ZCZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C1 | O5 | sing | 1.43Å | 1.41Å | |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | O2 | sing | 1.43Å | 1.40Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | C2M | sing | 1.43Å | 1.40Å | |
| C2M | H2M1 | sing | 1.09Å | 1.10Å | |
| C2M | H2M2 | sing | 1.09Å | 1.10Å | |
| C2M | H2M3 | sing | 1.09Å | 1.10Å | |
| C3 | O3 | sing | 1.43Å | 1.45Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | N4 | sing | 1.47Å | 1.51Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | O5 | sing | 1.43Å | 1.45Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.53Å | 1.54Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C6 | H63 | sing | 1.09Å | 1.10Å | |
| N4 | C7 | sing | 1.35Å | 1.35Å | |
| N4 | H4N1 | sing | 0.97Å | 1.00Å | |
| C7 | O7 | doub | 1.21Å | 1.23Å | |
| C7 | C8 | sing | 1.51Å | 1.53Å | |
| C8 | O8 | sing | 1.43Å | 1.40Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| O8 | H8O | sing | 0.97Å | 0.95Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | C10 | sing | 1.53Å | 1.47Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | O10 | sing | 1.43Å | 1.44Å | |
| O10 | H10O | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | H1 | 108.4° | 109.5° |
| C1 | O1 | HO1 | 109.5° | 113.9° |
| O1 | C1 | O5 | 109.8° | 109.6° |
| O1 | C1 | C2 | 102.5° | 109.5° |
| H1 | C1 | O5 | 108.7° | 109.5° |
| H1 | C1 | C2 | 107.2° | 109.4° |
| O5 | C1 | C2 | 119.7° | 109.4° |
| C1 | O5 | C5 | 119.3° | 114.1° |
| C1 | C2 | O2 | 113.0° | 109.5° |
| C1 | C2 | C3 | 104.7° | 109.1° |
| C1 | C2 | H2 | 106.7° | 109.5° |
| O2 | C2 | C3 | 116.8° | 109.5° |
| O2 | C2 | H2 | 108.3° | 109.5° |
| C2 | O2 | C2M | 118.9° | 114.0° |
| C3 | C2 | H2 | 106.6° | 109.6° |
| C2 | C3 | O3 | 112.1° | 109.5° |
| C2 | C3 | C4 | 108.5° | 109.0° |
| C2 | C3 | H3 | 106.6° | 109.5° |
| O2 | C2M | H2M1 | 109.5° | 109.5° |
| O2 | C2M | H2M2 | 109.5° | 109.5° |
| O2 | C2M | H2M3 | 109.5° | 109.5° |
| H2M1 | C2M | H2M2 | 109.4° | 109.5° |
| H2M1 | C2M | H2M3 | 109.5° | 109.4° |
| H2M2 | C2M | H2M3 | 109.5° | 109.5° |
| O3 | C3 | C4 | 114.8° | 109.5° |
| O3 | C3 | H3 | 107.6° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 114.1° |
| C4 | C3 | H3 | 106.8° | 109.6° |
| C3 | C4 | N4 | 114.1° | 109.5° |
| C3 | C4 | C5 | 111.8° | 109.2° |
| C3 | C4 | H4 | 107.7° | 109.5° |
| N4 | C4 | C5 | 107.8° | 109.5° |
| N4 | C4 | H4 | 107.8° | 109.5° |
| C4 | N4 | C7 | 108.8° | 120.0° |
| C4 | N4 | H4N1 | 125.6° | 120.0° |
| C5 | C4 | H4 | 107.4° | 109.6° |
| C4 | C5 | O5 | 117.0° | 109.4° |
| C4 | C5 | H5 | 106.5° | 109.5° |
| C4 | C5 | C6 | 111.6° | 109.5° |
| O5 | C5 | H5 | 107.6° | 109.5° |
| O5 | C5 | C6 | 107.2° | 109.5° |
| H5 | C5 | C6 | 106.4° | 109.5° |
| C5 | C6 | H61 | 109.5° | 109.5° |
| C5 | C6 | H62 | 109.4° | 109.5° |
| C5 | C6 | H63 | 109.5° | 109.5° |
| H61 | C6 | H62 | 109.5° | 109.5° |
| H61 | C6 | H63 | 109.5° | 109.4° |
| H62 | C6 | H63 | 109.5° | 109.5° |
| C7 | N4 | H4N1 | 125.6° | 120.0° |
| N4 | C7 | O7 | 105.8° | 120.0° |
| N4 | C7 | C8 | 140.0° | 120.0° |
| O7 | C7 | C8 | 114.1° | 120.1° |
| C7 | C8 | O8 | 119.3° | 109.5° |
| C7 | C8 | H8 | 103.0° | 109.5° |
| C7 | C8 | C9 | 110.3° | 109.5° |
| O8 | C8 | H8 | 104.2° | 109.5° |
| C8 | O8 | H8O | 109.5° | 114.0° |
| O8 | C8 | C9 | 114.8° | 109.4° |
| H8 | C8 | C9 | 103.0° | 109.5° |
| C8 | C9 | H91 | 107.6° | 109.5° |
| C8 | C9 | H92 | 107.6° | 109.5° |
| C8 | C9 | C10 | 116.8° | 109.5° |
| H91 | C9 | H92 | 109.5° | 109.5° |
| H91 | C9 | C10 | 107.6° | 109.5° |
| H92 | C9 | C10 | 107.6° | 109.5° |
| C9 | C10 | H101 | 110.3° | 109.5° |
| C9 | C10 | H102 | 110.4° | 109.5° |
| C9 | C10 | O10 | 105.9° | 109.5° |
| H101 | C10 | H102 | 109.4° | 109.5° |
| H101 | C10 | O10 | 110.4° | 109.4° |
| H102 | C10 | O10 | 110.4° | 109.5° |
| C10 | O10 | H10O | 109.5° | 114.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | H1 | O5 | 119.3° | 120.1° |
| O1 | C1 | H1 | C2 | 110.0° | 120.0° |
| O1 | C1 | O5 | C2 | 118.1° | 120.0° |
| O1 | C1 | C2 | O2 | 160.8° | 177.7° |
| O1 | C1 | C2 | C3 | 71.0° | 62.4° |
| O1 | C1 | C2 | H2 | 41.8° | 57.6° |
| O1 | C1 | O5 | C5 | 89.9° | 58.8° |
| H1 | C1 | O1 | HO1 | 66.9° | 60.0° |
| H1 | C1 | O5 | C2 | 123.5° | 119.9° |
| H1 | C1 | C2 | O2 | 46.8° | 57.7° |
| H1 | C1 | C2 | C3 | 175.0° | 177.6° |
| H1 | C1 | C2 | H2 | 72.2° | 62.5° |
| H1 | C1 | O5 | C5 | 151.6° | 178.9° |
| HO1 | O1 | C1 | O5 | 51.7° | 60.1° |
| HO1 | O1 | C1 | C2 | 180.0° | 180.0° |
| O5 | C1 | C2 | O2 | 77.4° | 62.2° |
| O5 | C1 | C2 | C3 | 50.8° | 57.7° |
| O5 | C1 | C2 | H2 | 163.6° | 177.6° |
| C1 | O5 | C5 | C4 | 17.9° | 61.2° |
| C1 | O5 | C5 | H5 | 101.8° | 58.7° |
| C1 | O5 | C5 | C6 | 144.1° | 178.8° |
| C1 | C2 | O2 | C3 | 121.7° | 119.7° |
| C1 | C2 | O2 | H2 | 118.0° | 120.1° |
| C1 | C2 | C3 | H2 | 112.9° | 119.9° |
| C1 | C2 | O2 | C2M | 134.1° | 90.0° |
| C1 | C2 | C3 | O3 | 167.6° | 176.9° |
| C1 | C2 | C3 | C4 | 64.5° | 57.0° |
| C1 | C2 | C3 | H3 | 50.2° | 63.0° |
| C2 | C1 | O5 | C5 | 28.1° | 61.2° |
| O2 | C2 | C3 | H2 | 121.2° | 120.2° |
| C2 | O2 | C2M | H2M1 | 180.0° | 60.0° |
| C2 | O2 | C2M | H2M2 | 60.0° | 60.0° |
| C2 | O2 | C2M | H2M3 | 60.0° | 180.0° |
| O2 | C2 | C3 | O3 | 66.5° | 57.0° |
| O2 | C2 | C3 | C4 | 61.4° | 62.9° |
| O2 | C2 | C3 | H3 | 176.1° | 177.1° |
| C3 | C2 | O2 | C2M | 12.4° | 150.3° |
| C2 | C3 | O3 | C4 | 124.5° | 119.5° |
| C2 | C3 | O3 | H3 | 116.9° | 120.2° |
| C2 | C3 | C4 | H3 | 114.5° | 119.9° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.0° |
| C2 | C3 | C4 | N4 | 178.6° | 176.9° |
| C2 | C3 | C4 | C5 | 58.8° | 57.0° |
| C2 | C3 | C4 | H4 | 59.0° | 63.0° |
| H2 | C2 | O2 | C2M | 107.9° | 30.1° |
| H2 | C2 | C3 | O3 | 54.7° | 63.2° |
| H2 | C2 | C3 | C4 | 177.4° | 176.9° |
| H2 | C2 | C3 | H3 | 62.7° | 56.9° |
| O2 | C2M | H2M1 | H2M2 | 120.0° | 120.0° |
| O2 | C2M | H2M1 | H2M3 | 120.0° | 120.0° |
| O2 | C2M | H2M2 | H2M3 | 120.0° | 120.1° |
| H2M1 | C2M | H2M2 | H2M3 | 120.0° | 119.9° |
| O3 | C3 | C4 | H3 | 119.1° | 120.2° |
| O3 | C3 | C4 | N4 | 52.3° | 63.3° |
| O3 | C3 | C4 | C5 | 174.9° | 176.9° |
| O3 | C3 | C4 | H4 | 67.3° | 56.9° |
| C4 | C3 | O3 | HO3 | 55.5° | 179.5° |
| C3 | C4 | N4 | C5 | 124.8° | 119.7° |
| C3 | C4 | N4 | H4 | 119.5° | 120.1° |
| C3 | C4 | C5 | H4 | 118.0° | 120.0° |
| C3 | C4 | C5 | O5 | 33.8° | 57.6° |
| C3 | C4 | C5 | H5 | 86.4° | 62.3° |
| C3 | C4 | C5 | C6 | 157.9° | 177.6° |
| C3 | C4 | N4 | C7 | 138.1° | 155.0° |
| C3 | C4 | N4 | H4N1 | 41.9° | 25.0° |
| H3 | C3 | O3 | HO3 | 63.2° | 60.2° |
| H3 | C3 | C4 | N4 | 66.9° | 57.0° |
| H3 | C3 | C4 | C5 | 55.8° | 62.9° |
| H3 | C3 | C4 | H4 | 173.6° | 177.1° |
| N4 | C4 | C5 | H4 | 115.9° | 120.2° |
| N4 | C4 | C5 | O5 | 160.0° | 177.5° |
| N4 | C4 | C5 | H5 | 39.7° | 57.5° |
| N4 | C4 | C5 | C6 | 76.0° | 62.5° |
| C4 | N4 | C7 | H4N1 | 180.0° | 180.0° |
| C4 | N4 | C7 | O7 | 0.1° | 0.0° |
| C4 | N4 | C7 | C8 | 179.7° | 180.0° |
| C4 | C5 | O5 | H5 | 119.7° | 120.0° |
| C4 | C5 | O5 | C6 | 126.2° | 120.0° |
| C4 | C5 | H5 | C6 | 119.2° | 120.1° |
| C4 | C5 | C6 | H61 | 180.0° | 59.9° |
| C4 | C5 | C6 | H62 | 60.0° | 180.0° |
| C4 | C5 | C6 | H63 | 60.0° | 60.0° |
| C5 | C4 | N4 | C7 | 97.1° | 85.3° |
| C5 | C4 | N4 | H4N1 | 82.9° | 94.7° |
| H4 | C4 | C5 | O5 | 84.1° | 62.3° |
| H4 | C4 | C5 | H5 | 155.6° | 177.7° |
| H4 | C4 | C5 | C6 | 39.9° | 57.7° |
| H4 | C4 | N4 | C7 | 18.6° | 34.9° |
| H4 | C4 | N4 | H4N1 | 161.4° | 145.1° |
| O5 | C5 | H5 | C6 | 114.7° | 120.0° |
| O5 | C5 | C6 | H61 | 50.6° | 60.0° |
| O5 | C5 | C6 | H62 | 170.6° | 60.1° |
| O5 | C5 | C6 | H63 | 69.4° | 179.9° |
| H5 | C5 | C6 | H61 | 64.3° | 180.0° |
| H5 | C5 | C6 | H62 | 55.7° | 60.0° |
| H5 | C5 | C6 | H63 | 175.7° | 60.1° |
| C5 | C6 | H61 | H62 | 120.0° | 120.1° |
| C5 | C6 | H61 | H63 | 120.0° | 120.0° |
| C5 | C6 | H62 | H63 | 120.0° | 120.0° |
| H61 | C6 | H62 | H63 | 120.0° | 119.9° |
| N4 | C7 | O7 | C8 | 179.9° | 180.0° |
| N4 | C7 | C8 | O8 | 69.9° | 175.0° |
| N4 | C7 | C8 | H8 | 175.4° | 55.1° |
| N4 | C7 | C8 | C9 | 66.1° | 65.0° |
| H4N1 | N4 | C7 | O7 | 179.9° | 180.0° |
| H4N1 | N4 | C7 | C8 | 0.3° | 0.0° |
| O7 | C7 | C8 | O8 | 110.3° | 5.0° |
| O7 | C7 | C8 | H8 | 4.4° | 125.0° |
| O7 | C7 | C8 | C9 | 113.7° | 114.9° |
| C7 | C8 | O8 | H8 | 114.0° | 120.0° |
| C7 | C8 | O8 | C9 | 134.2° | 120.0° |
| C7 | C8 | H8 | C9 | 114.7° | 120.1° |
| C7 | C8 | O8 | H8O | 180.0° | 59.9° |
| C7 | C8 | C9 | H91 | 5.0° | 65.0° |
| C7 | C8 | C9 | H92 | 112.9° | 55.0° |
| C7 | C8 | C9 | C10 | 126.0° | 175.0° |
| O8 | C8 | H8 | C9 | 120.1° | 120.0° |
| O8 | C8 | C9 | H91 | 133.2° | 55.0° |
| O8 | C8 | C9 | H92 | 108.9° | 175.0° |
| O8 | C8 | C9 | C10 | 12.2° | 65.0° |
| H8 | C8 | O8 | H8O | 66.0° | 179.9° |
| H8 | C8 | C9 | H91 | 114.3° | 175.0° |
| H8 | C8 | C9 | H92 | 3.6° | 65.0° |
| H8 | C8 | C9 | C10 | 124.7° | 55.0° |
| H8O | O8 | C8 | C9 | 45.8° | 60.1° |
| C8 | C9 | H91 | H92 | 116.7° | 120.0° |
| C8 | C9 | H91 | C10 | 126.6° | 120.0° |
| C8 | C9 | H92 | C10 | 126.7° | 120.0° |
| C8 | C9 | C10 | H101 | 124.0° | 60.0° |
| C8 | C9 | C10 | H102 | 2.9° | 60.0° |
| C8 | C9 | C10 | O10 | 116.5° | 180.0° |
| H91 | C9 | H92 | C10 | 116.7° | 120.0° |
| H91 | C9 | C10 | H101 | 114.9° | NaN° |
| H91 | C9 | C10 | H102 | 124.0° | 60.0° |
| H91 | C9 | C10 | O10 | 4.5° | 60.0° |
| H92 | C9 | C10 | H101 | 3.0° | 60.0° |
| H92 | C9 | C10 | H102 | 118.1° | 180.0° |
| H92 | C9 | C10 | O10 | 122.4° | 60.0° |
| C9 | C10 | H101 | H102 | 121.7° | 120.0° |
| C9 | C10 | H101 | O10 | 116.7° | 120.0° |
| C9 | C10 | H102 | O10 | 116.7° | 120.0° |
| C9 | C10 | O10 | H10O | 180.0° | 180.0° |
| H101 | C10 | H102 | O10 | 121.7° | 120.0° |
| H101 | C10 | O10 | H10O | 60.6° | 60.0° |
| H102 | C10 | O10 | H10O | 60.6° | 59.9° |
