SW0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C08 | C07 | doub | 1.38Å | 1.37Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| C07 | C05 | sing | 1.38Å | 1.38Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C05 | F06 | sing | 1.35Å | 1.35Å | |
| C05 | C04 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C04 | sing | 1.39Å | 1.37Å | Aromatic |
| C04 | N03 | sing | 1.40Å | 1.44Å | |
| N03 | C02 | sing | 1.35Å | 1.42Å | |
| O01 | C02 | doub | 1.21Å | 1.19Å | |
| C02 | C11 | sing | 1.48Å | 1.51Å | |
| C11 | C16 | sing | 1.42Å | 1.41Å | Aromatic |
| C11 | N12 | doub | 1.31Å | 1.31Å | Aromatic |
| C16 | C14 | doub | 1.35Å | 1.37Å | Aromatic |
| N12 | O13 | sing | 1.21Å | 1.37Å | Aromatic |
| C14 | O13 | sing | 1.34Å | 1.31Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H153 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C07 | C08 | C09 | 120.9° | 120.2° |
| C08 | C07 | C05 | 119.5° | 120.0° |
| C08 | C07 | H071 | 120.3° | 120.0° |
| C07 | C08 | H081 | 119.6° | 119.9° |
| C08 | C09 | C10 | 120.1° | 120.1° |
| C09 | C08 | H081 | 119.6° | 119.9° |
| C08 | C09 | H091 | 119.9° | 120.0° |
| C07 | C05 | F06 | 118.7° | 120.1° |
| C07 | C05 | C04 | 119.8° | 119.9° |
| C05 | C07 | H071 | 120.3° | 120.0° |
| C09 | C10 | C04 | 119.0° | 120.0° |
| C09 | C10 | H101 | 120.5° | 120.0° |
| C10 | C09 | H091 | 119.9° | 119.9° |
| F06 | C05 | C04 | 121.6° | 120.0° |
| C05 | C04 | C10 | 120.8° | 119.8° |
| C05 | C04 | N03 | 119.5° | 120.1° |
| C10 | C04 | N03 | 119.6° | 120.1° |
| C04 | C10 | H101 | 120.5° | 120.0° |
| C04 | N03 | C02 | 120.1° | 120.0° |
| C04 | N03 | H031 | 120.0° | 120.0° |
| N03 | C02 | O01 | 121.4° | 120.0° |
| N03 | C02 | C11 | 116.2° | 120.0° |
| C02 | N03 | H031 | 119.9° | 120.1° |
| O01 | C02 | C11 | 122.4° | 120.0° |
| C02 | C11 | C16 | 126.9° | 126.9° |
| C02 | C11 | N12 | 124.5° | 127.0° |
| C16 | C11 | N12 | 108.5° | 106.1° |
| C11 | C16 | C14 | 107.7° | 103.9° |
| C11 | C16 | H161 | 126.1° | 128.0° |
| C11 | N12 | O13 | 105.3° | 111.4° |
| C16 | C14 | O13 | 104.5° | 106.6° |
| C16 | C14 | C15 | 129.2° | 126.7° |
| C14 | C16 | H161 | 126.1° | 128.0° |
| N12 | O13 | C14 | 113.8° | 111.9° |
| O13 | C14 | C15 | 126.3° | 126.7° |
| C14 | C15 | H151 | 109.5° | 109.5° |
| C14 | C15 | H153 | 109.5° | 109.5° |
| C14 | C15 | H152 | 109.5° | 109.5° |
| H151 | C15 | H153 | 109.5° | 109.4° |
| H151 | C15 | H152 | 109.5° | 109.5° |
| H153 | C15 | H152 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C07 | C08 | C09 | H081 | 180.0° | 179.8° |
| C08 | C07 | C05 | H071 | 180.0° | 179.9° |
| C07 | C08 | C09 | C10 | 0.4° | 0.5° |
| C08 | C07 | C05 | F06 | 179.9° | 180.0° |
| C08 | C07 | C05 | C04 | 0.6° | 0.0° |
| C07 | C08 | C09 | H091 | 179.6° | 180.0° |
| C09 | C08 | C07 | C05 | 0.4° | 0.3° |
| C08 | C09 | C10 | H091 | 180.0° | 179.5° |
| C08 | C09 | C10 | C04 | 0.6° | 0.5° |
| C08 | C09 | C10 | H101 | 179.5° | 179.8° |
| C09 | C08 | C07 | H071 | 179.6° | 179.8° |
| C07 | C05 | F06 | C04 | 179.4° | 180.0° |
| C07 | C05 | C04 | C10 | 1.6° | 0.0° |
| C07 | C05 | C04 | N03 | 177.9° | 180.0° |
| C05 | C07 | C08 | H081 | 179.6° | 180.0° |
| C09 | C10 | C04 | C05 | 1.6° | 0.3° |
| C09 | C10 | C04 | H101 | 180.0° | 179.6° |
| C09 | C10 | C04 | N03 | 177.9° | 179.7° |
| C10 | C09 | C08 | H081 | 179.6° | 179.7° |
| F06 | C05 | C04 | C10 | 179.0° | 180.0° |
| F06 | C05 | C04 | N03 | 2.6° | 0.0° |
| F06 | C05 | C07 | H071 | 0.1° | 0.1° |
| C05 | C04 | C10 | N03 | 176.3° | 180.0° |
| C05 | C04 | N03 | C02 | 59.9° | 155.2° |
| C05 | C04 | C10 | H101 | 178.5° | 179.9° |
| C04 | C05 | C07 | H071 | 179.4° | 180.0° |
| C05 | C04 | N03 | H031 | 120.1° | 24.8° |
| C10 | C04 | N03 | C02 | 123.7° | 24.8° |
| C04 | C10 | C09 | H091 | 179.4° | 180.0° |
| C10 | C04 | N03 | H031 | 56.3° | 155.2° |
| C04 | N03 | C02 | H031 | 180.0° | 180.0° |
| C04 | N03 | C02 | O01 | 2.3° | 5.5° |
| C04 | N03 | C02 | C11 | 177.0° | 174.5° |
| N03 | C04 | C10 | H101 | 2.1° | 0.1° |
| N03 | C02 | O01 | C11 | 179.2° | 180.0° |
| N03 | C02 | C11 | C16 | 36.3° | 180.0° |
| N03 | C02 | C11 | N12 | 147.6° | 0.0° |
| O01 | C02 | C11 | C16 | 143.0° | 0.0° |
| O01 | C02 | C11 | N12 | 33.1° | 180.0° |
| O01 | C02 | N03 | H031 | 177.7° | 174.5° |
| C02 | C11 | C16 | N12 | 176.6° | 180.0° |
| C02 | C11 | C16 | C14 | 178.4° | 180.0° |
| C02 | C11 | N12 | O13 | 178.0° | 179.9° |
| C02 | C11 | C16 | H161 | 1.6° | 0.0° |
| C11 | C02 | N03 | H031 | 3.0° | 5.6° |
| C11 | C16 | C14 | H161 | 180.0° | 180.0° |
| C16 | C11 | N12 | O13 | 1.2° | 0.0° |
| C11 | C16 | C14 | O13 | 1.5° | 0.0° |
| C11 | C16 | C14 | C15 | 178.6° | 180.0° |
| N12 | C11 | C16 | C14 | 1.8° | 0.0° |
| C11 | N12 | O13 | C14 | 0.3° | 0.0° |
| N12 | C11 | C16 | H161 | 178.2° | 180.0° |
| C16 | C14 | O13 | N12 | 0.8° | 0.0° |
| C16 | C14 | O13 | C15 | 179.8° | 179.9° |
| C16 | C14 | C15 | H151 | 179.8° | 179.9° |
| C16 | C14 | C15 | H153 | 60.2° | 59.9° |
| C16 | C14 | C15 | H152 | 59.8° | 60.0° |
| N12 | O13 | C14 | C15 | 179.3° | 179.9° |
| O13 | C14 | C15 | H151 | 0.0° | 0.0° |
| O13 | C14 | C15 | H153 | 120.0° | 120.0° |
| O13 | C14 | C15 | H152 | 120.0° | 120.1° |
| O13 | C14 | C16 | H161 | 178.5° | 180.0° |
| C14 | C15 | H151 | H153 | 120.0° | 120.0° |
| C14 | C15 | H151 | H152 | 120.0° | 120.0° |
| C14 | C15 | H153 | H152 | 120.0° | 120.0° |
| C15 | C14 | C16 | H161 | 1.4° | 0.1° |
| H101 | C10 | C09 | H091 | 0.5° | 0.3° |
| H151 | C15 | H153 | H152 | 120.0° | 120.0° |
| H071 | C07 | C08 | H081 | 0.4° | 0.0° |
| H081 | C08 | C09 | H091 | 0.4° | 0.2° |
