EAO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O13 | C12 | doub | 1.21Å | 1.20Å | |
| O10 | C09 | doub | 1.21Å | 1.22Å | |
| C12 | C14 | sing | 1.51Å | 1.51Å | |
| C12 | C08 | sing | 1.46Å | 1.49Å | |
| C09 | C08 | sing | 1.46Å | 1.53Å | |
| C09 | C11 | sing | 1.51Å | 1.49Å | |
| C08 | C07 | doub | 1.39Å | 1.31Å | |
| C07 | C06 | sing | 1.42Å | 1.50Å | |
| C06 | C05 | doub | 1.40Å | 1.39Å | Aromatic |
| C06 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.37Å | Aromatic |
| O01 | N02 | sing | 1.22Å | 1.38Å | |
| C04 | N02 | sing | 1.48Å | 1.46Å | |
| C04 | C18 | doub | 1.39Å | 1.34Å | Aromatic |
| C16 | C18 | sing | 1.40Å | 1.39Å | Aromatic |
| C16 | O17 | sing | 1.36Å | 1.40Å | |
| N02 | O03 | doub | 1.22Å | 1.17Å | |
| C18 | O19 | sing | 1.36Å | 1.37Å | |
| C05 | H1 | sing | 1.08Å | 1.08Å | |
| C07 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C14 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| O17 | H10 | sing | 0.97Å | 0.95Å | |
| O19 | H11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O13 | C12 | C14 | 124.8° | 120.1° |
| O13 | C12 | C08 | 114.9° | 120.0° |
| O10 | C09 | C08 | 122.8° | 120.0° |
| O10 | C09 | C11 | 122.3° | 119.9° |
| C14 | C12 | C08 | 120.3° | 119.9° |
| C12 | C14 | H6 | 109.5° | 109.5° |
| C12 | C14 | H7 | 109.5° | 109.5° |
| C12 | C14 | H8 | 109.5° | 109.4° |
| C12 | C08 | C09 | 116.8° | 120.0° |
| C12 | C08 | C07 | 119.8° | 120.0° |
| C08 | C09 | C11 | 114.9° | 120.1° |
| C09 | C08 | C07 | 123.3° | 120.0° |
| C09 | C11 | H3 | 109.5° | 109.4° |
| C09 | C11 | H4 | 109.5° | 109.5° |
| C09 | C11 | H5 | 109.4° | 109.6° |
| C08 | C07 | C06 | 128.8° | 120.0° |
| C08 | C07 | H2 | 115.6° | 120.1° |
| C07 | C06 | C05 | 123.3° | 120.1° |
| C07 | C06 | C15 | 114.0° | 120.1° |
| C06 | C07 | H2 | 115.6° | 120.0° |
| C05 | C06 | C15 | 122.7° | 119.7° |
| C06 | C05 | C04 | 117.7° | 119.9° |
| C06 | C05 | H1 | 121.2° | 120.0° |
| C06 | C15 | C16 | 117.1° | 119.8° |
| C06 | C15 | H9 | 121.4° | 120.1° |
| C05 | C04 | N02 | 115.7° | 119.9° |
| C05 | C04 | C18 | 120.5° | 120.2° |
| C04 | C05 | H1 | 121.2° | 120.1° |
| C15 | C16 | C18 | 120.9° | 120.0° |
| C15 | C16 | O17 | 122.1° | 119.9° |
| C16 | C15 | H9 | 121.5° | 120.1° |
| O01 | N02 | C04 | 115.4° | 120.0° |
| O01 | N02 | O03 | 119.9° | 120.0° |
| N02 | C04 | C18 | 123.8° | 119.9° |
| C04 | N02 | O03 | 124.7° | 120.0° |
| C04 | C18 | C16 | 121.0° | 120.3° |
| C04 | C18 | O19 | 121.3° | 119.9° |
| C18 | C16 | O17 | 116.9° | 120.0° |
| C16 | C18 | O19 | 117.6° | 119.8° |
| C16 | O17 | H10 | 109.5° | 114.0° |
| C18 | O19 | H11 | 109.5° | 114.0° |
| H3 | C11 | H4 | 109.4° | 109.4° |
| H3 | C11 | H5 | 109.4° | 109.5° |
| H4 | C11 | H5 | 109.5° | 109.5° |
| H6 | C14 | H7 | 109.5° | 109.5° |
| H6 | C14 | H8 | 109.5° | 109.5° |
| H7 | C14 | H8 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O13 | C12 | C14 | C08 | 178.6° | 179.9° |
| O13 | C12 | C08 | C09 | 1.9° | 179.7° |
| O13 | C12 | C08 | C07 | 178.5° | 0.4° |
| O13 | C12 | C14 | H6 | 0.0° | 178.0° |
| O13 | C12 | C14 | H7 | 120.0° | 58.0° |
| O13 | C12 | C14 | H8 | 120.0° | 62.0° |
| O10 | C09 | C08 | C12 | 98.8° | 115.1° |
| O10 | C09 | C08 | C11 | 179.6° | 179.9° |
| O10 | C09 | C08 | C07 | 77.6° | 65.0° |
| O10 | C09 | C11 | H3 | 0.0° | 176.7° |
| O10 | C09 | C11 | H4 | 120.0° | 56.7° |
| O10 | C09 | C11 | H5 | 120.0° | 63.3° |
| C14 | C12 | C08 | C09 | 179.3° | 0.3° |
| C14 | C12 | C08 | C07 | 2.7° | 179.7° |
| C12 | C14 | H6 | H7 | 120.0° | 120.0° |
| C12 | C14 | H6 | H8 | 120.0° | 120.0° |
| C12 | C14 | H7 | H8 | 120.0° | 119.9° |
| C12 | C08 | C09 | C07 | 176.4° | 179.9° |
| C12 | C08 | C09 | C11 | 81.6° | 64.8° |
| C12 | C08 | C07 | C06 | 179.7° | 173.7° |
| C12 | C08 | C07 | H2 | 0.3° | 6.4° |
| C08 | C12 | C14 | H6 | 178.6° | 1.9° |
| C08 | C12 | C14 | H7 | 58.6° | 122.0° |
| C08 | C12 | C14 | H8 | 61.3° | 118.1° |
| C09 | C08 | C07 | C06 | 4.0° | 6.3° |
| C09 | C08 | C07 | H2 | 176.0° | 173.7° |
| C08 | C09 | C11 | H3 | 179.6° | 3.4° |
| C08 | C09 | C11 | H4 | 59.6° | 123.3° |
| C08 | C09 | C11 | H5 | 60.4° | 116.6° |
| C11 | C09 | C08 | C07 | 102.0° | 115.1° |
| C09 | C11 | H3 | H4 | 120.0° | 120.0° |
| C09 | C11 | H3 | H5 | 120.0° | 120.1° |
| C09 | C11 | H4 | H5 | 120.0° | 120.1° |
| C08 | C07 | C06 | H2 | 180.0° | 180.0° |
| C08 | C07 | C06 | C05 | 20.6° | 146.4° |
| C08 | C07 | C06 | C15 | 161.7° | 33.6° |
| C07 | C06 | C05 | C15 | 177.6° | 179.9° |
| C07 | C06 | C05 | C04 | 179.3° | 180.0° |
| C07 | C06 | C15 | C16 | 179.4° | 180.0° |
| C07 | C06 | C05 | H1 | 0.7° | 0.1° |
| C07 | C06 | C15 | H9 | 0.6° | 0.1° |
| C06 | C05 | C04 | H1 | 180.0° | 179.9° |
| C05 | C06 | C15 | C16 | 1.6° | 0.1° |
| C06 | C05 | C04 | N02 | 178.0° | 180.0° |
| C06 | C05 | C04 | C18 | 3.2° | 0.3° |
| C05 | C06 | C07 | H2 | 159.4° | 33.5° |
| C05 | C06 | C15 | H9 | 178.3° | 180.0° |
| C15 | C06 | C05 | C04 | 1.8° | 0.1° |
| C06 | C15 | C16 | H9 | 180.0° | 179.9° |
| C06 | C15 | C16 | C18 | 2.9° | 0.3° |
| C06 | C15 | C16 | O17 | 179.0° | 180.0° |
| C15 | C06 | C05 | H1 | 178.2° | 180.0° |
| C15 | C06 | C07 | H2 | 18.3° | 146.4° |
| C05 | C04 | N02 | O01 | 6.0° | 179.7° |
| C05 | C04 | N02 | C18 | 178.7° | 179.8° |
| C05 | C04 | C18 | C16 | 4.6° | 0.5° |
| C05 | C04 | N02 | O03 | 172.4° | 0.3° |
| C05 | C04 | C18 | O19 | 179.6° | 179.7° |
| C15 | C16 | C18 | C04 | 4.5° | 0.5° |
| C15 | C16 | C18 | O17 | 176.2° | 179.7° |
| C15 | C16 | C18 | O19 | 179.6° | 179.7° |
| C15 | C16 | O17 | H10 | 180.0° | 89.9° |
| O01 | N02 | C04 | O03 | 178.4° | 179.9° |
| O01 | N02 | C04 | C18 | 172.7° | 0.1° |
| N02 | C04 | C18 | C16 | 176.7° | 179.7° |
| N02 | C04 | C18 | O19 | 1.0° | 0.1° |
| N02 | C04 | C05 | H1 | 2.0° | 0.1° |
| C04 | C18 | C16 | O19 | 175.9° | 179.8° |
| C04 | C18 | C16 | O17 | 179.2° | 179.8° |
| C18 | C04 | N02 | O03 | 8.9° | 180.0° |
| C18 | C04 | C05 | H1 | 176.7° | 179.8° |
| C04 | C18 | O19 | H11 | 2.3° | 90.0° |
| C18 | C16 | C15 | H9 | 177.0° | 179.8° |
| C18 | C16 | O17 | H10 | 3.8° | 89.8° |
| C16 | C18 | O19 | H11 | 173.5° | 89.8° |
| O17 | C16 | C18 | O19 | 3.4° | 0.1° |
| O17 | C16 | C15 | H9 | 1.0° | 0.1° |
| H3 | C11 | H4 | H5 | 120.0° | 120.0° |
| H6 | C14 | H7 | H8 | 120.0° | 120.0° |
