N1L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | O5 | sing | 1.43Å | 1.48Å | |
| C1 | O1 | sing | 1.43Å | 1.45Å | |
| C2 | C3 | sing | 1.53Å | 1.56Å | |
| C2 | N2 | sing | 1.47Å | 1.49Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | O3 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| C4 | O4 | sing | 1.43Å | 1.47Å | |
| C5 | C6 | sing | 1.51Å | 1.53Å | |
| C5 | O5 | sing | 1.43Å | 1.50Å | |
| C6 | O6B | sing | 1.34Å | 1.47Å | |
| C6 | O6A | doub | 1.21Å | 1.45Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| N2 | H21N | sing | 1.01Å | 1.00Å | |
| N2 | H22N | sing | 1.01Å | 1.00Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O6B | HO6B | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O5 | 118.0° | 109.4° |
| C2 | C1 | O1 | 110.7° | 109.5° |
| C1 | C2 | C3 | 106.8° | 109.1° |
| C1 | C2 | N2 | 102.9° | 109.5° |
| C2 | C1 | H1 | 103.4° | 109.5° |
| C1 | C2 | H2 | 110.3° | 109.6° |
| O5 | C1 | O1 | 114.1° | 109.5° |
| C1 | O5 | C5 | 111.9° | 114.1° |
| O5 | C1 | H1 | 104.3° | 109.4° |
| O1 | C1 | H1 | 104.5° | 109.5° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| C3 | C2 | N2 | 114.8° | 109.5° |
| C2 | C3 | C4 | 112.7° | 109.1° |
| C2 | C3 | O3 | 113.0° | 109.5° |
| C3 | C2 | H2 | 110.3° | 109.5° |
| C2 | C3 | H3 | 106.0° | 109.5° |
| N2 | C2 | H2 | 111.4° | 109.6° |
| C2 | N2 | H21N | 109.5° | 111.0° |
| C2 | N2 | H22N | 109.4° | 111.0° |
| C4 | C3 | O3 | 111.1° | 109.6° |
| C3 | C4 | C5 | 110.2° | 109.1° |
| C3 | C4 | O4 | 113.6° | 109.5° |
| C4 | C3 | H3 | 106.0° | 109.6° |
| C3 | C4 | H4 | 106.6° | 109.5° |
| O3 | C3 | H3 | 107.6° | 109.6° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C5 | C4 | O4 | 111.6° | 109.5° |
| C4 | C5 | C6 | 117.4° | 109.5° |
| C4 | C5 | O5 | 115.3° | 109.4° |
| C5 | C4 | H4 | 106.7° | 109.5° |
| C4 | C5 | H5 | 104.6° | 109.5° |
| O4 | C4 | H4 | 107.7° | 109.6° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C6 | C5 | O5 | 108.2° | 109.5° |
| C5 | C6 | O6B | 112.7° | 120.0° |
| C5 | C6 | O6A | 112.4° | 120.0° |
| C6 | C5 | H5 | 104.8° | 109.5° |
| O5 | C5 | H5 | 105.2° | 109.5° |
| O6B | C6 | O6A | 114.2° | 120.0° |
| C6 | O6B | HO6B | 109.5° | 117.0° |
| H21N | N2 | H22N | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O5 | O1 | 132.7° | 119.9° |
| C2 | C1 | O5 | H1 | 114.0° | 120.0° |
| C2 | C1 | O1 | H1 | 110.8° | 120.1° |
| C1 | C2 | C3 | N2 | 113.3° | 119.9° |
| C1 | C2 | C3 | H2 | 119.9° | 119.9° |
| C1 | C2 | N2 | H2 | 118.2° | 120.2° |
| C1 | C2 | C3 | C4 | 54.0° | 57.0° |
| C1 | C2 | C3 | O3 | 179.0° | 176.9° |
| C2 | C1 | O5 | C5 | 50.5° | 61.2° |
| C2 | C1 | O1 | HO1 | 180.0° | 180.0° |
| C1 | C2 | C3 | H3 | 61.5° | 62.9° |
| C1 | C2 | N2 | H21N | 180.0° | 60.0° |
| C1 | C2 | N2 | H22N | 60.0° | 176.0° |
| O5 | C1 | O1 | H1 | 113.2° | 120.0° |
| O5 | C1 | C2 | C3 | 53.4° | 57.6° |
| O5 | C1 | C2 | N2 | 174.6° | 177.5° |
| C1 | O5 | C5 | C4 | 47.4° | 61.2° |
| C1 | O5 | C5 | C6 | 178.8° | 178.9° |
| O5 | C1 | C2 | H2 | 66.5° | 62.3° |
| O5 | C1 | O1 | HO1 | 44.0° | 60.1° |
| C1 | O5 | C5 | H5 | 67.2° | 58.8° |
| O1 | C1 | C2 | C3 | 172.5° | 177.6° |
| O1 | C1 | C2 | N2 | 51.3° | 62.6° |
| O1 | C1 | O5 | C5 | 176.8° | 178.9° |
| O1 | C1 | C2 | H2 | 67.7° | 57.7° |
| C3 | C2 | N2 | H2 | 126.2° | 120.1° |
| C2 | C3 | C4 | O3 | 128.0° | 119.9° |
| C2 | C3 | C4 | H3 | 115.5° | 119.9° |
| C2 | C3 | O3 | H3 | 116.6° | 120.2° |
| C2 | C3 | C4 | C5 | 54.3° | 57.0° |
| C2 | C3 | C4 | O4 | 179.6° | 176.9° |
| C3 | C2 | C1 | H1 | 61.1° | 62.4° |
| C3 | C2 | N2 | H21N | 64.4° | 179.7° |
| C3 | C2 | N2 | H22N | 55.6° | 56.4° |
| C2 | C3 | C4 | H4 | 61.1° | 62.9° |
| C2 | C3 | O3 | HO3 | 180.0° | 180.0° |
| N2 | C2 | C3 | C4 | 167.3° | 176.9° |
| N2 | C2 | C3 | O3 | 65.7° | 63.2° |
| N2 | C2 | C1 | H1 | 60.1° | 57.5° |
| N2 | C2 | C3 | H3 | 51.9° | 57.0° |
| C2 | N2 | H21N | H22N | 120.0° | 124.0° |
| C4 | C3 | O3 | H3 | 115.6° | 120.2° |
| C3 | C4 | C5 | O4 | 127.2° | 119.9° |
| C3 | C4 | C5 | H4 | 115.3° | 119.9° |
| C3 | C4 | O4 | H4 | 117.9° | 120.2° |
| C3 | C4 | C5 | C6 | 179.4° | 177.6° |
| C3 | C4 | C5 | O5 | 50.1° | 57.6° |
| C4 | C3 | C2 | H2 | 65.9° | 62.9° |
| C4 | C3 | O3 | HO3 | 52.2° | 60.4° |
| C3 | C4 | C5 | H5 | 64.9° | 62.4° |
| C3 | C4 | O4 | HO4 | 165.7° | 180.0° |
| O3 | C3 | C4 | C5 | 177.7° | 176.9° |
| O3 | C3 | C4 | O4 | 51.6° | 63.2° |
| O3 | C3 | C2 | H2 | 61.1° | 57.0° |
| O3 | C3 | C4 | H4 | 66.9° | 57.0° |
| C5 | C4 | O4 | H4 | 116.8° | 120.2° |
| C4 | C5 | C6 | O5 | 132.6° | 119.9° |
| C4 | C5 | C6 | H5 | 115.5° | 120.0° |
| C4 | C5 | O5 | H5 | 114.7° | 119.9° |
| C4 | C5 | C6 | O6B | 110.8° | 65.0° |
| C4 | C5 | C6 | O6A | 20.0° | 115.0° |
| C5 | C4 | C3 | H3 | 61.2° | 62.9° |
| C5 | C4 | O4 | HO4 | 40.4° | 60.3° |
| O4 | C4 | C5 | C6 | 53.4° | 62.5° |
| O4 | C4 | C5 | O5 | 177.3° | 177.5° |
| O4 | C4 | C3 | H3 | 64.9° | 57.0° |
| O4 | C4 | C5 | H5 | 62.3° | 57.5° |
| C6 | C5 | O5 | H5 | 111.6° | 120.1° |
| C5 | C6 | O6B | O6A | 129.9° | 180.0° |
| C6 | C5 | C4 | H4 | 64.1° | 57.7° |
| C5 | C6 | O6B | HO6B | 129.9° | 180.0° |
| O5 | C5 | C6 | O6B | 21.8° | 175.1° |
| O5 | C5 | C6 | O6A | 152.6° | 4.9° |
| C5 | O5 | C1 | H1 | 63.5° | 58.8° |
| O5 | C5 | C4 | H4 | 65.3° | 62.3° |
| O6B | C6 | C5 | H5 | 133.7° | 55.0° |
| O6A | C6 | C5 | H5 | 95.5° | 125.0° |
| O6A | C6 | O6B | HO6B | 0.0° | 0.0° |
| H1 | C1 | C2 | H2 | 179.1° | 177.8° |
| H1 | C1 | O1 | HO1 | 69.2° | 59.9° |
| H2 | C2 | C3 | H3 | 178.6° | 177.2° |
| H2 | C2 | N2 | H21N | 61.8° | 60.2° |
| H2 | C2 | N2 | H22N | 178.2° | 63.7° |
| H3 | C3 | C4 | H4 | 176.6° | 177.2° |
| H3 | C3 | O3 | HO3 | 63.4° | 59.8° |
| H4 | C4 | C5 | H5 | 179.7° | 177.8° |
| H4 | C4 | O4 | HO4 | 76.4° | 59.8° |
