NOY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | H4 | sing | 0.97Å | 0.95Å | |
| O4 | C4 | sing | 1.43Å | 1.42Å | |
| C4 | C5 | sing | 1.54Å | 1.55Å | |
| C4 | HA | sing | 1.10Å | 1.11Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.10Å | 1.12Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| O3 | HB | sing | 0.97Å | 0.95Å | |
| C2 | N | sing | 1.46Å | 1.48Å | |
| C2 | O2 | sing | 1.43Å | 1.42Å | |
| C2 | H12 | sing | 1.10Å | 1.10Å | |
| N | C7 | sing | 1.46Å | 1.46Å | |
| N | H | sing | 1.02Å | 1.02Å | |
| C7 | C5 | sing | 1.53Å | 1.53Å | |
| C7 | H7C1 | sing | 1.10Å | 1.11Å | |
| C7 | H7C2 | sing | 1.10Å | 1.12Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | H5 | sing | 1.10Å | 1.12Å | |
| C6 | H6C1 | sing | 1.09Å | 1.12Å | |
| C6 | H6C2 | sing | 1.09Å | 1.11Å | |
| C6 | O6 | sing | 1.41Å | 13.10Å | |
| O2 | H22 | sing | 0.97Å | 0.95Å | |
| O6 | H6C3 | sing | 0.97Å | 13.72Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| H4 | O4 | C4 | 109.4° | 106.4° |
| O4 | C4 | C5 | 110.9° | 110.2° |
| O4 | C4 | HA | 108.3° | 106.9° |
| O4 | C4 | C3 | 109.4° | 107.8° |
| C5 | C4 | HA | 109.1° | 110.7° |
| C5 | C4 | C3 | 108.6° | 110.9° |
| C4 | C5 | C7 | 108.4° | 110.5° |
| C4 | C5 | C6 | 113.5° | 111.8° |
| C4 | C5 | H5 | 107.8° | 108.7° |
| HA | C4 | C3 | 110.6° | 110.2° |
| C4 | C3 | C2 | 110.8° | 112.0° |
| C4 | C3 | H3 | 107.0° | 111.0° |
| C4 | C3 | O3 | 110.9° | 107.7° |
| C2 | C3 | H3 | 110.3° | 110.9° |
| C2 | C3 | O3 | 107.6° | 108.8° |
| C3 | C2 | N | 111.2° | 111.5° |
| C3 | C2 | O2 | 107.1° | 108.2° |
| C3 | C2 | H12 | 109.7° | 110.5° |
| H3 | C3 | O3 | 110.3° | 106.1° |
| C3 | O3 | HB | 110.9° | 106.2° |
| N | C2 | O2 | 108.9° | 110.6° |
| N | C2 | H12 | 108.0° | 110.1° |
| C2 | N | C7 | 118.2° | 111.7° |
| C2 | N | H | 121.4° | 108.9° |
| O2 | C2 | H12 | 112.0° | 105.9° |
| C2 | O2 | H22 | 109.5° | 106.4° |
| C7 | N | H | 120.4° | 109.1° |
| N | C7 | C5 | 109.5° | 111.3° |
| N | C7 | H7C1 | 112.2° | 108.5° |
| N | C7 | H7C2 | 112.2° | 109.9° |
| C5 | C7 | H7C1 | 112.2° | 109.7° |
| C5 | C7 | H7C2 | 112.2° | 110.7° |
| C7 | C5 | C6 | 110.5° | 110.1° |
| C7 | C5 | H5 | 111.0° | 109.2° |
| H7C1 | C7 | H7C2 | 98.2° | 106.5° |
| C6 | C5 | H5 | 105.6° | 106.5° |
| C5 | C6 | H6C1 | 110.7° | 109.7° |
| C5 | C6 | H6C2 | 110.7° | 109.7° |
| C5 | C6 | O6 | 123.2° | 108.4° |
| H6C1 | C6 | H6C2 | 99.6° | 110.0° |
| H6C1 | C6 | O6 | 37.3° | 109.5° |
| H6C2 | C6 | O6 | 62.2° | 109.6° |
| C6 | O6 | H6C3 | 4.0° | 107.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| H4 | O4 | C4 | C5 | 60.3° | 88.4° |
| H4 | O4 | C4 | HA | 59.4° | 31.9° |
| H4 | O4 | C4 | C3 | 180.0° | 150.4° |
| O4 | C4 | C5 | HA | 119.2° | 118.0° |
| O4 | C4 | C5 | C3 | 120.2° | 119.3° |
| O4 | C4 | HA | C3 | 119.9° | 116.9° |
| O4 | C4 | C3 | C2 | 179.3° | 170.9° |
| O4 | C4 | C3 | H3 | 60.4° | 46.4° |
| O4 | C4 | C3 | O3 | 59.9° | 69.4° |
| O4 | C4 | C5 | C7 | 177.0° | 170.6° |
| O4 | C4 | C5 | C6 | 53.7° | 66.5° |
| O4 | C4 | C5 | H5 | 62.8° | 50.8° |
| C5 | C4 | HA | C3 | 119.4° | 123.1° |
| C5 | C4 | C3 | C2 | 59.6° | 50.2° |
| C5 | C4 | C3 | H3 | 60.7° | 74.3° |
| C5 | C4 | C3 | O3 | 179.0° | 169.9° |
| C4 | C5 | C7 | N | 57.5° | 56.4° |
| C4 | C5 | C7 | C6 | 125.0° | 123.9° |
| C4 | C5 | C7 | H5 | 118.2° | 119.5° |
| C4 | C5 | C7 | H7C1 | 67.8° | 176.6° |
| C4 | C5 | C7 | H7C2 | 177.3° | 66.2° |
| C4 | C5 | C6 | H5 | 117.9° | 118.5° |
| C4 | C5 | C6 | H6C1 | 54.7° | 176.9° |
| C4 | C5 | C6 | H6C2 | 54.7° | 62.2° |
| C4 | C5 | C6 | O6 | 14.9° | 57.4° |
| HA | C4 | C3 | C2 | 60.1° | 72.7° |
| HA | C4 | C3 | H3 | 179.6° | 162.7° |
| HA | C4 | C3 | O3 | 59.3° | 46.9° |
| HA | C4 | C5 | C7 | 57.8° | 71.4° |
| HA | C4 | C5 | C6 | 65.5° | 51.6° |
| HA | C4 | C5 | H5 | 178.0° | 168.8° |
| C4 | C3 | C2 | H3 | 118.3° | 124.6° |
| C4 | C3 | C2 | O3 | 121.3° | 119.0° |
| C4 | C3 | H3 | O3 | 120.7° | 116.8° |
| C4 | C3 | O3 | HB | 180.0° | 145.2° |
| C4 | C3 | C2 | N | 50.6° | 53.5° |
| C4 | C3 | C2 | O2 | 169.4° | 175.3° |
| C4 | C3 | C2 | H12 | 68.8° | 69.3° |
| C3 | C4 | C5 | C7 | 62.8° | 51.3° |
| C3 | C4 | C5 | C6 | 173.9° | 174.3° |
| C3 | C4 | C5 | H5 | 57.4° | 68.5° |
| C2 | C3 | H3 | O3 | 118.7° | 118.1° |
| C2 | C3 | O3 | HB | 58.7° | 23.6° |
| C3 | C2 | N | O2 | 117.8° | 120.4° |
| C3 | C2 | N | H12 | 120.4° | 123.0° |
| C3 | C2 | O2 | H12 | 120.4° | 118.4° |
| C3 | C2 | N | C7 | 48.5° | 58.4° |
| C3 | C2 | N | H | 131.5° | 62.0° |
| C3 | C2 | O2 | H22 | 162.2° | 81.3° |
| H3 | C3 | O3 | HB | 61.7° | 95.8° |
| H3 | C3 | C2 | N | 67.7° | 71.1° |
| H3 | C3 | C2 | O2 | 51.1° | 50.7° |
| H3 | C3 | C2 | H12 | 172.9° | 166.1° |
| O3 | C3 | C2 | N | 172.0° | 172.5° |
| O3 | C3 | C2 | O2 | 69.2° | 65.7° |
| O3 | C3 | C2 | H12 | 52.5° | 49.7° |
| N | C2 | O2 | H12 | 119.4° | 119.2° |
| C2 | N | C7 | H | 180.0° | 120.4° |
| C2 | N | C7 | C5 | 52.2° | 60.3° |
| C2 | N | C7 | H7C1 | 73.1° | 178.9° |
| C2 | N | C7 | H7C2 | 177.4° | 62.7° |
| N | C2 | O2 | H22 | 41.9° | 41.1° |
| O2 | C2 | N | C7 | 166.3° | 178.8° |
| O2 | C2 | N | H | 13.7° | 58.4° |
| H12 | C2 | N | C7 | 71.9° | 64.5° |
| H12 | C2 | N | H | 108.1° | 175.0° |
| H12 | C2 | O2 | H22 | 77.5° | 160.3° |
| N | C7 | C5 | H7C1 | 125.3° | 120.1° |
| N | C7 | C5 | H7C2 | 125.3° | 122.6° |
| N | C7 | H7C1 | H7C2 | 118.1° | 118.3° |
| N | C7 | C5 | C6 | 177.5° | 179.6° |
| N | C7 | C5 | H5 | 60.7° | 63.0° |
| H | N | C7 | C5 | 127.8° | 60.0° |
| H | N | C7 | H7C1 | 106.9° | 60.8° |
| H | N | C7 | H7C2 | 2.5° | 176.9° |
| C5 | C7 | H7C1 | H7C2 | 118.1° | 119.9° |
| C7 | C5 | C6 | H5 | 120.1° | 118.3° |
| C7 | C5 | C6 | H6C1 | 67.4° | 59.9° |
| C7 | C5 | C6 | H6C2 | 176.8° | 61.0° |
| C7 | C5 | C6 | O6 | 107.2° | 179.5° |
| H7C1 | C7 | C5 | C6 | 57.2° | 59.5° |
| H7C1 | C7 | C5 | H5 | 174.0° | 57.1° |
| H7C2 | C7 | C5 | C6 | 52.2° | 57.8° |
| H7C2 | C7 | C5 | H5 | 64.5° | 174.4° |
| C5 | C6 | H6C1 | H6C2 | 116.6° | 120.7° |
| C5 | C6 | H6C1 | O6 | 118.0° | 118.8° |
| C5 | C6 | H6C2 | O6 | 117.5° | 118.8° |
| C5 | C6 | O6 | H6C3 | 163.9° | 7.5° |
| H5 | C5 | C6 | H6C1 | 172.6° | 58.4° |
| H5 | C5 | C6 | H6C2 | 63.1° | 179.3° |
| H5 | C5 | C6 | O6 | 132.8° | 61.2° |
| H6C1 | C6 | H6C2 | O6 | 1.0° | 120.4° |
| H6C1 | C6 | O6 | H6C3 | 83.2° | 112.1° |
| H6C2 | C6 | O6 | H6C3 | 98.4° | 127.2° |
