RW5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C21 | sing | 1.51Å | 1.53Å | |
| C21 | O22 | sing | 1.34Å | 1.34Å | Aromatic |
| C21 | C20 | doub | 1.35Å | 1.39Å | Aromatic |
| O22 | C18 | sing | 1.34Å | 1.34Å | Aromatic |
| C20 | C19 | sing | 1.41Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.35Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C24 | C17 | sing | 1.53Å | 1.52Å | |
| C24 | C02 | sing | 1.53Å | 1.50Å | |
| C17 | N05 | sing | 1.47Å | 1.51Å | |
| C01 | C02 | sing | 1.53Å | 1.59Å | |
| C02 | C03 | sing | 1.53Å | 1.47Å | |
| O16 | C06 | doub | 1.22Å | 1.19Å | |
| N05 | C06 | sing | 1.35Å | 1.45Å | |
| N05 | C04 | sing | 1.47Å | 1.52Å | |
| C03 | C04 | sing | 1.53Å | 1.52Å | |
| C06 | C07 | sing | 1.48Å | 1.52Å | |
| C07 | C08 | doub | 1.40Å | 1.42Å | Aromatic |
| C07 | N15 | sing | 1.33Å | 1.33Å | Aromatic |
| C09 | C08 | sing | 1.46Å | 1.41Å | Aromatic |
| C09 | C10 | doub | 1.34Å | 1.39Å | Aromatic |
| C08 | C12 | sing | 1.42Å | 1.37Å | Aromatic |
| N15 | C14 | doub | 1.32Å | 1.32Å | Aromatic |
| C10 | N11 | sing | 1.37Å | 1.33Å | Aromatic |
| C12 | N11 | sing | 1.37Å | 1.36Å | Aromatic |
| C12 | N13 | doub | 1.33Å | 1.36Å | Aromatic |
| C14 | N13 | sing | 1.32Å | 1.32Å | Aromatic |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| N11 | H111 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C21 | O22 | 126.0° | 125.7° |
| C23 | C21 | C20 | 126.9° | 125.9° |
| C21 | C23 | H231 | 109.5° | 109.5° |
| C21 | C23 | H233 | 109.5° | 109.4° |
| C21 | C23 | H232 | 109.5° | 109.4° |
| O22 | C21 | C20 | 107.1° | 108.4° |
| C21 | O22 | C18 | 111.1° | 109.5° |
| C21 | C20 | C19 | 107.4° | 106.9° |
| C21 | C20 | H201 | 126.3° | 126.5° |
| O22 | C18 | C19 | 107.3° | 108.4° |
| O22 | C18 | C17 | 123.5° | 125.8° |
| C20 | C19 | C18 | 107.1° | 106.9° |
| C19 | C20 | H201 | 126.3° | 126.6° |
| C20 | C19 | H191 | 126.4° | 126.6° |
| C19 | C18 | C17 | 129.2° | 125.8° |
| C18 | C19 | H191 | 126.4° | 126.5° |
| C18 | C17 | C24 | 106.6° | 109.6° |
| C18 | C17 | N05 | 115.0° | 109.6° |
| C18 | C17 | H171 | 107.8° | 109.6° |
| C17 | C24 | C02 | 111.6° | 109.3° |
| C24 | C17 | N05 | 111.5° | 108.8° |
| C24 | C17 | H171 | 107.8° | 109.7° |
| C17 | C24 | H241 | 109.0° | 109.5° |
| C17 | C24 | H242 | 108.9° | 109.5° |
| C24 | C02 | C01 | 108.8° | 109.4° |
| C24 | C02 | C03 | 111.4° | 109.6° |
| C24 | C02 | H021 | 109.2° | 109.5° |
| C02 | C24 | H241 | 108.9° | 109.5° |
| C02 | C24 | H242 | 109.0° | 109.5° |
| C17 | N05 | C06 | 122.5° | 120.7° |
| C17 | N05 | C04 | 112.9° | 118.7° |
| N05 | C17 | H171 | 107.9° | 109.6° |
| C01 | C02 | C03 | 109.7° | 109.4° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.5° | 109.4° |
| C02 | C01 | H011 | 109.5° | 109.4° |
| C01 | C02 | H021 | 108.1° | 109.4° |
| C02 | C03 | C04 | 110.5° | 109.3° |
| C03 | C02 | H021 | 109.5° | 109.5° |
| C02 | C03 | H031 | 109.2° | 109.5° |
| C02 | C03 | H032 | 109.2° | 109.5° |
| O16 | C06 | N05 | 119.9° | 120.0° |
| O16 | C06 | C07 | 119.7° | 120.0° |
| C06 | N05 | C04 | 124.7° | 120.6° |
| N05 | C06 | C07 | 120.4° | 120.0° |
| N05 | C04 | C03 | 113.2° | 108.8° |
| N05 | C04 | H042 | 108.5° | 109.6° |
| N05 | C04 | H041 | 108.6° | 109.7° |
| C04 | C03 | H031 | 109.2° | 109.5° |
| C04 | C03 | H032 | 109.2° | 109.5° |
| C03 | C04 | H042 | 108.5° | 109.6° |
| C03 | C04 | H041 | 108.5° | 109.6° |
| C06 | C07 | C08 | 122.8° | 120.9° |
| C06 | C07 | N15 | 118.0° | 120.9° |
| C08 | C07 | N15 | 119.1° | 118.2° |
| C07 | C08 | C09 | 137.0° | 135.3° |
| C07 | C08 | C12 | 118.1° | 118.6° |
| C07 | N15 | C14 | 121.2° | 121.1° |
| C08 | C09 | C10 | 107.8° | 106.9° |
| C09 | C08 | C12 | 104.9° | 106.1° |
| C08 | C09 | H091 | 126.1° | 126.6° |
| C09 | C10 | N11 | 108.1° | 110.0° |
| C09 | C10 | H101 | 125.9° | 125.0° |
| C10 | C09 | H091 | 126.1° | 126.6° |
| C08 | C12 | N11 | 110.0° | 107.0° |
| C08 | C12 | N13 | 118.8° | 118.5° |
| N15 | C14 | N13 | 121.3° | 122.9° |
| N15 | C14 | H141 | 119.4° | 118.6° |
| C10 | N11 | C12 | 109.2° | 110.0° |
| N11 | C10 | H101 | 126.0° | 125.0° |
| C10 | N11 | H111 | 125.4° | 125.0° |
| N11 | C12 | N13 | 131.2° | 134.5° |
| C12 | N11 | H111 | 125.4° | 125.0° |
| C12 | N13 | C14 | 121.4° | 120.7° |
| N13 | C14 | H141 | 119.4° | 118.5° |
| H013 | C01 | H012 | 109.4° | 109.5° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H012 | C01 | H011 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.5° |
| H042 | C04 | H041 | 109.5° | 109.6° |
| H231 | C23 | H233 | 109.5° | 109.5° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H233 | C23 | H232 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C21 | O22 | C20 | 178.8° | 179.7° |
| C23 | C21 | O22 | C18 | 179.3° | 180.0° |
| C23 | C21 | C20 | C19 | 179.1° | 179.8° |
| C23 | C21 | C20 | H201 | 0.9° | 0.2° |
| C21 | C23 | H231 | H233 | 120.0° | 120.0° |
| C21 | C23 | H231 | H232 | 120.0° | 120.0° |
| C21 | C23 | H233 | H232 | 120.0° | 119.9° |
| O22 | C21 | C20 | C19 | 0.3° | 0.4° |
| C21 | O22 | C18 | C19 | 0.5° | 0.0° |
| C21 | O22 | C18 | C17 | 179.9° | 179.7° |
| O22 | C21 | C20 | H201 | 179.8° | 180.0° |
| O22 | C21 | C23 | H231 | 0.0° | 0.0° |
| O22 | C21 | C23 | H233 | 120.0° | 120.1° |
| O22 | C21 | C23 | H232 | 120.0° | 120.0° |
| C20 | C21 | O22 | C18 | 0.5° | 0.3° |
| C21 | C20 | C19 | H201 | 180.0° | 179.6° |
| C21 | C20 | C19 | C18 | 0.1° | 0.4° |
| C21 | C20 | C19 | H191 | 179.9° | 179.6° |
| C20 | C21 | C23 | H231 | 178.6° | 179.7° |
| C20 | C21 | C23 | H233 | 61.4° | 59.6° |
| C20 | C21 | C23 | H232 | 58.6° | 60.3° |
| O22 | C18 | C19 | C20 | 0.4° | 0.2° |
| O22 | C18 | C19 | C17 | 179.5° | 179.8° |
| O22 | C18 | C17 | C24 | 41.0° | 79.0° |
| O22 | C18 | C17 | N05 | 165.1° | 40.3° |
| O22 | C18 | C17 | H171 | 74.5° | 160.5° |
| O22 | C18 | C19 | H191 | 179.6° | 179.8° |
| C20 | C19 | C18 | H191 | 180.0° | 180.0° |
| C20 | C19 | C18 | C17 | 179.9° | 180.0° |
| C19 | C18 | C17 | C24 | 139.5° | 100.7° |
| C19 | C18 | C17 | N05 | 15.5° | 140.0° |
| C19 | C18 | C17 | H171 | 105.0° | 19.7° |
| C18 | C19 | C20 | H201 | 179.9° | 180.0° |
| C18 | C17 | C24 | N05 | 126.3° | 119.8° |
| C18 | C17 | C24 | H171 | 115.5° | 120.4° |
| C18 | C17 | C24 | C02 | 72.6° | 65.2° |
| C18 | C17 | N05 | H171 | 120.4° | 120.3° |
| C18 | C17 | N05 | C06 | 107.7° | 113.8° |
| C18 | C17 | N05 | C04 | 73.2° | 66.2° |
| C17 | C18 | C19 | H191 | 0.1° | 0.0° |
| C18 | C17 | C24 | H241 | 47.7° | 54.8° |
| C18 | C17 | C24 | H242 | 167.0° | 174.9° |
| C17 | C24 | C02 | H241 | 120.3° | 120.0° |
| C17 | C24 | C02 | H242 | 120.3° | 119.9° |
| C24 | C17 | N05 | H171 | 118.2° | 120.0° |
| C17 | C24 | C02 | C01 | 179.5° | 178.6° |
| C17 | C24 | C02 | C03 | 59.3° | 61.4° |
| C24 | C17 | N05 | C06 | 130.8° | 126.4° |
| C24 | C17 | N05 | C04 | 48.3° | 53.6° |
| C17 | C24 | C02 | H021 | 61.8° | 58.7° |
| C17 | C24 | H241 | H242 | 119.0° | 120.1° |
| C02 | C24 | C17 | N05 | 53.6° | 54.6° |
| C24 | C02 | C01 | C03 | 122.2° | 120.1° |
| C24 | C02 | C01 | H021 | 118.5° | 119.9° |
| C24 | C02 | C03 | H021 | 121.0° | 120.1° |
| C24 | C02 | C03 | C04 | 58.0° | 61.4° |
| C02 | C24 | C17 | H171 | 171.9° | 174.4° |
| C24 | C02 | C01 | H013 | 180.0° | 179.9° |
| C24 | C02 | C01 | H012 | 60.0° | 59.9° |
| C24 | C02 | C01 | H011 | 60.0° | 60.1° |
| C24 | C02 | C03 | H031 | 178.1° | 178.7° |
| C24 | C02 | C03 | H032 | 62.2° | 58.6° |
| C02 | C24 | H241 | H242 | 119.0° | 120.1° |
| C17 | N05 | C06 | O16 | 0.3° | 3.8° |
| C17 | N05 | C06 | C04 | 179.0° | 180.0° |
| C17 | N05 | C04 | C03 | 48.4° | 53.6° |
| C17 | N05 | C06 | C07 | 178.5° | 176.2° |
| C17 | N05 | C04 | H042 | 169.0° | 66.2° |
| C17 | N05 | C04 | H041 | 72.1° | 173.5° |
| N05 | C17 | C24 | H241 | 173.9° | 174.6° |
| N05 | C17 | C24 | H242 | 66.7° | 65.3° |
| C01 | C02 | C03 | H021 | 118.4° | 119.9° |
| C01 | C02 | C03 | C04 | 178.6° | 178.6° |
| C02 | C01 | H013 | H012 | 120.0° | 120.0° |
| C02 | C01 | H013 | H011 | 120.0° | 120.0° |
| C02 | C01 | H012 | H011 | 120.0° | 119.9° |
| C01 | C02 | C03 | H031 | 61.3° | 58.7° |
| C01 | C02 | C03 | H032 | 58.4° | 61.5° |
| C01 | C02 | C24 | H241 | 59.2° | 58.6° |
| C01 | C02 | C24 | H242 | 60.1° | 61.5° |
| C02 | C03 | C04 | N05 | 52.8° | 54.7° |
| C02 | C03 | C04 | H031 | 120.2° | 120.0° |
| C02 | C03 | C04 | H032 | 120.2° | 120.0° |
| C03 | C02 | C01 | H013 | 57.9° | 60.0° |
| C03 | C02 | C01 | H012 | 177.8° | 180.0° |
| C03 | C02 | C01 | H011 | 62.2° | 60.0° |
| C02 | C03 | H031 | H032 | 119.6° | 120.1° |
| C02 | C03 | C04 | H042 | 173.3° | 65.2° |
| C02 | C03 | C04 | H041 | 67.8° | 174.6° |
| C03 | C02 | C24 | H241 | 179.6° | 178.6° |
| C03 | C02 | C24 | H242 | 61.0° | 58.5° |
| O16 | C06 | N05 | C07 | 178.9° | 180.0° |
| O16 | C06 | N05 | C04 | 179.3° | 176.2° |
| O16 | C06 | C07 | C08 | 54.3° | 38.2° |
| O16 | C06 | C07 | N15 | 124.7° | 140.9° |
| C06 | N05 | C04 | C03 | 130.6° | 126.4° |
| N05 | C06 | C07 | C08 | 126.9° | 141.8° |
| N05 | C06 | C07 | N15 | 54.2° | 39.2° |
| C06 | N05 | C17 | H171 | 12.6° | 6.4° |
| C06 | N05 | C04 | H042 | 10.1° | 113.8° |
| C06 | N05 | C04 | H041 | 108.8° | 6.6° |
| N05 | C04 | C03 | H042 | 120.6° | 119.8° |
| N05 | C04 | C03 | H041 | 120.6° | 119.9° |
| C04 | N05 | C06 | C07 | 0.5° | 3.9° |
| C04 | N05 | C17 | H171 | 166.5° | 173.6° |
| N05 | C04 | C03 | H031 | 172.9° | 174.6° |
| N05 | C04 | C03 | H032 | 67.4° | 65.3° |
| N05 | C04 | H042 | H041 | 118.3° | 120.4° |
| C04 | C03 | C02 | H021 | 63.0° | 58.7° |
| C04 | C03 | H031 | H032 | 119.5° | 120.1° |
| C03 | C04 | H042 | H041 | 118.3° | 120.3° |
| C06 | C07 | C08 | N15 | 178.9° | 179.1° |
| C06 | C07 | C08 | C09 | 0.8° | 0.1° |
| C06 | C07 | C08 | C12 | 179.6° | 180.0° |
| C06 | C07 | N15 | C14 | 179.8° | 179.7° |
| C07 | C08 | C09 | C12 | 179.6° | 180.0° |
| C07 | C08 | C09 | C10 | 179.7° | 179.9° |
| C08 | C07 | N15 | C14 | 0.8° | 0.6° |
| C07 | C08 | C12 | N11 | 179.8° | 179.5° |
| C07 | C08 | C12 | N13 | 0.2° | 0.6° |
| C07 | C08 | C09 | H091 | 0.3° | 0.0° |
| N15 | C07 | C08 | C09 | 179.7° | 179.2° |
| N15 | C07 | C08 | C12 | 0.7° | 0.9° |
| C07 | N15 | C14 | N13 | 0.4° | 0.0° |
| C07 | N15 | C14 | H141 | 179.6° | 179.7° |
| C08 | C09 | C10 | H091 | 180.0° | 180.0° |
| C08 | C09 | C10 | N11 | 0.0° | 0.5° |
| C09 | C08 | C12 | N11 | 0.1° | 0.5° |
| C09 | C08 | C12 | N13 | 179.9° | 179.4° |
| C08 | C09 | C10 | H101 | 180.0° | 179.6° |
| C10 | C09 | C08 | C12 | 0.1° | 0.0° |
| C09 | C10 | N11 | H101 | 180.0° | 179.1° |
| C09 | C10 | N11 | C12 | 0.0° | 0.9° |
| C09 | C10 | N11 | H111 | 180.0° | 180.0° |
| C08 | C12 | N11 | C10 | 0.1° | 0.8° |
| C08 | C12 | N11 | N13 | 179.9° | 179.9° |
| C08 | C12 | N13 | C14 | 0.2° | 0.0° |
| C12 | C08 | C09 | H091 | 179.9° | 180.0° |
| C08 | C12 | N11 | H111 | 180.0° | 180.0° |
| N15 | C14 | N13 | C12 | 0.1° | 0.3° |
| N15 | C14 | N13 | H141 | 180.0° | 179.7° |
| C10 | N11 | C12 | H111 | 180.0° | 179.1° |
| C10 | N11 | C12 | N13 | 179.9° | 179.1° |
| N11 | C10 | C09 | H091 | 180.0° | 179.5° |
| N11 | C12 | N13 | C14 | 179.8° | 180.0° |
| C12 | N11 | C10 | H101 | 180.0° | 180.0° |
| C12 | N13 | C14 | H141 | 179.9° | 180.0° |
| N13 | C12 | N11 | H111 | 0.1° | 0.0° |
| H171 | C17 | C24 | H241 | 67.8° | 65.5° |
| H171 | C17 | C24 | H242 | 51.5° | 54.6° |
| H101 | C10 | C09 | H091 | 0.0° | 0.3° |
| H101 | C10 | N11 | H111 | 0.0° | 0.9° |
| H201 | C20 | C19 | H191 | 0.1° | 0.0° |
| H013 | C01 | H012 | H011 | 120.0° | 120.1° |
| H013 | C01 | C02 | H021 | 61.5° | 60.0° |
| H012 | C01 | C02 | H021 | 58.5° | 60.0° |
| H011 | C01 | C02 | H021 | 178.5° | 180.0° |
| H021 | C02 | C03 | H031 | 57.2° | 61.3° |
| H021 | C02 | C03 | H032 | 176.9° | 178.6° |
| H021 | C02 | C24 | H241 | 58.5° | 61.3° |
| H021 | C02 | C24 | H242 | 177.9° | 178.6° |
| H031 | C03 | C04 | H042 | 66.5° | 54.8° |
| H031 | C03 | C04 | H041 | 52.3° | 65.5° |
| H032 | C03 | C04 | H042 | 53.1° | 174.9° |
| H032 | C03 | C04 | H041 | 172.0° | 54.6° |
| H231 | C23 | H233 | H232 | 120.0° | 120.0° |
