ZUZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C10 | C5 | sing | 1.53Å | 1.53Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.51Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C4 | N1 | sing | 1.35Å | 1.35Å | |
| C4 | O3 | doub | 1.21Å | 1.23Å | |
| N1 | C3 | sing | 1.47Å | 1.45Å | |
| C3 | C2 | sing | 1.51Å | 1.50Å | |
| C2 | O1 | sing | 1.34Å | 1.33Å | |
| C2 | O2 | doub | 1.21Å | 1.20Å | |
| O1 | C1 | sing | 1.45Å | 1.45Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| C3 | H15 | sing | 1.09Å | 1.10Å | |
| C9 | H16 | sing | 1.09Å | 1.10Å | |
| C9 | H17 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C9 | C8 | 112.7° | 109.5° |
| C9 | C10 | C5 | 113.9° | 109.5° |
| C9 | C10 | H9 | 108.3° | 109.5° |
| C9 | C10 | H10 | 108.3° | 109.5° |
| C10 | C9 | H16 | 108.7° | 109.5° |
| C10 | C9 | H17 | 108.7° | 109.4° |
| C9 | C8 | C7 | 111.8° | 109.5° |
| C9 | C8 | H7 | 108.9° | 109.4° |
| C9 | C8 | H8 | 108.9° | 109.5° |
| C8 | C9 | H16 | 108.7° | 109.5° |
| C8 | C9 | H17 | 108.7° | 109.5° |
| C10 | C5 | C4 | 110.3° | 109.5° |
| C10 | C5 | C6 | 111.1° | 109.5° |
| C10 | C5 | H2 | 107.1° | 109.5° |
| C5 | C10 | H9 | 108.3° | 109.4° |
| C5 | C10 | H10 | 108.3° | 109.4° |
| C8 | C7 | C6 | 113.8° | 109.5° |
| C8 | C7 | H5 | 108.4° | 109.5° |
| C8 | C7 | H6 | 108.4° | 109.5° |
| C7 | C8 | H7 | 108.9° | 109.5° |
| C7 | C8 | H8 | 108.8° | 109.5° |
| C4 | C5 | C6 | 113.6° | 109.5° |
| C5 | C4 | N1 | 117.3° | 120.0° |
| C5 | C4 | O3 | 121.5° | 120.0° |
| C4 | C5 | H2 | 107.3° | 109.5° |
| C5 | C6 | C7 | 112.4° | 109.5° |
| C6 | C5 | H2 | 107.1° | 109.5° |
| C5 | C6 | H3 | 108.7° | 109.5° |
| C5 | C6 | H4 | 108.8° | 109.5° |
| C7 | C6 | H3 | 108.8° | 109.4° |
| C7 | C6 | H4 | 108.7° | 109.5° |
| C6 | C7 | H5 | 108.4° | 109.5° |
| C6 | C7 | H6 | 108.4° | 109.5° |
| N1 | C4 | O3 | 121.1° | 120.0° |
| C4 | N1 | C3 | 122.4° | 120.0° |
| C4 | N1 | H1 | 118.8° | 120.0° |
| N1 | C3 | C2 | 112.4° | 109.4° |
| C3 | N1 | H1 | 118.8° | 120.0° |
| N1 | C3 | H14 | 108.7° | 109.5° |
| N1 | C3 | H15 | 108.8° | 109.5° |
| C3 | C2 | O1 | 110.9° | 120.0° |
| C3 | C2 | O2 | 124.5° | 120.0° |
| C2 | C3 | H14 | 108.7° | 109.5° |
| C2 | C3 | H15 | 108.7° | 109.5° |
| O1 | C2 | O2 | 124.6° | 120.0° |
| C2 | O1 | C1 | 116.9° | 117.0° |
| O1 | C1 | H11 | 109.5° | 109.4° |
| O1 | C1 | H12 | 109.5° | 109.4° |
| O1 | C1 | H13 | 109.5° | 109.5° |
| H3 | C6 | H4 | 109.4° | 109.5° |
| H5 | C7 | H6 | 109.5° | 109.5° |
| H7 | C8 | H8 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.5° |
| H11 | C1 | H13 | 109.5° | 109.5° |
| H12 | C1 | H13 | 109.5° | 109.5° |
| H14 | C3 | H15 | 109.5° | 109.5° |
| H16 | C9 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C9 | C8 | H16 | 120.5° | 120.0° |
| C10 | C9 | C8 | H17 | 120.5° | 120.0° |
| C9 | C10 | C5 | H9 | 120.7° | 120.0° |
| C9 | C10 | C5 | H10 | 120.6° | 120.0° |
| C10 | C9 | C8 | C7 | 58.7° | 60.0° |
| C9 | C10 | C5 | C4 | 149.5° | 180.0° |
| C9 | C10 | C5 | C6 | 22.7° | 60.0° |
| C9 | C10 | C5 | H2 | 94.0° | 60.0° |
| C10 | C9 | C8 | H7 | 179.0° | 180.0° |
| C10 | C9 | C8 | H8 | 61.7° | 60.0° |
| C9 | C10 | H9 | H10 | 118.0° | 120.0° |
| C10 | C9 | H16 | H17 | 118.5° | 120.0° |
| C8 | C9 | C10 | C5 | 34.7° | 60.0° |
| C9 | C8 | C7 | H7 | 120.4° | 119.9° |
| C9 | C8 | C7 | H8 | 120.4° | 120.0° |
| C9 | C8 | C7 | C6 | 22.0° | 60.0° |
| C9 | C8 | C7 | H5 | 98.7° | 60.0° |
| C9 | C8 | C7 | H6 | 142.6° | 180.0° |
| C9 | C8 | H7 | H8 | 118.9° | 120.0° |
| C8 | C9 | C10 | H9 | 86.0° | 60.0° |
| C8 | C9 | C10 | H10 | 155.3° | 180.0° |
| C8 | C9 | H16 | H17 | 118.6° | 120.1° |
| C10 | C5 | C4 | C6 | 125.4° | 120.0° |
| C10 | C5 | C4 | H2 | 116.4° | 120.0° |
| C10 | C5 | C6 | H2 | 116.7° | 120.0° |
| C10 | C5 | C6 | C7 | 59.3° | 60.0° |
| C10 | C5 | C4 | N1 | 125.0° | 60.0° |
| C10 | C5 | C4 | O3 | 51.9° | 120.0° |
| C10 | C5 | C6 | H3 | 179.7° | 180.0° |
| C10 | C5 | C6 | H4 | 61.2° | 60.0° |
| C5 | C10 | H9 | H10 | 118.0° | 120.0° |
| C5 | C10 | C9 | H16 | 85.8° | 60.0° |
| C5 | C10 | C9 | H17 | 155.2° | 180.0° |
| C8 | C7 | C6 | C5 | 35.6° | 60.0° |
| C8 | C7 | C6 | H5 | 120.7° | 120.0° |
| C8 | C7 | C6 | H6 | 120.6° | 120.0° |
| C8 | C7 | C6 | H3 | 156.1° | 180.0° |
| C8 | C7 | C6 | H4 | 84.8° | 60.0° |
| C8 | C7 | H5 | H6 | 118.0° | 120.0° |
| C7 | C8 | H7 | H8 | 118.9° | 120.1° |
| C7 | C8 | C9 | H16 | 61.8° | 59.9° |
| C7 | C8 | C9 | H17 | 179.2° | 180.0° |
| C4 | C5 | C6 | H2 | 118.3° | 120.0° |
| C4 | C5 | C6 | C7 | 175.7° | 180.0° |
| C5 | C4 | N1 | O3 | 176.9° | 180.0° |
| C5 | C4 | N1 | C3 | 164.3° | 180.0° |
| C5 | C4 | N1 | H1 | 15.7° | 0.3° |
| C4 | C5 | C6 | H3 | 55.2° | 60.0° |
| C4 | C5 | C6 | H4 | 63.9° | 60.0° |
| C4 | C5 | C10 | H9 | 89.8° | 60.0° |
| C4 | C5 | C10 | H10 | 28.9° | 60.0° |
| C5 | C6 | C7 | H3 | 120.4° | 120.0° |
| C5 | C6 | C7 | H4 | 120.5° | 120.0° |
| C6 | C5 | C4 | N1 | 109.6° | 180.0° |
| C6 | C5 | C4 | O3 | 73.5° | 0.0° |
| C5 | C6 | H3 | H4 | 118.7° | 120.0° |
| C5 | C6 | C7 | H5 | 156.3° | 60.0° |
| C5 | C6 | C7 | H6 | 85.0° | 180.0° |
| C6 | C5 | C10 | H9 | 143.3° | 60.0° |
| C6 | C5 | C10 | H10 | 98.0° | 180.0° |
| C7 | C6 | C5 | H2 | 57.4° | 60.0° |
| C7 | C6 | H3 | H4 | 118.6° | 120.0° |
| C6 | C7 | H5 | H6 | 118.0° | 120.0° |
| C6 | C7 | C8 | H7 | 142.3° | 180.0° |
| C6 | C7 | C8 | H8 | 98.4° | 60.0° |
| C4 | N1 | C3 | H1 | 180.0° | 179.7° |
| C4 | N1 | C3 | C2 | 111.3° | 179.7° |
| N1 | C4 | C5 | H2 | 8.6° | 60.0° |
| C4 | N1 | C3 | H14 | 128.3° | 60.3° |
| C4 | N1 | C3 | H15 | 9.2° | 59.7° |
| O3 | C4 | N1 | C3 | 12.6° | 0.0° |
| O3 | C4 | N1 | H1 | 167.4° | 179.7° |
| O3 | C4 | C5 | H2 | 168.3° | 120.0° |
| N1 | C3 | C2 | H14 | 120.4° | 120.0° |
| N1 | C3 | C2 | H15 | 120.5° | 120.0° |
| N1 | C3 | C2 | O1 | 176.2° | 180.0° |
| N1 | C3 | C2 | O2 | 1.5° | 0.0° |
| N1 | C3 | H14 | H15 | 118.7° | 120.0° |
| C3 | C2 | O1 | O2 | 177.6° | 179.9° |
| C3 | C2 | O1 | C1 | 176.7° | 180.0° |
| C2 | C3 | N1 | H1 | 68.7° | 0.0° |
| C2 | C3 | H14 | H15 | 118.6° | 120.0° |
| C2 | O1 | C1 | H11 | 180.0° | 60.1° |
| C2 | O1 | C1 | H12 | 60.0° | 180.0° |
| C2 | O1 | C1 | H13 | 60.0° | 59.9° |
| O1 | C2 | C3 | H14 | 63.4° | 60.0° |
| O1 | C2 | C3 | H15 | 55.7° | 60.0° |
| O2 | C2 | O1 | C1 | 1.0° | 0.1° |
| O2 | C2 | C3 | H14 | 119.0° | 120.0° |
| O2 | C2 | C3 | H15 | 121.9° | 120.0° |
| O1 | C1 | H11 | H12 | 120.0° | 119.9° |
| O1 | C1 | H11 | H13 | 120.0° | 120.0° |
| O1 | C1 | H12 | H13 | 120.0° | 120.0° |
| H1 | N1 | C3 | H14 | 51.7° | 120.0° |
| H1 | N1 | C3 | H15 | 170.8° | 120.0° |
| H2 | C5 | C6 | H3 | 63.0° | 60.0° |
| H2 | C5 | C6 | H4 | 177.9° | 180.0° |
| H2 | C5 | C10 | H9 | 26.7° | 180.0° |
| H2 | C5 | C10 | H10 | 145.3° | 60.0° |
| H3 | C6 | C7 | H5 | 83.2° | 60.0° |
| H3 | C6 | C7 | H6 | 35.5° | 60.0° |
| H4 | C6 | C7 | H5 | 35.9° | 180.0° |
| H4 | C6 | C7 | H6 | 154.6° | 60.0° |
| H5 | C7 | C8 | H7 | 21.7° | 60.0° |
| H5 | C7 | C8 | H8 | 140.9° | 180.0° |
| H6 | C7 | C8 | H7 | 97.1° | 60.0° |
| H6 | C7 | C8 | H8 | 22.2° | 60.0° |
| H7 | C8 | C9 | H16 | 58.6° | 60.0° |
| H7 | C8 | C9 | H17 | 60.5° | 60.0° |
| H8 | C8 | C9 | H16 | 177.9° | 180.0° |
| H8 | C8 | C9 | H17 | 58.8° | 59.9° |
| H9 | C10 | C9 | H16 | 153.5° | 179.9° |
| H9 | C10 | C9 | H17 | 34.5° | 60.0° |
| H10 | C10 | C9 | H16 | 34.8° | 60.0° |
| H10 | C10 | C9 | H17 | 84.2° | 60.0° |
| H11 | C1 | H12 | H13 | 120.0° | 120.1° |
