SGV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | doub | 1.32Å | 1.35Å | Aromatic |
| N1 | C6 | sing | 1.33Å | 1.35Å | Aromatic |
| C2 | N3 | sing | 1.32Å | 1.35Å | Aromatic |
| N3 | C4 | doub | 1.33Å | 1.36Å | Aromatic |
| C4 | C5 | sing | 1.40Å | 1.46Å | Aromatic |
| C4 | N9 | sing | 1.37Å | 1.33Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.48Å | Aromatic |
| C5 | C7 | sing | 1.47Å | 1.35Å | Aromatic |
| C6 | N6 | sing | 1.38Å | 1.34Å | |
| C7 | C8 | doub | 1.36Å | 1.35Å | Aromatic |
| C7 | C10 | sing | 1.47Å | 1.49Å | |
| C8 | N9 | sing | 1.36Å | 1.34Å | Aromatic |
| N9 | C1' | sing | 1.46Å | 1.47Å | |
| C1' | C2' | sing | 1.55Å | 1.52Å | |
| C1' | O4' | sing | 1.44Å | 1.43Å | |
| C10 | N11 | sing | 1.35Å | 1.33Å | |
| C10 | O12 | doub | 1.22Å | 1.22Å | |
| C2' | O2' | sing | 1.43Å | 1.42Å | |
| C2' | C3' | sing | 1.55Å | 1.51Å | |
| C3' | O3' | sing | 1.43Å | 1.43Å | |
| C3' | C4' | sing | 1.54Å | 1.53Å | |
| C4' | O4' | sing | 1.44Å | 1.43Å | |
| C4' | C5' | sing | 1.53Å | 1.53Å | |
| C5' | O5' | sing | 1.43Å | 1.43Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å | |
| N6 | HN6A | sing | 0.97Å | 1.00Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C1' | H1' | sing | 1.09Å | 1.10Å | |
| N11 | HN11 | sing | 0.97Å | 1.00Å | |
| N11 | HN1A | sing | 0.97Å | 1.00Å | |
| C2' | H2' | sing | 1.09Å | 1.10Å | |
| O2' | HO2' | sing | 0.97Å | 0.95Å | |
| C3' | H3' | sing | 1.09Å | 1.10Å | |
| O3' | HO3' | sing | 0.97Å | 0.95Å | |
| C4' | H4' | sing | 1.09Å | 1.10Å | |
| C5' | H5' | sing | 1.09Å | 1.10Å | |
| C5' | H5'A | sing | 1.09Å | 1.10Å | |
| O5' | HO5' | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C6 | 121.8° | 120.9° |
| N1 | C2 | N3 | 122.3° | 122.7° |
| N1 | C2 | H2 | 118.8° | 118.6° |
| N1 | C6 | C5 | 119.0° | 118.4° |
| N1 | C6 | N6 | 120.8° | 120.9° |
| C2 | N3 | C4 | 121.6° | 120.7° |
| N3 | C2 | H2 | 118.8° | 118.7° |
| N3 | C4 | C5 | 119.2° | 118.5° |
| N3 | C4 | N9 | 135.1° | 134.1° |
| C5 | C4 | N9 | 105.7° | 107.4° |
| C4 | C5 | C6 | 116.1° | 118.8° |
| C4 | C5 | C7 | 106.8° | 106.1° |
| C4 | N9 | C8 | 109.5° | 110.5° |
| C4 | N9 | C1' | 125.2° | 124.7° |
| C6 | C5 | C7 | 137.1° | 135.1° |
| C5 | C6 | N6 | 120.2° | 120.8° |
| C5 | C7 | C8 | 107.4° | 106.3° |
| C5 | C7 | C10 | 127.3° | 126.8° |
| C6 | N6 | HN6 | 109.5° | 120.0° |
| C6 | N6 | HN6A | 109.4° | 120.0° |
| C8 | C7 | C10 | 125.2° | 126.9° |
| C7 | C8 | N9 | 110.6° | 109.7° |
| C7 | C8 | H8 | 124.7° | 125.2° |
| C7 | C10 | N11 | 119.0° | 120.0° |
| C7 | C10 | O12 | 119.6° | 120.0° |
| C8 | N9 | C1' | 125.3° | 124.8° |
| N9 | C8 | H8 | 124.7° | 125.2° |
| N9 | C1' | C2' | 103.2° | 110.6° |
| N9 | C1' | O4' | 111.7° | 110.6° |
| N9 | C1' | H1' | 111.7° | 110.6° |
| C2' | C1' | O4' | 107.8° | 103.4° |
| C1' | C2' | O2' | 110.5° | 110.9° |
| C1' | C2' | C3' | 103.8° | 102.1° |
| C2' | C1' | H1' | 115.3° | 110.6° |
| C1' | C2' | H2' | 113.5° | 110.9° |
| C1' | O4' | C4' | 110.2° | 107.0° |
| O4' | C1' | H1' | 107.3° | 110.7° |
| N11 | C10 | O12 | 121.4° | 120.0° |
| C10 | N11 | HN11 | 120.0° | 120.0° |
| C10 | N11 | HN1A | 120.0° | 120.0° |
| O2' | C2' | C3' | 112.3° | 110.9° |
| O2' | C2' | H2' | 105.2° | 110.8° |
| C2' | O2' | HO2' | 109.5° | 114.0° |
| C2' | C3' | O3' | 111.8° | 110.5° |
| C2' | C3' | C4' | 103.7° | 104.2° |
| C3' | C2' | H2' | 111.8° | 110.9° |
| C2' | C3' | H3' | 112.9° | 110.5° |
| O3' | C3' | C4' | 112.7° | 110.5° |
| O3' | C3' | H3' | 104.0° | 110.4° |
| C3' | O3' | HO3' | 109.5° | 113.9° |
| C3' | C4' | O4' | 105.8° | 107.3° |
| C3' | C4' | C5' | 115.7° | 109.9° |
| C4' | C3' | H3' | 112.0° | 110.6° |
| C3' | C4' | H4' | 108.2° | 109.9° |
| O4' | C4' | C5' | 110.5° | 109.9° |
| O4' | C4' | H4' | 113.6° | 109.9° |
| C4' | C5' | O5' | 112.2° | 109.5° |
| C5' | C4' | H4' | 103.3° | 109.9° |
| C4' | C5' | H5' | 108.6° | 109.5° |
| C4' | C5' | H5'A | 108.5° | 109.4° |
| O5' | C5' | H5' | 108.6° | 109.5° |
| O5' | C5' | H5'A | 108.6° | 109.5° |
| C5' | O5' | HO5' | 109.5° | 114.0° |
| HN6 | N6 | HN6A | 109.5° | 120.0° |
| HN11 | N11 | HN1A | 120.0° | 120.0° |
| H5' | C5' | H5'A | 110.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C2 | N3 | H2 | 180.0° | 179.9° |
| N1 | C2 | N3 | C4 | 0.0° | 0.1° |
| C2 | N1 | C6 | C5 | 0.1° | 0.1° |
| C2 | N1 | C6 | N6 | 179.9° | 180.0° |
| C6 | N1 | C2 | N3 | 0.1° | 0.0° |
| N1 | C6 | C5 | C4 | 0.0° | 0.0° |
| N1 | C6 | C5 | N6 | 180.0° | 179.9° |
| N1 | C6 | C5 | C7 | 179.9° | 180.0° |
| C6 | N1 | C2 | H2 | 180.0° | 179.9° |
| N1 | C6 | N6 | HN6 | 0.0° | 12.7° |
| N1 | C6 | N6 | HN6A | 120.0° | 167.2° |
| C2 | N3 | C4 | C5 | 0.1° | 0.1° |
| C2 | N3 | C4 | N9 | 179.8° | 180.0° |
| N3 | C4 | C5 | N9 | 179.8° | 179.9° |
| N3 | C4 | C5 | C6 | 0.1° | 0.0° |
| N3 | C4 | C5 | C7 | 180.0° | 179.9° |
| N3 | C4 | N9 | C8 | 180.0° | 179.9° |
| N3 | C4 | N9 | C1' | 0.8° | 0.1° |
| C4 | N3 | C2 | H2 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 179.9° | 179.9° |
| C4 | C5 | C6 | N6 | 180.0° | 180.0° |
| C4 | C5 | C7 | C8 | 0.0° | 0.0° |
| C4 | C5 | C7 | C10 | 179.9° | 180.0° |
| C5 | C4 | N9 | C8 | 0.3° | 0.0° |
| C5 | C4 | N9 | C1' | 179.5° | 180.0° |
| N9 | C4 | C5 | C6 | 179.8° | 179.9° |
| N9 | C4 | C5 | C7 | 0.2° | 0.0° |
| C4 | N9 | C8 | C7 | 0.3° | 0.1° |
| C4 | N9 | C8 | C1' | 179.2° | 180.0° |
| C4 | N9 | C1' | C2' | 92.0° | 85.0° |
| C4 | N9 | C1' | O4' | 152.5° | 161.0° |
| C4 | N9 | C8 | H8 | 179.7° | 180.0° |
| C4 | N9 | C1' | H1' | 32.4° | 37.9° |
| C6 | C5 | C7 | C8 | 180.0° | 180.0° |
| C6 | C5 | C7 | C10 | 0.0° | 0.1° |
| C5 | C6 | N6 | HN6 | 180.0° | 167.2° |
| C5 | C6 | N6 | HN6A | 60.0° | 12.9° |
| C7 | C5 | C6 | N6 | 0.1° | 0.1° |
| C5 | C7 | C8 | C10 | 180.0° | 179.9° |
| C5 | C7 | C8 | N9 | 0.2° | 0.1° |
| C5 | C7 | C10 | N11 | 155.2° | 146.4° |
| C5 | C7 | C10 | O12 | 24.9° | 33.6° |
| C5 | C7 | C8 | H8 | 179.8° | 180.0° |
| C6 | N6 | HN6 | HN6A | 120.0° | 179.9° |
| C7 | C8 | N9 | H8 | 180.0° | 180.0° |
| C7 | C8 | N9 | C1' | 179.5° | 180.0° |
| C8 | C7 | C10 | N11 | 24.9° | 33.7° |
| C8 | C7 | C10 | O12 | 155.0° | 146.3° |
| C10 | C7 | C8 | N9 | 179.9° | 180.0° |
| C7 | C10 | N11 | O12 | 179.9° | 180.0° |
| C10 | C7 | C8 | H8 | 0.1° | 0.1° |
| C7 | C10 | N11 | HN11 | 179.9° | 0.0° |
| C7 | C10 | N11 | HN1A | 0.1° | 179.9° |
| C8 | N9 | C1' | C2' | 87.1° | 95.0° |
| C8 | N9 | C1' | O4' | 28.4° | 19.1° |
| C8 | N9 | C1' | H1' | 148.5° | 142.1° |
| N9 | C1' | C2' | O4' | 118.3° | 118.5° |
| N9 | C1' | C2' | H1' | 122.0° | 122.9° |
| N9 | C1' | O4' | H1' | 122.6° | 123.0° |
| N9 | C1' | C2' | O2' | 139.2° | 86.3° |
| N9 | C1' | C2' | C3' | 100.2° | 155.5° |
| N9 | C1' | O4' | C4' | 112.6° | 158.5° |
| C1' | N9 | C8 | H8 | 0.5° | 0.0° |
| N9 | C1' | C2' | H2' | 21.3° | 37.3° |
| C2' | C1' | O4' | H1' | 124.7° | 118.5° |
| C1' | C2' | O2' | C3' | 115.3° | 112.7° |
| C1' | C2' | O2' | H2' | 122.9° | 123.6° |
| C1' | C2' | C3' | H2' | 122.7° | 118.2° |
| C1' | C2' | C3' | O3' | 149.5° | 97.8° |
| C1' | C2' | C3' | C4' | 27.8° | 20.9° |
| C2' | C1' | O4' | C4' | 0.1° | 40.0° |
| C1' | C2' | O2' | HO2' | 180.0° | 180.0° |
| C1' | C2' | C3' | H3' | 93.7° | 139.7° |
| O4' | C1' | C2' | O2' | 102.5° | 155.2° |
| O4' | C1' | C2' | C3' | 18.0° | 37.0° |
| C1' | O4' | C4' | C3' | 17.9° | 26.5° |
| C1' | O4' | C4' | C5' | 143.8° | 146.0° |
| O4' | C1' | C2' | H2' | 139.6° | 81.2° |
| C1' | O4' | C4' | H4' | 100.7° | 92.9° |
| C10 | N11 | HN11 | HN1A | 180.0° | 179.9° |
| O12 | C10 | N11 | HN11 | 0.0° | 179.9° |
| O12 | C10 | N11 | HN1A | 180.0° | 0.0° |
| O2' | C2' | C3' | H2' | 118.0° | 123.6° |
| O2' | C2' | C3' | O3' | 30.1° | 20.4° |
| O2' | C2' | C3' | C4' | 91.5° | 139.1° |
| O2' | C2' | C1' | H1' | 17.2° | 36.6° |
| O2' | C2' | C3' | H3' | 147.0° | 102.1° |
| C2' | C3' | O3' | C4' | 116.4° | 114.8° |
| C2' | C3' | O3' | H3' | 122.1° | 122.5° |
| C2' | C3' | C4' | H3' | 122.0° | 118.7° |
| C2' | C3' | C4' | O4' | 28.5° | 2.0° |
| C2' | C3' | C4' | C5' | 151.2° | 121.5° |
| C3' | C2' | C1' | H1' | 137.8° | 81.6° |
| C3' | C2' | O2' | HO2' | 64.7° | 67.3° |
| C2' | C3' | O3' | HO3' | 180.0° | 180.0° |
| C2' | C3' | C4' | H4' | 93.5° | 117.4° |
| O3' | C3' | C4' | H3' | 116.8° | 122.6° |
| O3' | C3' | C4' | O4' | 149.6° | 120.7° |
| O3' | C3' | C4' | C5' | 87.6° | 119.8° |
| O3' | C3' | C2' | H2' | 87.8° | 144.0° |
| O3' | C3' | C4' | H4' | 27.6° | 1.3° |
| C3' | C4' | O4' | C5' | 126.0° | 119.5° |
| C3' | C4' | O4' | H4' | 118.5° | 119.4° |
| C3' | C4' | C5' | H4' | 118.0° | 121.1° |
| C3' | C4' | C5' | O5' | 38.6° | 175.0° |
| C4' | C3' | C2' | H2' | 150.5° | 97.3° |
| C4' | C3' | O3' | HO3' | 63.6° | 65.2° |
| C3' | C4' | C5' | H5' | 158.6° | 54.9° |
| C3' | C4' | C5' | H5'A | 81.4° | 65.0° |
| O4' | C4' | C5' | H4' | 121.8° | 121.1° |
| O4' | C4' | C5' | O5' | 81.7° | 67.1° |
| C4' | O4' | C1' | H1' | 124.8° | 78.5° |
| O4' | C4' | C3' | H3' | 93.6° | 116.7° |
| O4' | C4' | C5' | H5' | 38.4° | 172.8° |
| O4' | C4' | C5' | H5'A | 158.3° | 52.8° |
| C4' | C5' | O5' | H5' | 120.0° | 120.0° |
| C4' | C5' | O5' | H5'A | 120.0° | 119.9° |
| C5' | C4' | C3' | H3' | 29.2° | 2.8° |
| C4' | C5' | H5' | H5'A | 118.8° | 120.0° |
| C4' | C5' | O5' | HO5' | 180.0° | 179.9° |
| O5' | C5' | C4' | H4' | 156.5° | 53.9° |
| O5' | C5' | H5' | H5'A | 118.9° | 120.0° |
| H1' | C1' | C2' | H2' | 100.7° | 160.2° |
| H2' | C2' | O2' | HO2' | 57.1° | 56.4° |
| H2' | C2' | C3' | H3' | 29.0° | 21.5° |
| H3' | C3' | O3' | HO3' | 57.9° | 57.5° |
| H3' | C3' | C4' | H4' | 144.4° | 123.9° |
| H4' | C4' | C5' | H5' | 83.4° | 66.1° |
| H4' | C4' | C5' | H5'A | 36.5° | 173.9° |
| H5' | C5' | O5' | HO5' | 60.0° | 60.0° |
| H5'A | C5' | O5' | HO5' | 60.0° | 60.0° |
