0IM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C03 | doub | 1.38Å | 1.38Å | Aromatic |
| C02 | C01 | sing | 1.38Å | 1.39Å | Aromatic |
| C03 | C04 | sing | 1.38Å | 1.38Å | Aromatic |
| C01 | C06 | doub | 1.38Å | 1.38Å | Aromatic |
| F16 | C15 | sing | 1.40Å | 1.37Å | |
| C04 | C05 | doub | 1.39Å | 1.39Å | Aromatic |
| C06 | C05 | sing | 1.39Å | 1.39Å | Aromatic |
| F18 | C15 | sing | 1.40Å | 1.37Å | |
| C15 | F17 | sing | 1.40Å | 1.37Å | |
| C15 | C08 | sing | 1.51Å | 1.54Å | |
| C05 | N07 | sing | 1.40Å | 1.45Å | |
| N07 | C08 | sing | 1.34Å | 1.32Å | Aromatic |
| N07 | N11 | sing | 1.40Å | 1.33Å | Aromatic |
| C08 | C09 | doub | 1.38Å | 1.42Å | Aromatic |
| O14 | C12 | doub | 1.22Å | 1.27Å | |
| N11 | C10 | doub | 1.30Å | 1.31Å | Aromatic |
| C09 | C12 | sing | 1.47Å | 1.53Å | |
| C09 | C10 | sing | 1.41Å | 1.41Å | Aromatic |
| C12 | O13 | sing | 1.35Å | 1.26Å | |
| C03 | H1 | sing | 1.08Å | 1.08Å | |
| C04 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C01 | H4 | sing | 1.08Å | 1.08Å | |
| C02 | H5 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| O13 | H7 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C03 | C02 | C01 | 121.0° | 120.1° |
| C02 | C03 | C04 | 119.1° | 120.0° |
| C02 | C03 | H1 | 120.4° | 120.0° |
| C03 | C02 | H5 | 119.5° | 119.9° |
| C02 | C01 | C06 | 119.8° | 120.1° |
| C02 | C01 | H4 | 120.1° | 119.9° |
| C01 | C02 | H5 | 119.5° | 120.0° |
| C03 | C04 | C05 | 120.3° | 120.0° |
| C04 | C03 | H1 | 120.5° | 120.0° |
| C03 | C04 | H2 | 119.9° | 120.0° |
| C01 | C06 | C05 | 119.5° | 119.9° |
| C06 | C01 | H4 | 120.1° | 120.0° |
| C01 | C06 | H6 | 120.3° | 120.0° |
| F16 | C15 | F18 | 108.7° | 109.5° |
| F16 | C15 | F17 | 108.3° | 109.5° |
| F16 | C15 | C08 | 110.9° | 109.5° |
| C04 | C05 | C06 | 120.3° | 119.9° |
| C04 | C05 | N07 | 118.7° | 120.1° |
| C05 | C04 | H2 | 119.9° | 120.0° |
| C06 | C05 | N07 | 121.0° | 120.1° |
| C05 | C06 | H6 | 120.2° | 120.0° |
| F18 | C15 | F17 | 109.0° | 109.5° |
| F18 | C15 | C08 | 110.3° | 109.4° |
| F17 | C15 | C08 | 109.5° | 109.5° |
| C15 | C08 | N07 | 126.6° | 126.3° |
| C15 | C08 | C09 | 126.9° | 126.3° |
| C05 | N07 | C08 | 125.7° | 125.8° |
| C05 | N07 | N11 | 123.8° | 125.7° |
| C08 | N07 | N11 | 110.5° | 108.5° |
| N07 | C08 | C09 | 106.5° | 107.3° |
| N07 | N11 | C10 | 110.6° | 108.9° |
| C08 | C09 | C12 | 128.3° | 126.4° |
| C08 | C09 | C10 | 105.2° | 107.2° |
| O14 | C12 | C09 | 121.2° | 120.0° |
| O14 | C12 | O13 | 119.7° | 120.0° |
| N11 | C10 | C09 | 107.2° | 108.1° |
| N11 | C10 | H3 | 126.4° | 125.9° |
| C12 | C09 | C10 | 126.4° | 126.4° |
| C09 | C12 | O13 | 119.1° | 120.0° |
| C09 | C10 | H3 | 126.4° | 126.0° |
| C12 | O13 | H7 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C03 | C02 | C01 | H5 | 180.0° | 180.0° |
| C02 | C03 | C04 | H1 | 180.0° | 179.7° |
| C03 | C02 | C01 | C06 | 0.6° | 0.6° |
| C02 | C03 | C04 | C05 | 0.3° | 0.2° |
| C02 | C03 | C04 | H2 | 179.6° | 179.8° |
| C03 | C02 | C01 | H4 | 179.4° | 179.8° |
| C01 | C02 | C03 | C04 | 0.7° | 0.0° |
| C02 | C01 | C06 | H4 | 180.0° | 179.2° |
| C02 | C01 | C06 | C05 | 0.1° | 0.9° |
| C01 | C02 | C03 | H1 | 179.3° | 179.7° |
| C02 | C01 | C06 | H6 | 179.9° | 180.0° |
| C03 | C04 | C05 | H2 | 180.0° | 179.9° |
| C03 | C04 | C05 | C06 | 0.1° | 0.0° |
| C03 | C04 | C05 | N07 | 179.5° | 180.0° |
| C04 | C03 | C02 | H5 | 179.2° | 180.0° |
| C01 | C06 | C05 | C04 | 0.2° | 0.6° |
| C01 | C06 | C05 | H6 | 180.0° | 179.2° |
| C01 | C06 | C05 | N07 | 179.4° | 179.5° |
| C06 | C01 | C02 | H5 | 179.4° | 179.4° |
| F16 | C15 | F18 | F17 | 117.9° | 120.0° |
| F16 | C15 | F18 | C08 | 121.8° | 120.0° |
| F16 | C15 | F17 | C08 | 121.1° | 120.0° |
| F16 | C15 | C08 | N07 | 33.4° | 29.7° |
| F16 | C15 | C08 | C09 | 146.6° | 150.0° |
| C04 | C05 | C06 | N07 | 179.6° | 180.0° |
| C04 | C05 | N07 | C08 | 89.7° | 145.0° |
| C04 | C05 | N07 | N11 | 89.1° | 35.0° |
| C05 | C04 | C03 | H1 | 179.7° | 180.0° |
| C04 | C05 | C06 | H6 | 179.8° | 179.7° |
| C06 | C05 | N07 | C08 | 90.7° | 35.0° |
| C06 | C05 | N07 | N11 | 90.5° | 144.9° |
| C06 | C05 | C04 | H2 | 179.9° | 179.9° |
| C05 | C06 | C01 | H4 | 179.9° | 179.9° |
| F18 | C15 | F17 | C08 | 120.7° | 120.0° |
| F18 | C15 | C08 | N07 | 87.1° | 149.7° |
| F18 | C15 | C08 | C09 | 92.9° | 30.0° |
| F17 | C15 | C08 | N07 | 152.9° | 90.3° |
| F17 | C15 | C08 | C09 | 27.1° | 90.0° |
| C15 | C08 | N07 | C05 | 0.8° | 0.3° |
| C15 | C08 | N07 | C09 | 180.0° | 179.7° |
| C15 | C08 | N07 | N11 | 179.8° | 179.8° |
| C15 | C08 | C09 | C12 | 0.1° | 0.0° |
| C15 | C08 | C09 | C10 | 179.9° | 180.0° |
| C05 | N07 | C08 | N11 | 178.9° | 179.9° |
| C05 | N07 | C08 | C09 | 179.2° | 180.0° |
| C05 | N07 | N11 | C10 | 179.3° | 179.7° |
| N07 | C05 | C04 | H2 | 0.5° | 0.0° |
| N07 | C05 | C06 | H6 | 0.6° | 0.3° |
| C08 | N07 | N11 | C10 | 0.3° | 0.3° |
| N07 | C08 | C09 | C12 | 179.9° | 179.7° |
| N07 | C08 | C09 | C10 | 0.1° | 0.3° |
| N11 | N07 | C08 | C09 | 0.2° | 0.0° |
| N07 | N11 | C10 | C09 | 0.2° | 0.4° |
| N07 | N11 | C10 | H3 | 179.8° | 180.0° |
| C08 | C09 | C12 | O14 | 9.2° | 0.0° |
| C08 | C09 | C10 | N11 | 0.1° | 0.5° |
| C08 | C09 | C12 | C10 | 179.9° | 180.0° |
| C08 | C09 | C12 | O13 | 171.3° | 180.0° |
| C08 | C09 | C10 | H3 | 179.9° | 180.0° |
| O14 | C12 | C09 | O13 | 179.6° | 180.0° |
| O14 | C12 | C09 | C10 | 170.9° | 180.0° |
| O14 | C12 | O13 | H7 | 0.0° | 0.1° |
| N11 | C10 | C09 | C12 | 180.0° | 179.5° |
| N11 | C10 | C09 | H3 | 180.0° | 179.6° |
| C12 | C09 | C10 | H3 | 0.0° | 0.0° |
| C09 | C12 | O13 | H7 | 179.6° | 179.9° |
| C10 | C09 | C12 | O13 | 8.7° | 0.0° |
| H1 | C03 | C04 | H2 | 0.3° | 0.1° |
| H1 | C03 | C02 | H5 | 0.7° | 0.3° |
| H4 | C01 | C02 | H5 | 0.6° | 0.2° |
| H4 | C01 | C06 | H6 | 0.1° | 0.8° |
