ZUL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C18 | doub | 1.38Å | 1.42Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.44Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.42Å | Aromatic |
| C16 | C15 | doub | 1.39Å | 1.42Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.42Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.42Å | Aromatic |
| C15 | C13 | sing | 1.48Å | 1.52Å | |
| F01 | C02 | sing | 1.35Å | 1.42Å | |
| C13 | C12 | doub | 1.39Å | 1.42Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.44Å | Aromatic |
| C02 | C03 | doub | 1.39Å | 1.40Å | Aromatic |
| C02 | C07 | sing | 1.38Å | 1.42Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.42Å | Aromatic |
| C03 | C04 | sing | 1.38Å | 1.43Å | Aromatic |
| C14 | C09 | doub | 1.39Å | 1.45Å | Aromatic |
| C07 | C06 | doub | 1.39Å | 1.44Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.42Å | Aromatic |
| C04 | C05 | doub | 1.40Å | 1.44Å | Aromatic |
| C09 | C10 | sing | 1.39Å | 1.43Å | Aromatic |
| C09 | N08 | sing | 1.40Å | 1.46Å | |
| C06 | C05 | sing | 1.41Å | 1.43Å | Aromatic |
| C06 | N08 | sing | 1.39Å | 1.48Å | |
| C05 | C21 | sing | 1.47Å | 1.62Å | |
| O22 | C21 | doub | 1.22Å | 1.26Å | |
| C21 | O23 | sing | 1.35Å | 1.27Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C20 | H3 | sing | 1.08Å | 1.08Å | |
| C03 | H4 | sing | 1.08Å | 1.08Å | |
| C04 | H5 | sing | 1.08Å | 1.08Å | |
| C07 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| N08 | H13 | sing | 0.97Å | 1.00Å | |
| O23 | H14 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | C16 | 120.0° | 120.1° |
| C17 | C18 | C19 | 118.8° | 120.3° |
| C18 | C17 | H2 | 120.0° | 120.0° |
| C17 | C18 | H11 | 120.6° | 119.9° |
| C17 | C16 | C15 | 121.4° | 119.9° |
| C16 | C17 | H2 | 120.0° | 119.9° |
| C17 | C16 | H10 | 119.3° | 120.1° |
| C18 | C19 | C20 | 120.6° | 120.1° |
| C19 | C18 | H11 | 120.6° | 119.9° |
| C18 | C19 | H12 | 119.7° | 120.0° |
| C16 | C15 | C20 | 117.5° | 119.7° |
| C16 | C15 | C13 | 120.7° | 120.2° |
| C15 | C16 | H10 | 119.3° | 120.1° |
| C19 | C20 | C15 | 121.7° | 119.9° |
| C19 | C20 | H3 | 119.2° | 120.1° |
| C20 | C19 | H12 | 119.7° | 119.9° |
| C20 | C15 | C13 | 121.9° | 120.1° |
| C15 | C20 | H3 | 119.1° | 120.0° |
| C15 | C13 | C12 | 119.5° | 120.1° |
| C15 | C13 | C14 | 121.6° | 120.1° |
| F01 | C02 | C03 | 116.7° | 119.8° |
| F01 | C02 | C07 | 117.7° | 119.8° |
| C12 | C13 | C14 | 118.9° | 119.8° |
| C13 | C12 | C11 | 119.2° | 120.1° |
| C13 | C12 | H8 | 120.4° | 120.0° |
| C13 | C14 | C09 | 122.7° | 119.8° |
| C13 | C14 | H9 | 118.7° | 120.1° |
| C03 | C02 | C07 | 125.5° | 120.4° |
| C02 | C03 | C04 | 115.3° | 120.4° |
| C02 | C03 | H4 | 122.3° | 119.8° |
| C02 | C07 | C06 | 118.0° | 120.0° |
| C02 | C07 | H6 | 121.0° | 120.1° |
| C12 | C11 | C10 | 121.4° | 120.2° |
| C12 | C11 | H7 | 119.3° | 119.9° |
| C11 | C12 | H8 | 120.4° | 120.0° |
| C03 | C04 | C05 | 122.4° | 119.9° |
| C04 | C03 | H4 | 122.3° | 119.8° |
| C03 | C04 | H5 | 118.8° | 120.0° |
| C14 | C09 | C10 | 116.3° | 120.0° |
| C14 | C09 | N08 | 121.8° | 120.0° |
| C09 | C14 | H9 | 118.6° | 120.1° |
| C07 | C06 | C05 | 119.0° | 119.7° |
| C07 | C06 | N08 | 117.4° | 120.2° |
| C06 | C07 | H6 | 121.0° | 119.9° |
| C11 | C10 | C09 | 121.6° | 120.2° |
| C11 | C10 | H1 | 119.2° | 119.9° |
| C10 | C11 | H7 | 119.3° | 119.9° |
| C04 | C05 | C06 | 119.7° | 119.6° |
| C04 | C05 | C21 | 119.2° | 120.2° |
| C05 | C04 | H5 | 118.8° | 120.0° |
| C10 | C09 | N08 | 121.9° | 120.0° |
| C09 | C10 | H1 | 119.2° | 120.0° |
| C09 | N08 | C06 | 123.8° | 120.0° |
| C09 | N08 | H13 | 118.1° | 120.0° |
| C05 | C06 | N08 | 123.5° | 120.1° |
| C06 | C05 | C21 | 121.1° | 120.2° |
| C06 | N08 | H13 | 118.1° | 120.0° |
| C05 | C21 | O22 | 117.2° | 120.0° |
| C05 | C21 | O23 | 118.7° | 120.0° |
| O22 | C21 | O23 | 124.1° | 120.0° |
| C21 | O23 | H14 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | C16 | H2 | 180.0° | 179.2° |
| C17 | C18 | C19 | H11 | 180.0° | 179.2° |
| C18 | C17 | C16 | C15 | 0.8° | 0.6° |
| C17 | C18 | C19 | C20 | 0.2° | 0.5° |
| C18 | C17 | C16 | H10 | 179.2° | 179.5° |
| C17 | C18 | C19 | H12 | 179.8° | 180.0° |
| C16 | C17 | C18 | C19 | 0.3° | 0.8° |
| C17 | C16 | C15 | H10 | 180.0° | 179.9° |
| C17 | C16 | C15 | C20 | 0.8° | 0.0° |
| C17 | C16 | C15 | C13 | 179.1° | 179.7° |
| C16 | C17 | C18 | H11 | 179.7° | 180.0° |
| C18 | C19 | C20 | H12 | 180.0° | 179.5° |
| C18 | C19 | C20 | C15 | 0.2° | 0.0° |
| C19 | C18 | C17 | H2 | 179.7° | 180.0° |
| C18 | C19 | C20 | H3 | 179.8° | 179.9° |
| C16 | C15 | C20 | C19 | 0.3° | 0.3° |
| C16 | C15 | C20 | C13 | 179.9° | 179.7° |
| C16 | C15 | C13 | C12 | 78.3° | 179.8° |
| C16 | C15 | C13 | C14 | 100.7° | 0.5° |
| C15 | C16 | C17 | H2 | 179.2° | 179.8° |
| C16 | C15 | C20 | H3 | 179.7° | 179.8° |
| C19 | C20 | C15 | H3 | 180.0° | 179.9° |
| C19 | C20 | C15 | C13 | 179.6° | 180.0° |
| C20 | C19 | C18 | H11 | 179.8° | 179.7° |
| C20 | C15 | C13 | C12 | 101.6° | 0.0° |
| C20 | C15 | C13 | C14 | 79.4° | 179.7° |
| C20 | C15 | C16 | H10 | 179.2° | 180.0° |
| C15 | C20 | C19 | H12 | 179.8° | 179.5° |
| C15 | C13 | C12 | C14 | 179.0° | 179.7° |
| C15 | C13 | C12 | C11 | 178.9° | 180.0° |
| C15 | C13 | C14 | C09 | 179.2° | 180.0° |
| C13 | C15 | C20 | H3 | 0.4° | 0.1° |
| C15 | C13 | C12 | H8 | 1.2° | 0.3° |
| C15 | C13 | C14 | H9 | 0.8° | 0.3° |
| C13 | C15 | C16 | H10 | 0.9° | 0.2° |
| F01 | C02 | C03 | C07 | 179.2° | 179.8° |
| F01 | C02 | C03 | C04 | 179.9° | 179.7° |
| F01 | C02 | C07 | C06 | 179.5° | 179.7° |
| F01 | C02 | C03 | H4 | 0.1° | 0.2° |
| F01 | C02 | C07 | H6 | 0.5° | 0.3° |
| C13 | C12 | C11 | H8 | 180.0° | 179.8° |
| C12 | C13 | C14 | C09 | 0.2° | 0.3° |
| C13 | C12 | C11 | C10 | 0.6° | 0.0° |
| C13 | C12 | C11 | H7 | 179.4° | 180.0° |
| C12 | C13 | C14 | H9 | 179.8° | 180.0° |
| C14 | C13 | C12 | C11 | 0.2° | 0.3° |
| C13 | C14 | C09 | H9 | 180.0° | 179.7° |
| C13 | C14 | C09 | C10 | 0.1° | 0.0° |
| C13 | C14 | C09 | N08 | 179.7° | 180.0° |
| C14 | C13 | C12 | H8 | 179.8° | 179.9° |
| C02 | C03 | C04 | H4 | 180.0° | 180.0° |
| C03 | C02 | C07 | C06 | 0.4° | 0.0° |
| C02 | C03 | C04 | C05 | 0.8° | 0.1° |
| C02 | C03 | C04 | H5 | 179.3° | 180.0° |
| C03 | C02 | C07 | H6 | 179.6° | 180.0° |
| C07 | C02 | C03 | C04 | 0.9° | 0.0° |
| C02 | C07 | C06 | H6 | 180.0° | 180.0° |
| C02 | C07 | C06 | C05 | 0.3° | 0.0° |
| C02 | C07 | C06 | N08 | 179.3° | 180.0° |
| C07 | C02 | C03 | H4 | 179.1° | 180.0° |
| C12 | C11 | C10 | H7 | 180.0° | 180.0° |
| C12 | C11 | C10 | C09 | 0.6° | 0.3° |
| C12 | C11 | C10 | H1 | 179.4° | 180.0° |
| C03 | C04 | C05 | H5 | 180.0° | 179.9° |
| C03 | C04 | C05 | C06 | 0.1° | 0.1° |
| C03 | C04 | C05 | C21 | 179.3° | 180.0° |
| C14 | C09 | C10 | C11 | 0.3° | 0.2° |
| C14 | C09 | C10 | N08 | 179.6° | 180.0° |
| C14 | C09 | N08 | C06 | 100.2° | 177.9° |
| C14 | C09 | C10 | H1 | 179.7° | 180.0° |
| C14 | C09 | N08 | H13 | 79.8° | 2.1° |
| C07 | C06 | C05 | C04 | 0.4° | 0.0° |
| C07 | C06 | N08 | C09 | 23.4° | 98.7° |
| C07 | C06 | C05 | N08 | 178.9° | 180.0° |
| C07 | C06 | C05 | C21 | 179.8° | 180.0° |
| C07 | C06 | N08 | H13 | 156.5° | 81.2° |
| C11 | C10 | C09 | H1 | 180.0° | 179.7° |
| C11 | C10 | C09 | N08 | 179.3° | 179.8° |
| C10 | C11 | C12 | H8 | 179.4° | 179.8° |
| C04 | C05 | C06 | C21 | 179.4° | 179.9° |
| C04 | C05 | C06 | N08 | 179.3° | 180.0° |
| C04 | C05 | C21 | O22 | 144.7° | 174.5° |
| C04 | C05 | C21 | O23 | 35.7° | 5.4° |
| C05 | C04 | C03 | H4 | 179.3° | 180.0° |
| C10 | C09 | N08 | C06 | 79.4° | 2.1° |
| C09 | C10 | C11 | H7 | 179.3° | 179.7° |
| C10 | C09 | C14 | H9 | 179.8° | 179.7° |
| C10 | C09 | N08 | H13 | 100.6° | 177.9° |
| C09 | N08 | C06 | C05 | 155.5° | 81.3° |
| C09 | N08 | C06 | H13 | 180.0° | 179.9° |
| N08 | C09 | C10 | H1 | 0.7° | 0.0° |
| N08 | C09 | C14 | H9 | 0.3° | 0.3° |
| C06 | C05 | C21 | O22 | 35.8° | 5.6° |
| C06 | C05 | C21 | O23 | 143.7° | 174.5° |
| C06 | C05 | C04 | H5 | 179.9° | 180.0° |
| C05 | C06 | C07 | H6 | 179.7° | 179.9° |
| C05 | C06 | N08 | H13 | 24.5° | 98.8° |
| N08 | C06 | C05 | C21 | 1.3° | 0.0° |
| N08 | C06 | C07 | H6 | 0.7° | 0.0° |
| C05 | C21 | O22 | O23 | 179.5° | 180.0° |
| C21 | C05 | C04 | H5 | 0.7° | 0.1° |
| C05 | C21 | O23 | H14 | 179.5° | 180.0° |
| O22 | C21 | O23 | H14 | 0.0° | 0.0° |
| H1 | C10 | C11 | H7 | 0.7° | 0.0° |
| H2 | C17 | C16 | H10 | 0.8° | 0.3° |
| H2 | C17 | C18 | H11 | 0.3° | 0.8° |
| H3 | C20 | C19 | H12 | 0.2° | 0.4° |
| H4 | C03 | C04 | H5 | 0.7° | 0.1° |
| H7 | C11 | C12 | H8 | 0.6° | 0.2° |
| H11 | C18 | C19 | H12 | 0.2° | 0.8° |
