2W9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O25 | N24 | sing | 1.22Å | 1.22Å | |
| O26 | N24 | doub | 1.22Å | 1.22Å | |
| N24 | C23 | sing | 1.48Å | 1.33Å | |
| C23 | C27 | doub | 1.35Å | 1.35Å | Aromatic |
| C23 | O22 | sing | 1.34Å | 1.34Å | Aromatic |
| C27 | C29 | sing | 1.41Å | 1.47Å | Aromatic |
| O22 | C21 | sing | 1.35Å | 1.33Å | Aromatic |
| C29 | C21 | doub | 1.36Å | 1.34Å | Aromatic |
| C21 | C1 | sing | 1.48Å | 1.51Å | |
| C1 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C1 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.51Å | 1.54Å | |
| C4 | C7 | sing | 1.53Å | 1.55Å | |
| O11 | C8 | doub | 1.21Å | 1.23Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C8 | O9 | sing | 1.34Å | 1.34Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| O9 | H6 | sing | 0.97Å | 0.95Å | |
| C14 | H7 | sing | 1.08Å | 1.08Å | |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C16 | H9 | sing | 1.08Å | 1.08Å | |
| C27 | H10 | sing | 1.08Å | 1.08Å | |
| C29 | H11 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O25 | N24 | O26 | 125.5° | 119.9° |
| O25 | N24 | C23 | 118.2° | 120.0° |
| O26 | N24 | C23 | 116.2° | 120.0° |
| N24 | C23 | C27 | 127.3° | 125.7° |
| N24 | C23 | O22 | 118.8° | 125.7° |
| C27 | C23 | O22 | 113.8° | 108.7° |
| C23 | C27 | C29 | 104.3° | 107.1° |
| C23 | C27 | H10 | 127.8° | 126.5° |
| C23 | O22 | C21 | 103.9° | 109.4° |
| C27 | C29 | C21 | 102.8° | 106.7° |
| C29 | C27 | H10 | 127.9° | 126.5° |
| C27 | C29 | H11 | 128.6° | 126.6° |
| O22 | C21 | C29 | 115.2° | 108.1° |
| O22 | C21 | C1 | 115.1° | 125.9° |
| C29 | C21 | C1 | 129.7° | 126.0° |
| C21 | C29 | H11 | 128.6° | 126.6° |
| C21 | C1 | C16 | 119.6° | 120.1° |
| C21 | C1 | C2 | 121.3° | 120.2° |
| C16 | C1 | C2 | 119.0° | 119.7° |
| C1 | C16 | C15 | 121.1° | 119.9° |
| C1 | C16 | H9 | 119.4° | 120.1° |
| C1 | C2 | C3 | 120.3° | 119.9° |
| C1 | C2 | H1 | 119.8° | 120.0° |
| C16 | C15 | C14 | 119.4° | 120.1° |
| C16 | C15 | H8 | 120.3° | 120.0° |
| C15 | C16 | H9 | 119.4° | 120.0° |
| C2 | C3 | C14 | 119.7° | 120.2° |
| C2 | C3 | C4 | 120.7° | 119.9° |
| C3 | C2 | H1 | 119.8° | 120.1° |
| C15 | C14 | C3 | 120.3° | 120.3° |
| C15 | C14 | H7 | 119.8° | 119.8° |
| C14 | C15 | H8 | 120.3° | 119.9° |
| C14 | C3 | C4 | 119.6° | 119.9° |
| C3 | C14 | H7 | 119.8° | 119.9° |
| C3 | C4 | C7 | 111.3° | 109.5° |
| C3 | C4 | H2 | 109.0° | 109.5° |
| C3 | C4 | H3 | 109.0° | 109.4° |
| C4 | C7 | C8 | 111.7° | 109.5° |
| C7 | C4 | H2 | 109.0° | 109.5° |
| C7 | C4 | H3 | 109.0° | 109.4° |
| C4 | C7 | H4 | 108.9° | 109.5° |
| C4 | C7 | H5 | 108.9° | 109.4° |
| O11 | C8 | C7 | 121.1° | 120.0° |
| O11 | C8 | O9 | 123.5° | 120.0° |
| C7 | C8 | O9 | 115.4° | 120.0° |
| C8 | C7 | H4 | 108.9° | 109.5° |
| C8 | C7 | H5 | 108.9° | 109.5° |
| C8 | O9 | H6 | 109.5° | 117.0° |
| H2 | C4 | H3 | 109.5° | 109.4° |
| H4 | C7 | H5 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O25 | N24 | O26 | C23 | 177.4° | 180.0° |
| O25 | N24 | C23 | C27 | 9.8° | 0.0° |
| O25 | N24 | C23 | O22 | 168.6° | 179.7° |
| O26 | N24 | C23 | C27 | 172.5° | 180.0° |
| O26 | N24 | C23 | O22 | 9.0° | 0.3° |
| N24 | C23 | C27 | O22 | 178.6° | 179.7° |
| N24 | C23 | C27 | C29 | 178.9° | 180.0° |
| N24 | C23 | O22 | C21 | 179.3° | 179.7° |
| N24 | C23 | C27 | H10 | 1.1° | 0.1° |
| C23 | C27 | C29 | H10 | 180.0° | 179.9° |
| C27 | C23 | O22 | C21 | 0.6° | 0.0° |
| C23 | C27 | C29 | C21 | 0.0° | 0.4° |
| C23 | C27 | C29 | H11 | 180.0° | 180.0° |
| O22 | C23 | C27 | C29 | 0.4° | 0.2° |
| C23 | O22 | C21 | C29 | 0.6° | 0.2° |
| C23 | O22 | C21 | C1 | 178.3° | 179.9° |
| O22 | C23 | C27 | H10 | 179.6° | 179.9° |
| C27 | C29 | C21 | O22 | 0.3° | 0.4° |
| C27 | C29 | C21 | H11 | 180.0° | 179.6° |
| C27 | C29 | C21 | C1 | 177.7° | 179.9° |
| O22 | C21 | C29 | C1 | 177.4° | 179.7° |
| O22 | C21 | C1 | C16 | 2.1° | 180.0° |
| O22 | C21 | C1 | C2 | 174.4° | 0.3° |
| O22 | C21 | C29 | H11 | 179.6° | 180.0° |
| C29 | C21 | C1 | C16 | 179.5° | 0.3° |
| C29 | C21 | C1 | C2 | 3.0° | 180.0° |
| C21 | C29 | C27 | H10 | 180.0° | 179.7° |
| C21 | C1 | C16 | C2 | 176.6° | 179.7° |
| C21 | C1 | C16 | C15 | 178.4° | 179.7° |
| C21 | C1 | C2 | C3 | 178.1° | 179.7° |
| C21 | C1 | C2 | H1 | 1.9° | 0.3° |
| C21 | C1 | C16 | H9 | 1.6° | 0.3° |
| C1 | C21 | C29 | H11 | 2.3° | 0.3° |
| C1 | C16 | C15 | H9 | 180.0° | 179.9° |
| C16 | C1 | C2 | C3 | 1.6° | 0.0° |
| C1 | C16 | C15 | C14 | 1.1° | 0.1° |
| C16 | C1 | C2 | H1 | 178.4° | 180.0° |
| C1 | C16 | C15 | H8 | 178.9° | 180.0° |
| C2 | C1 | C16 | C15 | 1.9° | 0.1° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | C14 | 0.5° | 0.0° |
| C1 | C2 | C3 | C4 | 179.3° | 179.9° |
| C2 | C1 | C16 | H9 | 178.2° | 180.0° |
| C16 | C15 | C14 | H8 | 180.0° | 179.9° |
| C16 | C15 | C14 | C3 | 0.0° | 0.0° |
| C16 | C15 | C14 | H7 | 180.0° | 180.0° |
| C2 | C3 | C14 | C15 | 0.3° | 0.0° |
| C2 | C3 | C14 | C4 | 179.9° | 179.9° |
| C2 | C3 | C4 | C7 | 107.9° | 89.9° |
| C2 | C3 | C4 | H2 | 12.4° | 150.0° |
| C2 | C3 | C4 | H3 | 131.8° | 30.0° |
| C2 | C3 | C14 | H7 | 179.7° | 180.0° |
| C15 | C14 | C3 | H7 | 180.0° | 180.0° |
| C15 | C14 | C3 | C4 | 179.9° | 179.9° |
| C14 | C15 | C16 | H9 | 178.9° | 180.0° |
| C14 | C3 | C4 | C7 | 72.2° | 90.0° |
| C14 | C3 | C2 | H1 | 179.5° | 180.0° |
| C14 | C3 | C4 | H2 | 167.5° | 30.1° |
| C14 | C3 | C4 | H3 | 48.0° | 150.1° |
| C3 | C14 | C15 | H8 | 180.0° | 179.9° |
| C3 | C4 | C7 | H2 | 120.3° | 120.1° |
| C3 | C4 | C7 | H3 | 120.3° | 120.0° |
| C3 | C4 | C7 | C8 | 78.2° | 180.0° |
| C4 | C3 | C2 | H1 | 0.7° | 0.1° |
| C3 | C4 | H2 | H3 | 119.2° | 119.9° |
| C3 | C4 | C7 | H4 | 161.4° | 60.0° |
| C3 | C4 | C7 | H5 | 42.1° | 60.0° |
| C4 | C3 | C14 | H7 | 0.1° | 0.1° |
| C4 | C7 | C8 | O11 | 9.9° | 0.1° |
| C4 | C7 | C8 | H4 | 120.3° | 120.0° |
| C4 | C7 | C8 | H5 | 120.4° | 120.0° |
| C4 | C7 | C8 | O9 | 170.3° | 180.0° |
| C7 | C4 | H2 | H3 | 119.2° | 119.9° |
| C4 | C7 | H4 | H5 | 119.0° | 120.0° |
| O11 | C8 | C7 | O9 | 179.8° | 179.9° |
| O11 | C8 | C7 | H4 | 130.2° | 120.0° |
| O11 | C8 | C7 | H5 | 110.5° | 120.0° |
| O11 | C8 | O9 | H6 | 0.0° | 0.0° |
| C8 | C7 | C4 | H2 | 42.0° | 59.9° |
| C8 | C7 | C4 | H3 | 161.5° | 60.0° |
| C8 | C7 | H4 | H5 | 119.0° | 120.0° |
| C7 | C8 | O9 | H6 | 179.8° | 180.0° |
| O9 | C8 | C7 | H4 | 50.0° | 60.0° |
| O9 | C8 | C7 | H5 | 69.3° | 60.0° |
| H2 | C4 | C7 | H4 | 78.3° | 179.9° |
| H2 | C4 | C7 | H5 | 162.4° | 60.1° |
| H3 | C4 | C7 | H4 | 41.1° | 60.0° |
| H3 | C4 | C7 | H5 | 78.2° | 180.0° |
| H7 | C14 | C15 | H8 | 0.0° | 0.1° |
| H8 | C15 | C16 | H9 | 1.0° | 0.1° |
| H10 | C27 | C29 | H11 | 0.0° | 0.2° |
