29 | H30 | 119.0° | 120.0° |
| C22 | C25 | C34 | H32 | 180.0° | 60.1° |
| C22 | C25 | C34 | H33 | 60.0° | 180.0° |
| C22 | C25 | C34 | H34 | 60.0° | 60.0° |
| C22 | C25 | C26 | H35 | 58.6° | 60.0° |
| C22 | C25 | C26 | H36 | 61.4° | 180.0° |
| C22 | C25 | C26 | H37 | 178.5° | 60.0° |
| C26 | C25 | C22 | H29 | 44.4° | 175.0° |
| C26 | C25 | C22 | H30 | 75.0° | 55.0° |
| C26 | C25 | C34 | H32 | 61.2° | 59.9° |
| C26 | C25 | C34 | H33 | 58.8° | 60.0° |
| C26 | C25 | C34 | H34 | 178.8° | 180.0° |
| C25 | C26 | H35 | H36 | 120.0° | 120.0° |
| C25 | C26 | H35 | H37 | 120.0° | 120.0° |
| C25 | C26 | H36 | H37 | 120.0° | 120.0° |
| N68 | C70 | C73 | H14 | 120.2° | 120.0° |
| N68 | C70 | C73 | H15 | 120.2° | 120.0° |
| N68 | C70 | C73 | C74 | 9.1° | 90.0° |
| N68 | C70 | C73 | C76 | 175.6° | 89.5° |
| N68 | C70 | H14 | H15 | 119.5° | 120.0° |
| C03 | C05 | C07 | H4 | 180.0° | 180.0° |
| C03 | C05 | C07 | C16 | 159.1° | 0.0° |
| C03 | C05 | C07 | C08 | 24.5° | 180.0° |
| C05 | C07 | C16 | C08 | 176.5° | 180.0° |
| C05 | C07 | C16 | C14 | 178.0° | 179.8° |
| C05 | C07 | C08 | C10 | 177.8° | 180.0° |
| C07 | C05 | C03 | H3 | 0.5° | 0.0° |
| C05 | C07 | C08 | H5 | 2.2° | 0.0° |
| C05 | C07 | C16 | H8 | 2.0° | 0.0° |
| C07 | C16 | C14 | H8 | 180.0° | 179.8° |
| C07 | C16 | C14 | C12 | 0.5° | 0.3° |
| C16 | C07 | C08 | C10 | 1.5° | 0.0° |
| C16 | C07 | C05 | H4 | 20.9° | 180.0° |
| C16 | C07 | C08 | H5 | 178.5° | 180.0° |
| C07 | C16 | C14 | H7 | 179.5° | 179.7° |
| C14 | C16 | C07 | C08 | 1.5° | 0.3° |
| C16 | C14 | C12 | H7 | 180.0° | 180.0° |
| C16 | C14 | C12 | C10 | 0.3° | 0.1° |
| C16 | C14 | C12 | H6 | 179.8° | 180.0° |
| C70 | C73 | C74 | C76 | 175.4° | 179.5° |
| C70 | C73 | C74 | C82 | 178.7° | 180.0° |
| C70 | C73 | C76 | C78 | 177.4° | 180.0° |
| C70 | C73 | C74 | H9 | 1.3° | 0.3° |
| C70 | C73 | C76 | H13 | 2.6° | 0.2° |
| C73 | C70 | H14 | H15 | 119.5° | 120.0° |
| C73 | C70 | N68 | H16 | 84.1° | 0.0° |
| C07 | C08 | C10 | H5 | 180.0° | 180.0° |
| C07 | C08 | C10 | C12 | 0.8° | 0.3° |
| C07 | C08 | C10 | H1 | 179.3° | 180.0° |
| C08 | C07 | C05 | H4 | 155.5° | 0.0° |
| C08 | C07 | C16 | H8 | 178.5° | 180.0° |
| C14 | C12 | C10 | C08 | 0.1° | 0.2° |
| C14 | C12 | C10 | H6 | 180.0° | 179.9° |
| C14 | C12 | C10 | H1 | 179.9° | 179.9° |
| C12 | C14 | C16 | H8 | 179.5° | 180.0° |
| C73 | C74 | C82 | H9 | 180.0° | 179.7° |
| C74 | C73 | C76 | C78 | 1.8° | 0.5° |
| C73 | C74 | C82 | C80 | 3.4° | 0.3° |
| C73 | C74 | C82 | H10 | 176.6° | 179.7° |
| C74 | C73 | C76 | H13 | 178.2° | 179.7° |
| C74 | C73 | C70 | H14 | 129.2° | 150.0° |
| C74 | C73 | C70 | H15 | 111.1° | 30.0° |
| C76 | C73 | C74 | C82 | 3.3° | 0.5° |
| C73 | C76 | C78 | H13 | 180.0° | 179.8° |
| C73 | C76 | C78 | C80 | 0.5° | 0.3° |
| C76 | C73 | C74 | H9 | 176.7° | 179.8° |
| C73 | C76 | C78 | H12 | 179.5° | 179.8° |
| C76 | C73 | C70 | H14 | 55.4° | 30.5° |
| C76 | C73 | C70 | H15 | 64.2° | 150.5° |
| C74 | C82 | C80 | H10 | 180.0° | 180.0° |
| C74 | C82 | C80 | C78 | 2.1° | 0.0° |
| C74 | C82 | C80 | H11 | 177.9° | 180.0° |
| C08 | C10 | C12 | H1 | 180.0° | 179.7° |
| C08 | C10 | C12 | H6 | 179.9° | 179.7° |
| C12 | C10 | C08 | H5 | 179.3° | 179.7° |
| C10 | C12 | C14 | H7 | 179.7° | 180.0° |
| C76 | C78 | C80 | C82 | 0.7° | 0.0° |
| C76 | C78 | C80 | H12 | 180.0° | 180.0° |
| C76 | C78 | C80 | H11 | 179.3° | 180.0° |
| C82 | C80 | C78 | H11 | 180.0° | 180.0° |
| C80 | C82 | C74 | H9 | 176.6° | 180.0° |
| C82 | C80 | C78 | H12 | 179.3° | 180.0° |
| C78 | C80 | C82 | H10 | 178.0° | 180.0° |
| C80 | C78 | C76 | H13 | 179.5° | 179.9° |
| H1 | C10 | C08 | H5 | 0.7° | 0.0° |
| H1 | C10 | C12 | H6 | 0.1° | 0.0° |
| H2 | C20 | C22 | H29 | 175.1° | 175.0° |
| H2 | C20 | C22 | H30 | 65.5° | 65.0° |
| H2 | C20 | N18 | H38 | 176.0° | 145.0° |
| H3 | C03 | C05 | H4 | 179.5° | 180.0° |
| H6 | C12 | C14 | H7 | 0.3° | 0.1° |
| H7 | C14 | C16 | H8 | 0.5° | 0.0° |
| H9 | C74 | C82 | H10 | 3.4° | 0.0° |
| H10 | C82 | C80 | H11 | 2.0° | 0.0° |
| H11 | C80 | C78 | H12 | 0.7° | 0.1° |
| H12 | C78 | C76 | H13 | 0.5° | 0.0° |
| H14 | C70 | N68 | H16 | 155.8° | 119.9° |
| H15 | C70 | N68 | H16 | 36.1° | 120.0° |
| H17 | C57 | O58 | H18 | 60.4° | 180.0° |
| H17 | C57 | C40 | H19 | 171.5° | 59.9° |
| H19 | C40 | C42 | H20 | 68.5° | 65.8° |
| H19 | C40 | C42 | H21 | 172.7° | 174.2° |
| H19 | C40 | N38 | H28 | 177.5° | 147.9° |
| H20 | C42 | C45 | H22 | 176.5° | 171.0° |
| H21 | C42 | C45 | H22 | 64.6° | 69.0° |
| H22 | C45 | C54 | H23 | 146.2° | 147.8° |
| H22 | C45 | C54 | H24 | 24.3° | 24.1° |
| H23 | C54 | C51 | H25 | 143.8° | 26.3° |
| H23 | C54 | C51 | H26 | 22.1° | 148.2° |
| H24 | C54 | C51 | H25 | 21.9° | 97.4° |
| H24 | C54 | C51 | H26 | 99.8° | 24.5° |
| H25 | C51 | N49 | H27 | 73.7° | 44.0° |
| H26 | C51 | N49 | H27 | 48.0° | 77.9° |
| H29 | C22 | C25 | H31 | 74.3° | 65.0° |
| H30 | C22 | C25 | H31 | 166.3° | 175.0° |
| H31 | C25 | C34 | H32 | 58.1° | 180.0° |
| H31 | C25 | C34 | H33 | 178.1° | 60.1° |
| H31 | C25 | C34 | H34 | 62.0° | 60.0° |
| H31 | C25 | C26 | H35 | 60.3° | 60.0° |
| H31 | C25 | C26 | H36 | 179.7° | 60.0° |
| H31 | C25 | C26 | H37 | 59.7° | 180.0° |
| H32 | C34 | H33 | H34 | 120.0° | 120.0° |
| H35 | C26 | H36 | H37 | 120.0° | 120.0° |
