H0Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O24 | C25 | sing | 1.36Å | 1.38Å | |
| C23 | O22 | sing | 1.44Å | 1.43Å | |
| C25 | C26 | sing | 1.39Å | 1.38Å | Aromatic |
| C25 | C21 | doub | 1.39Å | 1.37Å | Aromatic |
| C26 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| O22 | C21 | sing | 1.36Å | 1.38Å | |
| C21 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.37Å | 1.39Å | Aromatic |
| C20 | C28 | doub | 1.40Å | 1.39Å | Aromatic |
| C20 | C18 | sing | 1.47Å | 1.47Å | |
| C28 | C16 | sing | 1.51Å | 1.51Å | |
| O10 | C11 | sing | 1.44Å | 1.43Å | |
| O10 | C09 | sing | 1.37Å | 1.38Å | |
| C18 | O19 | doub | 1.22Å | 1.20Å | |
| C18 | O17 | sing | 1.34Å | 1.36Å | |
| C11 | O12 | sing | 1.44Å | 1.43Å | |
| C08 | C09 | sing | 1.38Å | 1.37Å | Aromatic |
| C08 | C07 | doub | 1.39Å | 1.40Å | Aromatic |
| C09 | C13 | doub | 1.39Å | 1.36Å | Aromatic |
| C16 | O17 | sing | 1.45Å | 1.46Å | |
| C16 | C15 | sing | 1.53Å | 1.55Å | |
| C15 | C07 | sing | 1.51Å | 1.52Å | |
| C15 | N02 | sing | 1.47Å | 1.47Å | |
| C07 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| O12 | C13 | sing | 1.37Å | 1.38Å | |
| C13 | C14 | sing | 1.38Å | 1.37Å | Aromatic |
| N02 | C01 | sing | 1.47Å | 1.46Å | |
| N02 | C04 | sing | 1.47Å | 1.46Å | |
| C06 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C06 | C05 | sing | 1.51Å | 1.51Å | |
| C04 | C05 | sing | 1.53Å | 1.51Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H5 | sing | 1.09Å | 1.10Å | |
| C04 | H6 | sing | 1.09Å | 1.10Å | |
| C05 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.08Å | 1.08Å | |
| C27 | H16 | sing | 1.08Å | 1.08Å | |
| O24 | C23 | sing | 1.44Å | 1.43Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H4 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O24 | C25 | C26 | 128.6° | 131.4° |
| O24 | C25 | C21 | 109.8° | 108.6° |
| C25 | O24 | C23 | 105.8° | 105.4° |
| C23 | O22 | C21 | 105.3° | 105.5° |
| O22 | C23 | H14 | 109.6° | 110.6° |
| O22 | C23 | O24 | 108.7° | 103.7° |
| O22 | C23 | H4 | 109.6° | 110.6° |
| C26 | C25 | C21 | 121.6° | 120.0° |
| C25 | C26 | C27 | 118.2° | 120.3° |
| C25 | C26 | H15 | 120.9° | 119.9° |
| C25 | C21 | O22 | 110.5° | 108.7° |
| C25 | C21 | C20 | 120.0° | 119.6° |
| C26 | C27 | C28 | 121.3° | 120.2° |
| C27 | C26 | H15 | 120.9° | 119.8° |
| C26 | C27 | H16 | 119.3° | 119.9° |
| O22 | C21 | C20 | 129.5° | 131.6° |
| C21 | C20 | C28 | 119.5° | 119.4° |
| C21 | C20 | C18 | 131.9° | 132.5° |
| C27 | C28 | C20 | 119.4° | 120.3° |
| C27 | C28 | C16 | 132.3° | 133.4° |
| C28 | C27 | H16 | 119.3° | 119.9° |
| C28 | C20 | C18 | 108.6° | 108.1° |
| C20 | C28 | C16 | 108.2° | 106.3° |
| C20 | C18 | O19 | 130.4° | 124.9° |
| C20 | C18 | O17 | 108.2° | 110.2° |
| C28 | C16 | O17 | 103.7° | 106.3° |
| C28 | C16 | C15 | 117.5° | 110.1° |
| C28 | C16 | H13 | 108.9° | 110.1° |
| C11 | O10 | C09 | 105.6° | 105.5° |
| O10 | C11 | O12 | 108.3° | 103.8° |
| O10 | C11 | H10 | 109.8° | 110.6° |
| O10 | C11 | H18 | 109.8° | 110.6° |
| O10 | C09 | C08 | 128.4° | 131.7° |
| O10 | C09 | C13 | 110.3° | 108.7° |
| O19 | C18 | O17 | 121.3° | 124.8° |
| C18 | O17 | C16 | 111.2° | 109.0° |
| C11 | O12 | C13 | 105.6° | 105.4° |
| O12 | C11 | H10 | 109.8° | 110.5° |
| O12 | C11 | H18 | 109.7° | 110.5° |
| C09 | C08 | C07 | 118.8° | 120.4° |
| C08 | C09 | C13 | 121.3° | 119.7° |
| C09 | C08 | H9 | 120.6° | 119.8° |
| C08 | C07 | C15 | 119.1° | 118.3° |
| C08 | C07 | C06 | 119.7° | 119.9° |
| C07 | C08 | H9 | 120.6° | 119.8° |
| C09 | C13 | O12 | 110.2° | 108.7° |
| C09 | C13 | C14 | 121.3° | 119.6° |
| O17 | C16 | C15 | 108.6° | 110.1° |
| O17 | C16 | H13 | 109.5° | 110.1° |
| C16 | C15 | C07 | 110.4° | 109.3° |
| C16 | C15 | N02 | 109.4° | 109.3° |
| C16 | C15 | H12 | 107.2° | 109.2° |
| C15 | C16 | H13 | 108.4° | 110.0° |
| C07 | C15 | N02 | 114.0° | 110.5° |
| C15 | C07 | C06 | 121.1° | 121.8° |
| C07 | C15 | H12 | 107.5° | 109.3° |
| C15 | N02 | C01 | 111.9° | 111.1° |
| C15 | N02 | C04 | 114.2° | 110.2° |
| N02 | C15 | H12 | 108.1° | 109.2° |
| C07 | C06 | C14 | 120.0° | 120.0° |
| C07 | C06 | C05 | 120.9° | 121.7° |
| O12 | C13 | C14 | 128.5° | 131.7° |
| C13 | C14 | C06 | 118.8° | 120.4° |
| C13 | C14 | H11 | 120.6° | 119.8° |
| C01 | N02 | C04 | 110.9° | 111.0° |
| N02 | C01 | H1 | 109.5° | 109.5° |
| N02 | C01 | H2 | 109.4° | 109.5° |
| N02 | C01 | H3 | 109.5° | 109.5° |
| N02 | C04 | C05 | 111.7° | 108.5° |
| N02 | C04 | H5 | 108.9° | 109.6° |
| N02 | C04 | H6 | 108.9° | 109.6° |
| C14 | C06 | C05 | 119.1° | 118.3° |
| C06 | C14 | H11 | 120.6° | 119.8° |
| C06 | C05 | C04 | 111.1° | 109.9° |
| C06 | C05 | H7 | 109.1° | 109.4° |
| C06 | C05 | H8 | 109.1° | 109.3° |
| C05 | C04 | H5 | 109.0° | 109.6° |
| C05 | C04 | H6 | 108.9° | 109.6° |
| C04 | C05 | H7 | 109.1° | 109.4° |
| C04 | C05 | H8 | 109.1° | 109.4° |
| H1 | C01 | H2 | 109.5° | 109.4° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H5 | C04 | H6 | 109.5° | 109.8° |
| H7 | C05 | H8 | 109.5° | 109.4° |
| H10 | C11 | H18 | 109.5° | 110.6° |
| H14 | C23 | O24 | 109.7° | 110.6° |
| H14 | C23 | H4 | 109.5° | 110.5° |
| O24 | C23 | H4 | 109.7° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | O24 | C23 | O22 | 0.0° | 27.2° |
| O24 | C25 | C26 | C21 | 178.9° | 180.0° |
| O24 | C25 | C26 | C27 | 178.2° | 180.0° |
| O24 | C25 | C21 | O22 | 0.1° | 0.0° |
| O24 | C25 | C21 | C20 | 179.0° | 179.9° |
| C25 | O24 | C23 | H14 | 119.8° | 91.4° |
| O24 | C25 | C26 | H15 | 1.8° | 0.1° |
| C25 | O24 | C23 | H4 | 119.9° | 145.8° |
| C23 | O22 | C21 | C25 | 0.1° | 17.3° |
| C23 | O22 | C21 | C20 | 178.9° | 162.8° |
| O22 | C23 | H14 | O24 | 119.3° | 114.3° |
| O22 | C23 | H14 | H4 | 120.3° | 122.8° |
| O22 | C23 | O24 | H4 | 119.8° | 118.6° |
| C25 | C26 | C27 | H15 | 180.0° | 179.9° |
| C26 | C25 | C21 | O22 | 178.9° | 180.0° |
| C26 | C25 | C21 | C20 | 0.1° | 0.1° |
| C25 | C26 | C27 | C28 | 0.3° | 0.2° |
| C25 | C26 | C27 | H16 | 179.7° | 180.0° |
| C26 | C25 | O24 | C23 | 178.9° | 162.7° |
| C21 | C25 | C26 | C27 | 0.7° | 0.0° |
| C25 | C21 | O22 | C20 | 178.7° | 179.9° |
| C25 | C21 | C20 | C28 | 1.0° | 0.0° |
| C25 | C21 | C20 | C18 | 178.6° | 179.9° |
| C21 | C25 | C26 | H15 | 179.3° | 180.0° |
| C21 | C25 | O24 | C23 | 0.1° | 17.3° |
| C26 | C27 | C28 | H16 | 180.0° | 179.8° |
| C26 | C27 | C28 | C20 | 0.7° | 0.2° |
| C26 | C27 | C28 | C16 | 177.5° | 179.9° |
| O22 | C21 | C20 | C28 | 177.6° | 179.9° |
| O22 | C21 | C20 | C18 | 2.8° | 0.0° |
| C21 | O22 | C23 | H14 | 119.8° | 91.4° |
| C21 | O22 | C23 | O24 | 0.1° | 27.2° |
| C21 | O22 | C23 | H4 | 120.0° | 145.9° |
| C21 | C20 | C28 | C27 | 1.4° | 0.1° |
| C21 | C20 | C28 | C18 | 179.6° | 180.0° |
| C21 | C20 | C28 | C16 | 177.3° | 180.0° |
| C21 | C20 | C18 | O19 | 1.0° | 0.0° |
| C21 | C20 | C18 | O17 | 178.9° | 180.0° |
| C27 | C28 | C20 | C16 | 178.6° | 179.9° |
| C27 | C28 | C20 | C18 | 178.3° | 179.9° |
| C27 | C28 | C16 | O17 | 178.2° | 179.9° |
| C27 | C28 | C16 | C15 | 58.4° | 60.7° |
| C27 | C28 | C16 | H13 | 65.3° | 60.8° |
| C28 | C27 | C26 | H15 | 179.7° | 179.9° |
| C28 | C20 | C18 | O19 | 178.5° | 180.0° |
| C28 | C20 | C18 | O17 | 1.5° | 0.1° |
| C20 | C28 | C16 | O17 | 3.5° | 0.0° |
| C20 | C28 | C16 | C15 | 123.2° | 119.2° |
| C20 | C28 | C16 | H13 | 113.0° | 119.3° |
| C20 | C28 | C27 | H16 | 179.3° | 180.0° |
| C18 | C20 | C28 | C16 | 3.1° | 0.0° |
| C20 | C18 | O19 | O17 | 180.0° | 179.9° |
| C20 | C18 | O17 | C16 | 0.8° | 0.1° |
| C28 | C16 | O17 | C18 | 2.6° | 0.0° |
| C28 | C16 | O17 | C15 | 125.7° | 119.2° |
| C28 | C16 | O17 | H13 | 116.1° | 119.3° |
| C28 | C16 | C15 | H13 | 124.0° | 121.6° |
| C28 | C16 | C15 | C07 | 84.4° | 70.0° |
| C28 | C16 | C15 | N02 | 149.4° | 51.1° |
| C28 | C16 | C15 | H12 | 32.4° | 170.5° |
| C16 | C28 | C27 | H16 | 2.5° | 0.1° |
| O10 | C11 | O12 | H10 | 119.8° | 118.6° |
| O10 | C11 | O12 | H18 | 119.8° | 118.6° |
| C11 | O10 | C09 | C08 | 179.9° | 162.6° |
| C11 | O10 | C09 | C13 | 1.5° | 17.3° |
| O10 | C11 | O12 | C13 | 1.0° | 27.1° |
| O10 | C11 | H10 | H18 | 120.5° | 122.9° |
| C09 | O10 | C11 | O12 | 1.5° | 27.1° |
| O10 | C09 | C08 | C13 | 178.5° | 179.9° |
| O10 | C09 | C08 | C07 | 177.7° | 179.9° |
| O10 | C09 | C13 | O12 | 0.9° | 0.0° |
| O10 | C09 | C13 | C14 | 179.2° | 180.0° |
| O10 | C09 | C08 | H9 | 2.3° | 0.2° |
| C09 | O10 | C11 | H10 | 121.3° | 145.7° |
| C09 | O10 | C11 | H18 | 118.3° | 91.5° |
| O19 | C18 | O17 | C16 | 179.2° | 180.0° |
| C18 | O17 | C16 | C15 | 128.3° | 119.3° |
| C18 | O17 | C16 | H13 | 113.5° | 119.3° |
| C11 | O12 | C13 | C09 | 0.0° | 17.3° |
| C11 | O12 | C13 | C14 | 179.9° | 162.8° |
| O12 | C11 | H10 | H18 | 120.5° | 122.8° |
| C09 | C08 | C07 | H9 | 180.0° | 179.9° |
| C09 | C08 | C07 | C15 | 176.2° | 179.6° |
| C09 | C08 | C07 | C06 | 1.9° | 0.2° |
| C08 | C09 | C13 | O12 | 179.7° | 179.9° |
| C08 | C09 | C13 | C14 | 0.4° | 0.1° |
| C07 | C08 | C09 | C13 | 0.8° | 0.0° |
| C08 | C07 | C15 | C16 | 65.8° | 42.4° |
| C08 | C07 | C15 | C06 | 178.1° | 179.7° |
| C08 | C07 | C15 | N02 | 170.6° | 162.7° |
| C08 | C07 | C06 | C14 | 1.8° | 0.2° |
| C08 | C07 | C06 | C05 | 176.1° | 179.6° |
| C08 | C07 | C15 | H12 | 50.8° | 77.1° |
| C09 | C13 | O12 | C14 | 179.9° | 180.0° |
| C09 | C13 | C14 | C06 | 0.5° | 0.1° |
| C13 | C09 | C08 | H9 | 179.2° | 179.9° |
| C09 | C13 | C14 | H11 | 179.5° | 180.0° |
| O17 | C16 | C15 | H13 | 118.8° | 121.5° |
| O17 | C16 | C15 | C07 | 32.8° | 173.1° |
| O17 | C16 | C15 | N02 | 93.4° | 65.8° |
| O17 | C16 | C15 | H12 | 149.6° | 53.6° |
| C16 | C15 | C07 | N02 | 123.6° | 120.3° |
| C16 | C15 | C07 | H12 | 116.7° | 119.5° |
| C16 | C15 | N02 | H12 | 116.4° | 119.4° |
| C16 | C15 | C07 | C06 | 112.2° | 137.9° |
| C16 | C15 | N02 | C01 | 147.1° | 63.8° |
| C16 | C15 | N02 | C04 | 85.8° | 172.8° |
| C07 | C15 | N02 | H12 | 119.4° | 120.3° |
| C07 | C15 | N02 | C01 | 88.8° | 175.9° |
| C07 | C15 | N02 | C04 | 38.3° | 52.5° |
| C15 | C07 | C06 | C14 | 176.2° | 179.5° |
| C15 | C07 | C06 | C05 | 5.9° | 0.6° |
| C15 | C07 | C08 | H9 | 3.8° | 0.5° |
| C07 | C15 | C16 | H13 | 151.6° | 51.6° |
| N02 | C15 | C07 | C06 | 11.3° | 17.6° |
| C15 | N02 | C01 | C04 | 128.8° | 123.0° |
| C15 | N02 | C04 | C05 | 60.0° | 71.2° |
| C15 | N02 | C01 | H1 | 180.0° | 41.2° |
| C15 | N02 | C01 | H2 | 60.0° | 78.8° |
| C15 | N02 | C01 | H3 | 60.0° | 161.3° |
| C15 | N02 | C04 | H5 | 179.7° | 48.5° |
| C15 | N02 | C04 | H6 | 60.3° | 169.1° |
| N02 | C15 | C16 | H13 | 25.4° | 172.7° |
| C07 | C06 | C14 | C13 | 0.6° | 0.1° |
| C07 | C06 | C14 | C05 | 177.9° | 179.9° |
| C07 | C06 | C05 | C04 | 25.4° | 17.1° |
| C07 | C06 | C05 | H7 | 145.7° | 137.2° |
| C07 | C06 | C05 | H8 | 94.8° | 103.0° |
| C06 | C07 | C08 | H9 | 178.1° | 179.7° |
| C07 | C06 | C14 | H11 | 179.4° | 179.9° |
| C06 | C07 | C15 | H12 | 131.1° | 102.6° |
| O12 | C13 | C14 | C06 | 179.6° | 180.0° |
| C13 | O12 | C11 | H10 | 120.8° | 145.7° |
| O12 | C13 | C14 | H11 | 0.4° | 0.0° |
| C13 | O12 | C11 | H18 | 118.9° | 91.5° |
| C13 | C14 | C06 | H11 | 180.0° | 180.0° |
| C13 | C14 | C06 | C05 | 177.3° | 179.8° |
| C01 | N02 | C04 | C05 | 67.6° | 165.3° |
| N02 | C01 | H1 | H2 | 120.0° | 120.0° |
| N02 | C01 | H1 | H3 | 120.0° | 120.1° |
| N02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | N02 | C04 | H5 | 52.7° | 75.0° |
| C01 | N02 | C04 | H6 | 172.1° | 45.6° |
| C01 | N02 | C15 | H12 | 30.6° | 55.6° |
| N02 | C04 | C05 | C06 | 51.4° | 50.5° |
| N02 | C04 | C05 | H5 | 120.3° | 119.7° |
| N02 | C04 | C05 | H6 | 120.3° | 119.7° |
| C04 | N02 | C01 | H1 | 51.2° | 81.9° |
| C04 | N02 | C01 | H2 | 68.9° | 158.2° |
| C04 | N02 | C01 | H3 | 171.2° | 38.2° |
| N02 | C04 | H5 | H6 | 119.0° | 120.5° |
| N02 | C04 | C05 | H7 | 171.7° | 170.6° |
| N02 | C04 | C05 | H8 | 68.8° | 69.5° |
| C04 | N02 | C15 | H12 | 157.7° | 67.8° |
| C14 | C06 | C05 | C04 | 156.7° | 163.0° |
| C14 | C06 | C05 | H7 | 36.4° | 42.9° |
| C14 | C06 | C05 | H8 | 83.1° | 76.9° |
| C06 | C05 | C04 | H7 | 120.2° | 120.1° |
| C06 | C05 | C04 | H8 | 120.2° | 120.0° |
| C06 | C05 | C04 | H5 | 171.7° | 69.2° |
| C06 | C05 | C04 | H6 | 68.9° | 170.2° |
| C06 | C05 | H7 | H8 | 119.3° | 119.7° |
| C05 | C06 | C14 | H11 | 2.7° | 0.3° |
| C05 | C04 | H5 | H6 | 119.0° | 120.5° |
| C04 | C05 | H7 | H8 | 119.3° | 119.8° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H5 | C04 | C05 | H7 | 68.0° | 51.0° |
| H5 | C04 | C05 | H8 | 51.5° | 170.8° |
| H6 | C04 | C05 | H7 | 51.3° | 69.7° |
| H6 | C04 | C05 | H8 | 170.9° | 50.2° |
| H12 | C15 | C16 | H13 | 91.6° | 68.0° |
| H14 | C23 | O24 | H4 | 120.3° | 122.8° |
| H15 | C26 | C27 | H16 | 0.3° | 0.1° |
