6EO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N18 | C17 | doub | 1.32Å | 1.36Å | Aromatic |
| N18 | C19 | sing | 1.32Å | 1.37Å | Aromatic |
| O16 | C07 | doub | 1.21Å | 1.22Å | |
| C17 | C05 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.36Å | Aromatic |
| C14 | C12 | sing | 1.38Å | 1.37Å | Aromatic |
| C15 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| CL1 | C12 | sing | 1.74Å | 1.74Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | C08 | sing | 1.51Å | 1.51Å | |
| C07 | N06 | sing | 1.35Å | 1.33Å | |
| C05 | N06 | sing | 1.39Å | 1.41Å | |
| C05 | C04 | doub | 1.41Å | 1.38Å | Aromatic |
| C09 | C08 | sing | 1.51Å | 1.46Å | |
| C09 | C10 | doub | 1.38Å | 1.42Å | Aromatic |
| C20 | C04 | sing | 1.40Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C04 | C02 | sing | 1.48Å | 1.51Å | |
| C02 | O01 | doub | 1.21Å | 1.24Å | |
| C02 | O03 | sing | 1.35Å | 1.25Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.08Å | 1.08Å | |
| C17 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H4 | sing | 1.08Å | 1.08Å | |
| O03 | H5 | sing | 0.97Å | 0.95Å | |
| N06 | H6 | sing | 0.97Å | 1.00Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C19 | H11 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | N18 | C19 | 115.8° | 122.1° |
| N18 | C17 | C05 | 123.7° | 120.8° |
| N18 | C17 | H3 | 118.2° | 119.6° |
| N18 | C19 | C20 | 124.1° | 121.2° |
| N18 | C19 | H11 | 117.9° | 119.4° |
| O16 | C07 | C08 | 118.8° | 120.0° |
| O16 | C07 | N06 | 122.7° | 120.0° |
| C17 | C05 | N06 | 122.0° | 120.6° |
| C17 | C05 | C04 | 118.9° | 118.8° |
| C05 | C17 | H3 | 118.1° | 119.6° |
| C15 | C14 | C12 | 120.2° | 120.0° |
| C14 | C15 | C09 | 122.0° | 120.1° |
| C14 | C15 | H2 | 119.0° | 119.9° |
| C15 | C14 | H10 | 119.9° | 120.1° |
| C14 | C12 | CL1 | 118.5° | 120.0° |
| C14 | C12 | C11 | 120.8° | 120.0° |
| C12 | C14 | H10 | 119.9° | 120.0° |
| C15 | C09 | C08 | 119.1° | 120.0° |
| C15 | C09 | C10 | 117.6° | 120.0° |
| C09 | C15 | H2 | 119.0° | 120.0° |
| CL1 | C12 | C11 | 120.7° | 120.0° |
| C19 | C20 | C04 | 118.2° | 119.0° |
| C19 | C20 | H4 | 120.9° | 120.5° |
| C20 | C19 | H11 | 118.0° | 119.4° |
| C12 | C11 | C10 | 118.6° | 120.0° |
| C12 | C11 | H9 | 120.7° | 120.0° |
| C08 | C07 | N06 | 118.3° | 120.0° |
| C07 | C08 | C09 | 115.2° | 109.5° |
| C07 | C08 | H7 | 108.0° | 109.5° |
| C07 | C08 | H8 | 108.0° | 109.5° |
| C07 | N06 | C05 | 129.5° | 120.0° |
| C07 | N06 | H6 | 115.2° | 120.0° |
| N06 | C05 | C04 | 119.0° | 120.6° |
| C05 | N06 | H6 | 115.2° | 120.0° |
| C05 | C04 | C20 | 119.1° | 118.1° |
| C05 | C04 | C02 | 121.9° | 121.0° |
| C08 | C09 | C10 | 123.3° | 120.0° |
| C09 | C08 | H7 | 108.0° | 109.5° |
| C09 | C08 | H8 | 108.0° | 109.5° |
| C09 | C10 | C11 | 120.8° | 120.0° |
| C09 | C10 | H1 | 119.6° | 120.0° |
| C20 | C04 | C02 | 118.9° | 120.9° |
| C04 | C20 | H4 | 120.9° | 120.5° |
| C11 | C10 | H1 | 119.6° | 120.0° |
| C10 | C11 | H9 | 120.7° | 120.0° |
| C04 | C02 | O01 | 120.6° | 120.0° |
| C04 | C02 | O03 | 115.7° | 120.0° |
| O01 | C02 | O03 | 123.7° | 120.0° |
| C02 | O03 | H5 | 109.5° | 116.9° |
| H7 | C08 | H8 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N18 | C17 | C05 | H3 | 180.0° | 179.7° |
| C17 | N18 | C19 | C20 | 1.2° | 0.0° |
| N18 | C17 | C05 | N06 | 179.9° | 179.7° |
| N18 | C17 | C05 | C04 | 3.7° | 0.4° |
| C17 | N18 | C19 | H11 | 178.8° | 179.9° |
| C19 | N18 | C17 | C05 | 2.7° | 0.0° |
| N18 | C19 | C20 | H11 | 180.0° | 179.9° |
| N18 | C19 | C20 | C04 | 0.7° | 0.3° |
| C19 | N18 | C17 | H3 | 177.2° | 179.7° |
| N18 | C19 | C20 | H4 | 179.3° | 179.7° |
| O16 | C07 | C08 | N06 | 175.5° | 179.9° |
| O16 | C07 | N06 | C05 | 4.4° | 5.4° |
| O16 | C07 | C08 | C09 | 48.9° | 0.1° |
| O16 | C07 | N06 | H6 | 175.5° | 174.7° |
| O16 | C07 | C08 | H7 | 169.7° | 120.0° |
| O16 | C07 | C08 | H8 | 72.0° | 120.0° |
| C17 | C05 | N06 | C07 | 8.9° | 34.8° |
| C17 | C05 | N06 | C04 | 176.2° | 179.9° |
| C17 | C05 | C04 | C20 | 3.0° | 0.6° |
| C17 | C05 | C04 | C02 | 178.4° | 179.4° |
| C17 | C05 | N06 | H6 | 171.1° | 145.2° |
| C15 | C14 | C12 | H10 | 180.0° | 179.7° |
| C14 | C15 | C09 | H2 | 180.0° | 180.0° |
| C15 | C14 | C12 | CL1 | 180.0° | 179.8° |
| C15 | C14 | C12 | C11 | 0.3° | 0.3° |
| C14 | C15 | C09 | C08 | 179.3° | 180.0° |
| C14 | C15 | C09 | C10 | 1.2° | 0.0° |
| C12 | C14 | C15 | C09 | 0.5° | 0.3° |
| C14 | C12 | CL1 | C11 | 179.7° | 179.9° |
| C14 | C12 | C11 | C10 | 0.3° | 0.0° |
| C12 | C14 | C15 | H2 | 179.5° | 179.7° |
| C14 | C12 | C11 | H9 | 179.7° | 180.0° |
| C15 | C09 | C08 | C07 | 87.9° | 90.0° |
| C15 | C09 | C08 | C10 | 179.5° | 180.0° |
| C15 | C09 | C10 | C11 | 1.1° | 0.3° |
| C15 | C09 | C10 | H1 | 178.9° | 180.0° |
| C15 | C09 | C08 | H7 | 151.3° | 30.0° |
| C15 | C09 | C08 | H8 | 33.0° | 150.0° |
| C09 | C15 | C14 | H10 | 179.6° | 180.0° |
| CL1 | C12 | C11 | C10 | 180.0° | 179.9° |
| CL1 | C12 | C11 | H9 | 0.0° | 0.0° |
| CL1 | C12 | C14 | H10 | 0.0° | 0.1° |
| C19 | C20 | C04 | C05 | 1.6° | 0.6° |
| C19 | C20 | C04 | H4 | 180.0° | 179.4° |
| C19 | C20 | C04 | C02 | 179.8° | 179.5° |
| C12 | C11 | C10 | C09 | 0.4° | 0.3° |
| C12 | C11 | C10 | H9 | 180.0° | 180.0° |
| C12 | C11 | C10 | H1 | 179.6° | 180.0° |
| C11 | C12 | C14 | H10 | 179.7° | 180.0° |
| C08 | C07 | N06 | C05 | 179.8° | 174.7° |
| C07 | C08 | C09 | H7 | 120.8° | 120.1° |
| C07 | C08 | C09 | H8 | 120.8° | 120.0° |
| C07 | C08 | C09 | C10 | 92.6° | 89.9° |
| C08 | C07 | N06 | H6 | 0.2° | 5.3° |
| C07 | C08 | H7 | H8 | 117.4° | 120.0° |
| C07 | N06 | C05 | H6 | 180.0° | 179.9° |
| C07 | N06 | C05 | C04 | 174.9° | 145.3° |
| N06 | C07 | C08 | C09 | 135.6° | 180.0° |
| N06 | C07 | C08 | H7 | 14.8° | 59.9° |
| N06 | C07 | C08 | H8 | 103.6° | 60.0° |
| N06 | C05 | C04 | C20 | 179.3° | 179.5° |
| N06 | C05 | C04 | C02 | 2.1° | 0.5° |
| N06 | C05 | C17 | H3 | 0.0° | 0.1° |
| C05 | C04 | C20 | C02 | 178.6° | 179.9° |
| C05 | C04 | C02 | O01 | 15.8° | 5.0° |
| C05 | C04 | C02 | O03 | 166.5° | 175.0° |
| C04 | C05 | C17 | H3 | 176.2° | 180.0° |
| C05 | C04 | C20 | H4 | 178.4° | 180.0° |
| C04 | C05 | N06 | H6 | 5.1° | 34.7° |
| C08 | C09 | C10 | C11 | 179.4° | 179.7° |
| C08 | C09 | C10 | H1 | 0.6° | 0.0° |
| C08 | C09 | C15 | H2 | 0.7° | 0.0° |
| C09 | C08 | H7 | H8 | 117.4° | 120.0° |
| C09 | C10 | C11 | H1 | 180.0° | 179.7° |
| C10 | C09 | C15 | H2 | 178.9° | 180.0° |
| C10 | C09 | C08 | H7 | 28.2° | 150.0° |
| C10 | C09 | C08 | H8 | 146.5° | 30.1° |
| C09 | C10 | C11 | H9 | 179.6° | 179.7° |
| C20 | C04 | C02 | O01 | 162.8° | 175.1° |
| C20 | C04 | C02 | O03 | 15.0° | 4.9° |
| C04 | C20 | C19 | H11 | 179.3° | 179.6° |
| C04 | C02 | O01 | O03 | 177.5° | 180.0° |
| C02 | C04 | C20 | H4 | 0.2° | 0.0° |
| C04 | C02 | O03 | H5 | 177.6° | 180.0° |
| O01 | C02 | O03 | H5 | 0.0° | 0.0° |
| H1 | C10 | C11 | H9 | 0.4° | 0.1° |
| H2 | C15 | C14 | H10 | 0.4° | 0.0° |
| H4 | C20 | C19 | H11 | 0.7° | 0.2° |
