7RN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O12 | C09 | doub | 1.22Å | 1.18Å | |
| C04 | C03 | sing | 1.38Å | 1.60Å | Aromatic |
| C04 | C05 | doub | 1.35Å | 1.45Å | Aromatic |
| C03 | C02 | doub | 1.34Å | 1.46Å | Aromatic |
| C05 | C06 | sing | 1.47Å | 1.51Å | |
| C05 | S15 | sing | 1.76Å | 1.57Å | Aromatic |
| C07 | C06 | doub | 1.37Å | 1.36Å | Aromatic |
| C07 | C08 | sing | 1.41Å | 1.37Å | Aromatic |
| C06 | N14 | sing | 1.37Å | 1.34Å | Aromatic |
| C02 | C01 | sing | 1.51Å | 1.53Å | |
| C02 | S15 | sing | 1.76Å | 1.54Å | Aromatic |
| C08 | C09 | sing | 1.48Å | 1.51Å | |
| C08 | N13 | doub | 1.32Å | 1.33Å | Aromatic |
| C09 | N10 | sing | 1.35Å | 1.44Å | |
| N14 | N13 | sing | 1.28Å | 1.38Å | Aromatic |
| N10 | C11 | sing | 1.47Å | 1.45Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C03 | H4 | sing | 1.08Å | 1.08Å | |
| C04 | H5 | sing | 1.08Å | 1.08Å | |
| C07 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| N10 | H10 | sing | 0.97Å | 1.00Å | |
| N14 | H11 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O12 | C09 | C08 | 119.5° | 120.0° |
| O12 | C09 | N10 | 123.3° | 120.0° |
| C03 | C04 | C05 | 107.3° | 114.7° |
| C04 | C03 | C02 | 108.1° | 115.1° |
| C04 | C03 | H4 | 125.9° | 122.4° |
| C03 | C04 | H5 | 126.3° | 122.7° |
| C04 | C05 | C06 | 123.3° | 125.3° |
| C04 | C05 | S15 | 109.5° | 109.5° |
| C05 | C04 | H5 | 126.4° | 122.7° |
| C03 | C02 | C01 | 125.9° | 125.1° |
| C03 | C02 | S15 | 109.2° | 109.8° |
| C02 | C03 | H4 | 126.0° | 122.5° |
| C06 | C05 | S15 | 127.1° | 125.2° |
| C05 | C06 | C07 | 126.2° | 126.7° |
| C05 | C06 | N14 | 124.6° | 126.6° |
| C05 | S15 | C02 | 105.9° | 91.0° |
| C06 | C07 | C08 | 106.0° | 105.5° |
| C07 | C06 | N14 | 109.1° | 106.7° |
| C06 | C07 | H6 | 127.0° | 127.3° |
| C07 | C08 | C09 | 127.3° | 126.3° |
| C07 | C08 | N13 | 109.8° | 107.4° |
| C08 | C07 | H6 | 127.0° | 127.3° |
| C06 | N14 | N13 | 108.0° | 110.0° |
| C06 | N14 | H11 | 126.0° | 125.0° |
| C01 | C02 | S15 | 125.0° | 125.1° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.4° | 109.5° |
| C02 | C01 | H3 | 109.5° | 109.5° |
| C09 | C08 | N13 | 122.9° | 126.3° |
| C08 | C09 | N10 | 117.2° | 120.0° |
| C08 | N13 | N14 | 107.0° | 110.5° |
| C09 | N10 | C11 | 120.1° | 120.0° |
| C09 | N10 | H10 | 119.9° | 120.0° |
| N13 | N14 | H11 | 126.0° | 125.0° |
| N10 | C11 | H7 | 109.5° | 109.5° |
| N10 | C11 | H8 | 109.5° | 109.5° |
| N10 | C11 | H9 | 109.5° | 109.4° |
| C11 | N10 | H10 | 119.9° | 120.0° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.4° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H7 | C11 | H9 | 109.5° | 109.5° |
| H8 | C11 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O12 | C09 | C08 | C07 | 30.7° | 0.0° |
| O12 | C09 | C08 | N10 | 179.8° | 180.0° |
| O12 | C09 | C08 | N13 | 150.7° | 179.9° |
| O12 | C09 | N10 | C11 | 0.5° | 0.0° |
| O12 | C09 | N10 | H10 | 179.5° | 180.0° |
| C03 | C04 | C05 | H5 | 180.0° | 179.9° |
| C04 | C03 | C02 | H4 | 180.0° | 179.9° |
| C03 | C04 | C05 | C06 | 178.7° | 180.0° |
| C03 | C04 | C05 | S15 | 1.1° | 0.3° |
| C04 | C03 | C02 | C01 | 179.5° | 179.9° |
| C04 | C03 | C02 | S15 | 0.1° | 0.3° |
| C05 | C04 | C03 | C02 | 0.7° | 0.0° |
| C04 | C05 | C06 | S15 | 177.1° | 179.7° |
| C04 | C05 | C06 | C07 | 162.7° | 179.7° |
| C04 | C05 | C06 | N14 | 20.5° | 0.1° |
| C04 | C05 | S15 | C02 | 1.2° | 0.3° |
| C05 | C04 | C03 | H4 | 179.3° | 179.9° |
| C03 | C02 | S15 | C05 | 0.7° | 0.3° |
| C03 | C02 | C01 | S15 | 179.5° | 179.6° |
| C03 | C02 | C01 | H1 | 179.5° | 179.7° |
| C03 | C02 | C01 | H2 | 59.5° | 59.6° |
| C03 | C02 | C01 | H3 | 60.5° | 60.4° |
| C02 | C03 | C04 | H5 | 179.3° | 179.9° |
| C05 | C06 | C07 | N14 | 177.2° | 179.7° |
| C05 | C06 | C07 | C08 | 178.8° | 180.0° |
| C06 | C05 | S15 | C02 | 178.6° | 179.9° |
| C05 | C06 | N14 | N13 | 178.6° | 179.9° |
| C06 | C05 | C04 | H5 | 1.3° | 0.1° |
| C05 | C06 | C07 | H6 | 1.2° | 0.0° |
| C05 | C06 | N14 | H11 | 1.4° | 0.0° |
| S15 | C05 | C06 | C07 | 20.2° | 0.6° |
| S15 | C05 | C06 | N14 | 156.6° | 179.7° |
| C05 | S15 | C02 | C01 | 178.8° | 180.0° |
| S15 | C05 | C04 | H5 | 178.8° | 179.8° |
| C06 | C07 | C08 | H6 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 179.9° | 180.0° |
| C06 | C07 | C08 | N13 | 1.2° | 0.0° |
| C07 | C06 | N14 | N13 | 1.4° | 0.4° |
| C07 | C06 | N14 | H11 | 178.6° | 179.7° |
| C08 | C07 | C06 | N14 | 1.6° | 0.2° |
| C07 | C08 | C09 | N13 | 178.5° | 180.0° |
| C07 | C08 | C09 | N10 | 149.0° | 180.0° |
| C07 | C08 | N13 | N14 | 0.4° | 0.2° |
| C06 | N14 | N13 | C08 | 0.6° | 0.4° |
| C06 | N14 | N13 | H11 | 180.0° | 179.9° |
| N14 | C06 | C07 | H6 | 178.4° | 179.7° |
| C02 | C01 | H1 | H2 | 120.0° | 120.1° |
| C02 | C01 | H1 | H3 | 120.0° | 120.0° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | C03 | H4 | 0.5° | 0.2° |
| S15 | C02 | C01 | H1 | 0.0° | 0.1° |
| S15 | C02 | C01 | H2 | 120.0° | 120.0° |
| S15 | C02 | C01 | H3 | 120.0° | 120.0° |
| S15 | C02 | C03 | H4 | 179.9° | 179.8° |
| C09 | C08 | N13 | N14 | 179.2° | 179.7° |
| C08 | C09 | N10 | C11 | 179.2° | 180.0° |
| C09 | C08 | C07 | H6 | 0.1° | 0.0° |
| C08 | C09 | N10 | H10 | 0.8° | 0.0° |
| N13 | C08 | C09 | N10 | 29.5° | 0.0° |
| N13 | C08 | C07 | H6 | 178.8° | 180.0° |
| C08 | N13 | N14 | H11 | 179.4° | 179.7° |
| C09 | N10 | C11 | H10 | 180.0° | 180.0° |
| C09 | N10 | C11 | H7 | 180.0° | 180.0° |
| C09 | N10 | C11 | H8 | 60.0° | 59.9° |
| C09 | N10 | C11 | H9 | 60.0° | 60.0° |
| N10 | C11 | H7 | H8 | 120.0° | 120.0° |
| N10 | C11 | H7 | H9 | 120.0° | 119.9° |
| N10 | C11 | H8 | H9 | 120.0° | 119.9° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H4 | C03 | C04 | H5 | 0.7° | 0.0° |
| H7 | C11 | H8 | H9 | 120.0° | 120.0° |
| H7 | C11 | N10 | H10 | 0.0° | 0.0° |
| H8 | C11 | N10 | H10 | 120.0° | 120.0° |
| H9 | C11 | N10 | H10 | 120.0° | 120.0° |
