RNQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C4 | sing | 1.43Å | 1.43Å | |
| O6 | C6 | sing | 1.43Å | 1.44Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.53Å | 1.55Å | |
| O3 | C3 | sing | 1.43Å | 1.46Å | |
| C5 | O5 | sing | 1.43Å | 1.42Å | |
| O5 | C1 | sing | 1.43Å | 1.44Å | |
| C3 | C2 | sing | 1.53Å | 1.56Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | O2 | sing | 1.43Å | 1.42Å | |
| O31 | C31 | sing | 1.43Å | 1.42Å | |
| C1 | O41 | sing | 1.43Å | 1.43Å | |
| O41 | C41 | sing | 1.43Å | 1.43Å | |
| C31 | C41 | sing | 1.53Å | 1.53Å | |
| C31 | C21 | sing | 1.53Å | 1.53Å | |
| O7 | C7 | doub | 1.21Å | 1.23Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C7 | N2 | sing | 1.35Å | 1.35Å | |
| C41 | C51 | sing | 1.53Å | 1.54Å | |
| N2 | C21 | sing | 1.47Å | 1.47Å | |
| C21 | C11 | sing | 1.53Å | 1.54Å | |
| C51 | C61 | sing | 1.53Å | 1.55Å | |
| C51 | O51 | sing | 1.43Å | 1.44Å | |
| C11 | O51 | sing | 1.43Å | 1.45Å | |
| C11 | O1 | sing | 1.43Å | 1.43Å | |
| C61 | O61 | sing | 1.43Å | 1.45Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C51 | H51 | sing | 1.09Å | 1.10Å | |
| C61 | H611 | sing | 1.09Å | 1.10Å | |
| C61 | H621 | sing | 1.09Å | 1.10Å | |
| O61 | HO61 | sing | 0.97Å | 0.95Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| O31 | HO31 | sing | 0.97Å | 0.95Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| C8 | H83 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C4 | C5 | 110.1° | 109.5° |
| O4 | C4 | C3 | 107.3° | 109.5° |
| O4 | C4 | H4 | 110.2° | 109.5° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| O6 | C6 | C5 | 110.6° | 109.4° |
| O6 | C6 | H62 | 109.2° | 109.5° |
| O6 | C6 | H61 | 109.2° | 109.5° |
| C6 | O6 | HO6 | 109.5° | 113.9° |
| C6 | C5 | C4 | 111.4° | 109.5° |
| C6 | C5 | O5 | 108.6° | 109.5° |
| C6 | C5 | H5 | 109.3° | 109.5° |
| C5 | C6 | H62 | 109.2° | 109.5° |
| C5 | C6 | H61 | 109.2° | 109.5° |
| C5 | C4 | C3 | 111.9° | 109.2° |
| C4 | C5 | O5 | 107.7° | 109.4° |
| C4 | C5 | H5 | 109.1° | 109.5° |
| C5 | C4 | H4 | 108.8° | 109.6° |
| C4 | C3 | O3 | 110.8° | 109.5° |
| C4 | C3 | C2 | 110.8° | 109.1° |
| C3 | C4 | H4 | 108.6° | 109.5° |
| C4 | C3 | H3 | 106.4° | 109.5° |
| O3 | C3 | C2 | 114.7° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| O3 | C3 | H3 | 107.4° | 109.5° |
| C5 | O5 | C1 | 113.0° | 114.1° |
| O5 | C5 | H5 | 110.7° | 109.5° |
| O5 | C1 | C2 | 110.5° | 109.5° |
| O5 | C1 | O41 | 107.6° | 109.5° |
| O5 | C1 | H1 | 110.4° | 109.5° |
| C3 | C2 | C1 | 112.2° | 109.1° |
| C3 | C2 | O2 | 112.8° | 109.5° |
| C2 | C3 | H3 | 106.3° | 109.7° |
| C3 | C2 | H2 | 106.8° | 109.5° |
| C1 | C2 | O2 | 108.9° | 109.6° |
| C2 | C1 | O41 | 108.7° | 109.4° |
| C2 | C1 | H1 | 109.2° | 109.4° |
| C1 | C2 | H2 | 107.2° | 109.5° |
| O2 | C2 | H2 | 108.6° | 109.6° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| O31 | C31 | C41 | 110.5° | 109.5° |
| O31 | C31 | C21 | 110.8° | 109.5° |
| O31 | C31 | H31 | 109.9° | 109.6° |
| C31 | O31 | HO31 | 109.5° | 114.0° |
| C1 | O41 | C41 | 117.7° | 114.0° |
| O41 | C1 | H1 | 110.5° | 109.5° |
| O41 | C41 | C31 | 112.5° | 109.6° |
| O41 | C41 | C51 | 111.3° | 109.5° |
| O41 | C41 | H41 | 108.7° | 109.5° |
| C41 | C31 | C21 | 108.8° | 109.0° |
| C31 | C41 | C51 | 109.4° | 109.1° |
| C31 | C41 | H41 | 107.4° | 109.6° |
| C41 | C31 | H31 | 108.4° | 109.6° |
| C31 | C21 | N2 | 115.8° | 109.6° |
| C31 | C21 | C11 | 103.5° | 109.2° |
| C21 | C31 | H31 | 108.4° | 109.6° |
| C31 | C21 | H21 | 108.3° | 109.5° |
| O7 | C7 | C8 | 120.9° | 120.0° |
| O7 | C7 | N2 | 123.0° | 120.0° |
| C8 | C7 | N2 | 116.1° | 120.0° |
| C7 | C8 | H83 | 109.5° | 109.5° |
| C7 | C8 | H82 | 109.5° | 109.5° |
| C7 | C8 | H81 | 109.4° | 109.5° |
| C7 | N2 | C21 | 125.6° | 120.0° |
| C7 | N2 | HN2 | 117.2° | 120.0° |
| C41 | C51 | C61 | 115.6° | 109.5° |
| C41 | C51 | O51 | 106.7° | 109.4° |
| C41 | C51 | H51 | 107.7° | 109.6° |
| C51 | C41 | H41 | 107.3° | 109.6° |
| N2 | C21 | C11 | 111.6° | 109.5° |
| N2 | C21 | H21 | 109.1° | 109.5° |
| C21 | N2 | HN2 | 117.2° | 120.0° |
| C21 | C11 | O51 | 111.1° | 109.4° |
| C21 | C11 | O1 | 113.0° | 109.5° |
| C21 | C11 | H11 | 106.7° | 109.5° |
| C11 | C21 | H21 | 108.2° | 109.5° |
| C61 | C51 | O51 | 110.1° | 109.5° |
| C51 | C61 | O61 | 112.4° | 109.4° |
| C61 | C51 | H51 | 107.6° | 109.4° |
| C51 | C61 | H611 | 108.7° | 109.4° |
| C51 | C61 | H621 | 108.7° | 109.4° |
| C51 | O51 | C11 | 113.4° | 114.1° |
| O51 | C51 | H51 | 109.0° | 109.5° |
| O51 | C11 | O1 | 110.0° | 109.5° |
| O51 | C11 | H11 | 107.8° | 109.5° |
| O1 | C11 | H11 | 108.0° | 109.5° |
| C11 | O1 | HO1 | 109.5° | 114.0° |
| O61 | C61 | H611 | 108.7° | 109.5° |
| O61 | C61 | H621 | 108.7° | 109.5° |
| C61 | O61 | HO61 | 109.5° | 114.0° |
| H62 | C6 | H61 | 109.5° | 109.5° |
| H611 | C61 | H621 | 109.5° | 109.5° |
| H83 | C8 | H82 | 109.5° | 109.4° |
| H83 | C8 | H81 | 109.4° | 109.5° |
| H82 | C8 | H81 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C4 | C5 | C6 | 57.7° | 57.7° |
| O4 | C4 | C5 | C3 | 119.2° | 119.9° |
| O4 | C4 | C5 | H4 | 120.8° | 120.2° |
| O4 | C4 | C3 | H4 | 119.1° | 120.1° |
| O4 | C4 | C3 | O3 | 55.5° | 56.9° |
| O4 | C4 | C5 | O5 | 61.2° | 62.3° |
| O4 | C4 | C3 | C2 | 73.0° | 62.9° |
| O4 | C4 | C5 | H5 | 178.5° | 177.7° |
| O4 | C4 | C3 | H3 | 171.9° | 177.1° |
| O6 | C6 | C5 | H62 | 120.2° | 120.0° |
| O6 | C6 | C5 | H61 | 120.1° | 120.0° |
| O6 | C6 | C5 | C4 | 68.4° | 175.1° |
| O6 | C6 | C5 | O5 | 173.2° | 65.0° |
| O6 | C6 | C5 | H5 | 52.3° | 55.0° |
| O6 | C6 | H62 | H61 | 119.5° | 120.0° |
| C6 | C5 | C4 | O5 | 118.9° | 120.0° |
| C6 | C5 | C4 | H5 | 120.8° | 120.1° |
| C6 | C5 | C4 | C3 | 176.9° | 177.6° |
| C6 | C5 | O5 | H5 | 120.0° | 120.1° |
| C6 | C5 | O5 | C1 | 172.5° | 178.9° |
| C5 | C6 | H62 | H61 | 119.5° | 120.0° |
| C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
| C6 | C5 | C4 | H4 | 63.1° | 62.5° |
| C5 | C4 | C3 | H4 | 120.1° | 119.9° |
| C5 | C4 | C3 | O3 | 176.3° | 176.8° |
| C4 | C5 | O5 | H5 | 119.2° | 120.0° |
| C4 | C5 | O5 | C1 | 66.8° | 61.2° |
| C5 | C4 | C3 | C2 | 47.9° | 57.0° |
| C4 | C5 | C6 | H62 | 171.4° | 55.1° |
| C4 | C5 | C6 | H61 | 51.7° | 64.9° |
| C5 | C4 | O4 | HO4 | 180.0° | 180.0° |
| C5 | C4 | C3 | H3 | 67.2° | 63.0° |
| C4 | C3 | O3 | C2 | 126.3° | 119.6° |
| C4 | C3 | O3 | H3 | 115.9° | 120.1° |
| C3 | C4 | C5 | O5 | 57.9° | 57.6° |
| C4 | C3 | C2 | H3 | 115.2° | 119.9° |
| C4 | C3 | C2 | C1 | 44.0° | 56.9° |
| C4 | C3 | C2 | O2 | 167.5° | 176.9° |
| C4 | C3 | O3 | HO3 | 180.0° | 180.0° |
| C3 | C4 | C5 | H5 | 62.3° | 62.4° |
| C3 | C4 | O4 | HO4 | 58.0° | 60.3° |
| C4 | C3 | C2 | H2 | 73.2° | 62.9° |
| O3 | C3 | C2 | H3 | 118.5° | 120.2° |
| O3 | C3 | C2 | C1 | 170.4° | 176.8° |
| O3 | C3 | C2 | O2 | 66.1° | 63.3° |
| O3 | C3 | C4 | H4 | 63.6° | 63.2° |
| O3 | C3 | C2 | H2 | 53.1° | 57.0° |
| C5 | O5 | C1 | C2 | 64.0° | 61.2° |
| C5 | O5 | C1 | O41 | 177.5° | 178.9° |
| C5 | O5 | C1 | H1 | 56.8° | 58.8° |
| O5 | C5 | C6 | H62 | 53.0° | 175.0° |
| O5 | C5 | C6 | H61 | 66.7° | 55.0° |
| O5 | C5 | C4 | H4 | 178.0° | 177.5° |
| O5 | C1 | C2 | C3 | 50.6° | 57.6° |
| O5 | C1 | C2 | O41 | 117.9° | 120.0° |
| O5 | C1 | C2 | H1 | 121.5° | 120.0° |
| O5 | C1 | C2 | O2 | 176.3° | 177.5° |
| O5 | C1 | O41 | H1 | 120.6° | 120.1° |
| O5 | C1 | O41 | C41 | 93.1° | 70.3° |
| C1 | O5 | C5 | H5 | 52.5° | 58.8° |
| O5 | C1 | C2 | H2 | 66.4° | 62.3° |
| C3 | C2 | C1 | O2 | 125.7° | 119.9° |
| C3 | C2 | C1 | H2 | 117.0° | 119.8° |
| C3 | C2 | O2 | H2 | 118.2° | 120.2° |
| C3 | C2 | C1 | O41 | 168.5° | 177.6° |
| C2 | C3 | O3 | HO3 | 53.7° | 60.4° |
| C3 | C2 | C1 | H1 | 70.9° | 62.4° |
| C2 | C3 | C4 | H4 | 168.0° | 176.9° |
| C3 | C2 | O2 | HO2 | 180.0° | 180.0° |
| C1 | C2 | O2 | H2 | 116.4° | 120.2° |
| C2 | C1 | O41 | H1 | 119.8° | 120.0° |
| C2 | C1 | O41 | C41 | 147.2° | 169.7° |
| C1 | C2 | C3 | H3 | 71.2° | 63.0° |
| C1 | C2 | O2 | HO2 | 54.7° | 60.3° |
| O2 | C2 | C1 | O41 | 65.9° | 62.5° |
| O2 | C2 | C1 | H1 | 54.7° | 57.5° |
| O2 | C2 | C3 | H3 | 52.3° | 57.0° |
| O31 | C31 | C41 | O41 | 50.2° | 63.2° |
| O31 | C31 | C41 | C21 | 121.8° | 119.8° |
| O31 | C31 | C41 | H31 | 120.5° | 120.2° |
| O31 | C31 | C21 | H31 | 120.7° | 120.2° |
| O31 | C31 | C41 | C51 | 174.4° | 176.9° |
| O31 | C31 | C21 | N2 | 54.2° | 63.3° |
| O31 | C31 | C21 | C11 | 176.5° | 176.8° |
| O31 | C31 | C41 | H41 | 69.4° | 56.9° |
| O31 | C31 | C21 | H21 | 68.8° | 56.9° |
| C1 | O41 | C41 | C31 | 95.1° | 139.7° |
| C1 | O41 | C41 | C51 | 141.7° | 100.7° |
| O41 | C1 | C2 | H2 | 51.5° | 57.7° |
| C1 | O41 | C41 | H41 | 23.7° | 19.5° |
| O41 | C41 | C31 | C51 | 124.2° | 119.9° |
| O41 | C41 | C31 | H41 | 119.5° | 120.1° |
| O41 | C41 | C31 | C21 | 172.0° | 176.9° |
| O41 | C41 | C51 | H41 | 118.8° | 120.1° |
| O41 | C41 | C51 | C61 | 53.3° | 62.5° |
| O41 | C41 | C51 | O51 | 176.1° | 177.6° |
| C41 | O41 | C1 | H1 | 27.4° | 49.8° |
| O41 | C41 | C51 | H51 | 67.0° | 57.5° |
| O41 | C41 | C31 | H31 | 70.3° | 57.0° |
| C41 | C31 | C21 | H31 | 117.7° | 119.9° |
| C31 | C41 | C51 | H41 | 116.3° | 119.9° |
| C41 | C31 | C21 | N2 | 175.8° | 176.9° |
| C41 | C31 | C21 | C11 | 61.8° | 57.0° |
| C31 | C41 | C51 | C61 | 178.2° | 177.6° |
| C31 | C41 | C51 | O51 | 59.0° | 57.7° |
| C31 | C41 | C51 | H51 | 57.9° | 62.4° |
| C41 | C31 | O31 | HO31 | 123.5° | 180.0° |
| C41 | C31 | C21 | H21 | 52.9° | 62.9° |
| C31 | C21 | N2 | C7 | 85.3° | 155.0° |
| C21 | C31 | C41 | C51 | 63.8° | 57.0° |
| C31 | C21 | N2 | C11 | 118.0° | 119.7° |
| C31 | C21 | N2 | H21 | 122.5° | 120.2° |
| C31 | C21 | C11 | H21 | 114.8° | 119.9° |
| C31 | C21 | C11 | O51 | 61.5° | 57.6° |
| C31 | C21 | C11 | O1 | 174.4° | 177.6° |
| C31 | C21 | C11 | H11 | 55.8° | 62.4° |
| C21 | C31 | C41 | H41 | 52.5° | 62.9° |
| C21 | C31 | O31 | HO31 | 2.8° | 60.5° |
| C31 | C21 | N2 | HN2 | 94.7° | 24.9° |
| O7 | C7 | C8 | N2 | 178.5° | 180.0° |
| O7 | C7 | N2 | C21 | 8.0° | 0.0° |
| O7 | C7 | N2 | HN2 | 172.0° | 180.0° |
| O7 | C7 | C8 | H83 | 0.0° | 90.0° |
| O7 | C7 | C8 | H82 | 120.0° | 30.0° |
| O7 | C7 | C8 | H81 | 120.0° | 150.0° |
| C8 | C7 | N2 | C21 | 170.5° | 180.0° |
| C8 | C7 | N2 | HN2 | 9.5° | 0.1° |
| C7 | C8 | H83 | H82 | 120.0° | 120.0° |
| C7 | C8 | H83 | H81 | 120.0° | 120.1° |
| C7 | C8 | H82 | H81 | 120.0° | 120.1° |
| C7 | N2 | C21 | HN2 | 180.0° | 179.9° |
| C7 | N2 | C21 | C11 | 156.7° | 85.3° |
| C7 | N2 | C21 | H21 | 37.2° | 34.8° |
| N2 | C7 | C8 | H83 | 178.5° | 90.0° |
| N2 | C7 | C8 | H82 | 61.5° | 150.0° |
| N2 | C7 | C8 | H81 | 58.5° | 30.0° |
| C41 | C51 | C61 | O51 | 121.0° | 119.9° |
| C41 | C51 | C61 | H51 | 120.4° | 120.1° |
| C41 | C51 | O51 | H51 | 116.0° | 120.1° |
| C41 | C51 | O51 | C11 | 59.6° | 61.2° |
| C41 | C51 | C61 | O61 | 165.3° | 174.9° |
| C41 | C51 | C61 | H611 | 74.3° | 54.9° |
| C41 | C51 | C61 | H621 | 44.8° | 65.2° |
| C51 | C41 | C31 | H31 | 53.9° | 62.9° |
| N2 | C21 | C11 | H21 | 120.1° | 120.1° |
| N2 | C21 | C11 | O51 | 173.4° | 177.6° |
| N2 | C21 | C11 | O1 | 49.3° | 62.4° |
| N2 | C21 | C11 | H11 | 69.3° | 57.6° |
| N2 | C21 | C31 | H31 | 66.5° | 57.0° |
| C21 | C11 | O51 | C51 | 64.0° | 61.2° |
| C21 | C11 | O51 | O1 | 125.8° | 120.0° |
| C21 | C11 | O51 | H11 | 116.6° | 120.0° |
| C21 | C11 | O1 | H11 | 117.8° | 120.0° |
| C21 | C11 | O1 | HO1 | 180.0° | 179.9° |
| C11 | C21 | C31 | H31 | 55.9° | 62.9° |
| C11 | C21 | N2 | HN2 | 23.2° | 94.8° |
| C61 | C51 | O51 | H51 | 117.8° | 120.0° |
| C61 | C51 | O51 | C11 | 174.3° | 178.8° |
| C51 | C61 | O61 | H611 | 120.4° | 120.0° |
| C51 | C61 | O61 | H621 | 120.4° | 119.9° |
| C51 | C61 | H611 | H621 | 118.7° | 120.0° |
| C51 | C61 | O61 | HO61 | 180.0° | 180.0° |
| C61 | C51 | C41 | H41 | 65.5° | 57.7° |
| C51 | O51 | C11 | O1 | 170.1° | 178.8° |
| O51 | C51 | C61 | O61 | 44.3° | 65.2° |
| C51 | O51 | C11 | H11 | 52.6° | 58.8° |
| O51 | C51 | C61 | H611 | 164.7° | 174.8° |
| O51 | C51 | C61 | H621 | 76.1° | 54.7° |
| O51 | C51 | C41 | H41 | 57.3° | 62.3° |
| O51 | C11 | O1 | H11 | 117.4° | 120.0° |
| O51 | C11 | O1 | HO1 | 55.3° | 60.0° |
| C11 | O51 | C51 | H51 | 56.5° | 58.9° |
| O51 | C11 | C21 | H21 | 53.3° | 62.3° |
| O1 | C11 | C21 | H21 | 70.8° | 57.7° |
| O61 | C61 | C51 | H51 | 74.4° | 54.8° |
| O61 | C61 | H611 | H621 | 118.7° | 120.1° |
| HO3 | O3 | C3 | H3 | 64.1° | 59.8° |
| H1 | C1 | C2 | H2 | 172.1° | 177.7° |
| H5 | C5 | C6 | H62 | 67.9° | 64.9° |
| H5 | C5 | C6 | H61 | 172.4° | 175.0° |
| H5 | C5 | C4 | H4 | 57.7° | 57.5° |
| H62 | C6 | O6 | HO6 | 59.8° | 60.0° |
| H61 | C6 | O6 | HO6 | 59.9° | 60.0° |
| H4 | C4 | O4 | HO4 | 60.1° | 59.8° |
| H4 | C4 | C3 | H3 | 52.9° | 56.9° |
| H3 | C3 | C2 | H2 | 171.6° | 177.2° |
| H2 | C2 | O2 | HO2 | 61.8° | 59.9° |
| H11 | C11 | O1 | HO1 | 62.1° | 60.1° |
| H11 | C11 | C21 | H21 | 170.6° | 177.7° |
| H51 | C51 | C61 | H611 | 46.0° | 65.2° |
| H51 | C51 | C61 | H621 | 165.2° | 174.8° |
| H51 | C51 | C41 | H41 | 174.2° | 177.6° |
| H611 | C61 | O61 | HO61 | 59.6° | 60.0° |
| H621 | C61 | O61 | HO61 | 59.6° | 60.1° |
| H41 | C41 | C31 | H31 | 170.2° | 177.1° |
| H31 | C31 | O31 | HO31 | 116.9° | 59.8° |
| H31 | C31 | C21 | H21 | 170.6° | 177.2° |
| H21 | C21 | N2 | HN2 | 142.8° | 145.1° |
| H83 | C8 | H82 | H81 | 120.0° | 120.0° |
