RNW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O20 | N19 | sing | 1.42Å | 1.35Å | |
| N19 | C17 | sing | 1.35Å | 1.46Å | |
| O15 | S14 | doub | 1.42Å | 1.45Å | |
| C06 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C06 | C01 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | O18 | doub | 1.21Å | 1.21Å | |
| C17 | C16 | sing | 1.51Å | 1.51Å | |
| C05 | C04 | sing | 1.38Å | 1.40Å | Aromatic |
| S14 | C16 | sing | 1.81Å | 1.85Å | |
| S14 | C07 | sing | 1.81Å | 1.89Å | |
| C01 | C02 | doub | 1.38Å | 1.39Å | Aromatic |
| C04 | C07 | sing | 1.51Å | 1.51Å | |
| C04 | C03 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | C08 | sing | 1.51Å | 1.51Å | |
| C02 | C03 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | C08 | doub | 1.38Å | 1.40Å | Aromatic |
| C09 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| N19 | H191 | sing | 0.97Å | 1.00Å | |
| O20 | H201 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O20 | N19 | C17 | 120.8° | 120.0° |
| O20 | N19 | H191 | 119.6° | 120.0° |
| N19 | O20 | H201 | 109.5° | 114.0° |
| N19 | C17 | O18 | 120.4° | 120.0° |
| N19 | C17 | C16 | 113.9° | 120.0° |
| C17 | N19 | H191 | 119.6° | 120.0° |
| O15 | S14 | C16 | 104.1° | 109.5° |
| O15 | S14 | C07 | 105.1° | 109.5° |
| C05 | C06 | C01 | 120.7° | 120.0° |
| C06 | C05 | C04 | 121.5° | 120.0° |
| C06 | C05 | H051 | 119.3° | 120.1° |
| C05 | C06 | H061 | 119.6° | 120.0° |
| C06 | C01 | C02 | 118.5° | 120.1° |
| C06 | C01 | H011 | 120.8° | 119.9° |
| C01 | C06 | H061 | 119.7° | 120.1° |
| O18 | C17 | C16 | 125.4° | 120.0° |
| C17 | C16 | S14 | 112.4° | 109.5° |
| C17 | C16 | H161 | 108.7° | 109.5° |
| C17 | C16 | H162 | 108.7° | 109.5° |
| C05 | C04 | C07 | 120.9° | 120.0° |
| C05 | C04 | C03 | 116.8° | 119.9° |
| C04 | C05 | H051 | 119.2° | 120.0° |
| C16 | S14 | C07 | 118.1° | 103.0° |
| S14 | C16 | H161 | 108.7° | 109.4° |
| S14 | C16 | H162 | 108.7° | 109.5° |
| S14 | C07 | C04 | 122.1° | 109.5° |
| S14 | C07 | C08 | 101.2° | 109.4° |
| S14 | C07 | H071 | 106.5° | 109.5° |
| C01 | C02 | C03 | 120.8° | 120.0° |
| C02 | C01 | H011 | 120.8° | 120.0° |
| C01 | C02 | H021 | 119.6° | 120.0° |
| C07 | C04 | C03 | 121.8° | 120.0° |
| C04 | C07 | C08 | 104.9° | 109.5° |
| C04 | C07 | H071 | 110.8° | 109.5° |
| C04 | C03 | C02 | 121.7° | 120.0° |
| C04 | C03 | H031 | 119.1° | 119.9° |
| C07 | C08 | C09 | 121.9° | 120.0° |
| C07 | C08 | C13 | 118.9° | 120.0° |
| C08 | C07 | H071 | 110.8° | 109.5° |
| C03 | C02 | H021 | 119.6° | 120.0° |
| C02 | C03 | H031 | 119.1° | 120.0° |
| C08 | C09 | C10 | 120.6° | 120.0° |
| C09 | C08 | C13 | 118.0° | 120.0° |
| C08 | C09 | H091 | 119.7° | 120.0° |
| C09 | C10 | C11 | 120.7° | 120.1° |
| C09 | C10 | H101 | 119.6° | 120.0° |
| C10 | C09 | H091 | 119.7° | 120.0° |
| C08 | C13 | C12 | 121.2° | 120.0° |
| C08 | C13 | H131 | 119.4° | 120.0° |
| C10 | C11 | C12 | 119.2° | 120.0° |
| C11 | C10 | H101 | 119.7° | 120.0° |
| C10 | C11 | H111 | 120.4° | 120.0° |
| C13 | C12 | C11 | 120.3° | 120.0° |
| C12 | C13 | H131 | 119.4° | 120.0° |
| C13 | C12 | H121 | 119.9° | 120.0° |
| C12 | C11 | H111 | 120.4° | 120.0° |
| C11 | C12 | H121 | 119.9° | 120.0° |
| H161 | C16 | H162 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O20 | N19 | C17 | H191 | 180.0° | 179.9° |
| O20 | N19 | C17 | O18 | 0.0° | 0.0° |
| O20 | N19 | C17 | C16 | 173.9° | 180.0° |
| N19 | C17 | O18 | C16 | 173.1° | 180.0° |
| N19 | C17 | C16 | S14 | 77.4° | 180.0° |
| N19 | C17 | C16 | H161 | 43.0° | 60.0° |
| N19 | C17 | C16 | H162 | 162.2° | 60.0° |
| C17 | N19 | O20 | H201 | 0.0° | 179.9° |
| O15 | S14 | C16 | C17 | 94.8° | 63.6° |
| O15 | S14 | C16 | C07 | 116.0° | 116.4° |
| O15 | S14 | C07 | C04 | 63.5° | 171.4° |
| O15 | S14 | C07 | C08 | 179.1° | 68.7° |
| O15 | S14 | C07 | H071 | 65.0° | 51.3° |
| O15 | S14 | C16 | H161 | 25.6° | 56.4° |
| O15 | S14 | C16 | H162 | 144.8° | 176.4° |
| C05 | C06 | C01 | H061 | 180.0° | 179.5° |
| C06 | C05 | C04 | H051 | 180.0° | 179.8° |
| C05 | C06 | C01 | C02 | 0.1° | 0.6° |
| C06 | C05 | C04 | C07 | 171.8° | 179.7° |
| C06 | C05 | C04 | C03 | 0.0° | 0.2° |
| C05 | C06 | C01 | H011 | 180.0° | 179.8° |
| C01 | C06 | C05 | C04 | 0.1° | 0.5° |
| C06 | C01 | C02 | H011 | 180.0° | 179.7° |
| C06 | C01 | C02 | C03 | 0.0° | 0.3° |
| C06 | C01 | C02 | H021 | 180.0° | 179.7° |
| C01 | C06 | C05 | H051 | 179.9° | 179.7° |
| O18 | C17 | C16 | S14 | 96.1° | 0.0° |
| O18 | C17 | C16 | H161 | 143.4° | 119.9° |
| O18 | C17 | C16 | H162 | 24.3° | 120.0° |
| O18 | C17 | N19 | H191 | 180.0° | 179.9° |
| C17 | C16 | S14 | H161 | 120.4° | 120.0° |
| C17 | C16 | S14 | H162 | 120.4° | 120.0° |
| C17 | C16 | S14 | C07 | 149.2° | 180.0° |
| C17 | C16 | H161 | H162 | 118.6° | 120.0° |
| C16 | C17 | N19 | H191 | 6.2° | 0.1° |
| C05 | C04 | C07 | S14 | 2.0° | 51.9° |
| C05 | C04 | C07 | C03 | 171.3° | 180.0° |
| C05 | C04 | C07 | C08 | 111.8° | 68.0° |
| C05 | C04 | C03 | C02 | 0.1° | 0.0° |
| C05 | C04 | C03 | H031 | 179.9° | 180.0° |
| C04 | C05 | C06 | H061 | 179.9° | 180.0° |
| C05 | C04 | C07 | H071 | 128.6° | 171.9° |
| C16 | S14 | C07 | C04 | 179.0° | 55.0° |
| C16 | S14 | C07 | C08 | 65.4° | 175.0° |
| C16 | S14 | C07 | H071 | 50.5° | 65.0° |
| S14 | C16 | H161 | H162 | 118.6° | 120.0° |
| S14 | C07 | C04 | C08 | 113.8° | 119.9° |
| S14 | C07 | C04 | H071 | 126.6° | 120.0° |
| S14 | C07 | C04 | C03 | 169.3° | 128.1° |
| S14 | C07 | C08 | H071 | 112.6° | 120.0° |
| S14 | C07 | C08 | C09 | 63.0° | 50.9° |
| S14 | C07 | C08 | C13 | 104.6° | 128.3° |
| C07 | S14 | C16 | H161 | 90.4° | 60.0° |
| C07 | S14 | C16 | H162 | 28.7° | 60.0° |
| C01 | C02 | C03 | C04 | 0.1° | 0.0° |
| C01 | C02 | C03 | H021 | 180.0° | 180.0° |
| C01 | C02 | C03 | H031 | 179.9° | 180.0° |
| C02 | C01 | C06 | H061 | 180.0° | 180.0° |
| C04 | C07 | C08 | H071 | 119.6° | 120.1° |
| C07 | C04 | C03 | C02 | 171.6° | 180.0° |
| C04 | C07 | C08 | C09 | 64.7° | 69.1° |
| C04 | C07 | C08 | C13 | 127.6° | 111.7° |
| C07 | C04 | C03 | H031 | 8.4° | 0.0° |
| C07 | C04 | C05 | H051 | 8.3° | 0.0° |
| C03 | C04 | C07 | C08 | 76.9° | 111.9° |
| C04 | C03 | C02 | H031 | 180.0° | 180.0° |
| C04 | C03 | C02 | H021 | 179.9° | 180.0° |
| C03 | C04 | C05 | H051 | 180.0° | 180.0° |
| C03 | C04 | C07 | H071 | 42.7° | 8.1° |
| C07 | C08 | C09 | C13 | 167.8° | 179.2° |
| C07 | C08 | C09 | C10 | 167.8° | 179.7° |
| C07 | C08 | C13 | C12 | 168.2° | 180.0° |
| C07 | C08 | C13 | H131 | 11.8° | 0.6° |
| C07 | C08 | C09 | H091 | 12.1° | 0.2° |
| C03 | C02 | C01 | H011 | 179.9° | 180.0° |
| C08 | C09 | C10 | H091 | 180.0° | 179.9° |
| C08 | C09 | C10 | C11 | 0.1° | 0.0° |
| C09 | C08 | C13 | C12 | 0.0° | 0.8° |
| C08 | C09 | C10 | H101 | 179.9° | 179.7° |
| C09 | C08 | C13 | H131 | 180.0° | 179.8° |
| C09 | C08 | C07 | H071 | 175.7° | 170.8° |
| C10 | C09 | C08 | C13 | 0.1° | 0.5° |
| C09 | C10 | C11 | H101 | 180.0° | 179.6° |
| C09 | C10 | C11 | C12 | 0.0° | 0.3° |
| C09 | C10 | C11 | H111 | 180.0° | 179.7° |
| C08 | C13 | C12 | H131 | 180.0° | 179.4° |
| C08 | C13 | C12 | C11 | 0.0° | 0.6° |
| C13 | C08 | C07 | H071 | 8.0° | 8.3° |
| C13 | C08 | C09 | H091 | 179.9° | 179.4° |
| C08 | C13 | C12 | H121 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 0.0° | 0.0° |
| C10 | C11 | C12 | H111 | 180.0° | 180.0° |
| C11 | C10 | C09 | H091 | 179.9° | 180.0° |
| C10 | C11 | C12 | H121 | 180.0° | 179.4° |
| C13 | C12 | C11 | H121 | 180.0° | 179.4° |
| C13 | C12 | C11 | H111 | 180.0° | 180.0° |
| C12 | C11 | C10 | H101 | 180.0° | 180.0° |
| C11 | C12 | C13 | H131 | 180.0° | 180.0° |
| H101 | C10 | C09 | H091 | 0.1° | 0.4° |
| H101 | C10 | C11 | H111 | 0.0° | 0.0° |
| H131 | C13 | C12 | H121 | 0.0° | 0.6° |
| H011 | C01 | C02 | H021 | 0.0° | 0.0° |
| H011 | C01 | C06 | H061 | 0.0° | 0.3° |
| H021 | C02 | C03 | H031 | 0.1° | 0.0° |
| H051 | C05 | C06 | H061 | 0.0° | 0.2° |
| H111 | C11 | C12 | H121 | 0.0° | 0.6° |
| H191 | N19 | O20 | H201 | 180.0° | 0.0° |
