S8H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C13 | doub | 1.21Å | 1.25Å | |
| C13 | O5 | sing | 1.34Å | 1.25Å | |
| C13 | C12 | sing | 1.51Å | 1.54Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| C12 | N3 | sing | 1.47Å | 1.49Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| O4 | C9 | doub | 1.21Å | 1.23Å | |
| C10 | C9 | sing | 1.51Å | 1.52Å | |
| C9 | N2 | sing | 1.35Å | 1.34Å | |
| O3 | C6 | doub | 1.21Å | 1.23Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| C8 | S1 | sing | 1.82Å | 1.82Å | |
| C7 | N2 | sing | 1.46Å | 1.45Å | |
| C7 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | N1 | sing | 1.35Å | 1.33Å | |
| N1 | C5 | sing | 1.47Å | 1.45Å | |
| C5 | C4 | sing | 1.51Å | 1.50Å | |
| C4 | O1 | sing | 1.34Å | 1.34Å | |
| C4 | O2 | doub | 1.21Å | 1.20Å | |
| O1 | C2 | sing | 1.45Å | 1.46Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| N1 | H10 | sing | 0.97Å | 1.00Å | |
| N3 | H21 | sing | 1.01Å | 1.00Å | |
| N3 | H22 | sing | 1.01Å | 1.00Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H17 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| N2 | H15 | sing | 0.97Å | 1.00Å | |
| O5 | H14 | sing | 0.97Å | 0.95Å | |
| S1 | H24 | sing | 1.35Å | 1.30Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C13 | O5 | 125.5° | 120.0° |
| O6 | C13 | C12 | 117.0° | 120.0° |
| O5 | C13 | C12 | 117.5° | 120.0° |
| C13 | O5 | H14 | 109.5° | 117.0° |
| C13 | C12 | C11 | 111.1° | 109.5° |
| C13 | C12 | N3 | 110.1° | 109.5° |
| C13 | C12 | H20 | 107.9° | 109.5° |
| C11 | C12 | N3 | 111.3° | 109.5° |
| C12 | C11 | C10 | 115.6° | 109.5° |
| C12 | C11 | H18 | 107.9° | 109.5° |
| C12 | C11 | H19 | 107.9° | 109.5° |
| C11 | C12 | H20 | 107.9° | 109.5° |
| C12 | N3 | H21 | 109.5° | 111.1° |
| C12 | N3 | H22 | 109.5° | 110.9° |
| N3 | C12 | H20 | 108.5° | 109.4° |
| C11 | C10 | C9 | 117.4° | 109.5° |
| C11 | C10 | H17 | 107.5° | 109.5° |
| C11 | C10 | H16 | 107.5° | 109.5° |
| C10 | C11 | H18 | 107.9° | 109.5° |
| C10 | C11 | H19 | 107.9° | 109.5° |
| O4 | C9 | C10 | 122.5° | 120.0° |
| O4 | C9 | N2 | 122.2° | 120.0° |
| C10 | C9 | N2 | 115.3° | 120.0° |
| C9 | C10 | H17 | 107.5° | 109.5° |
| C9 | C10 | H16 | 107.5° | 109.4° |
| C9 | N2 | C7 | 123.0° | 120.0° |
| C9 | N2 | H15 | 118.5° | 120.0° |
| O3 | C6 | C7 | 118.2° | 120.0° |
| O3 | C6 | N1 | 123.8° | 120.0° |
| C7 | C8 | S1 | 116.4° | 109.5° |
| C8 | C7 | N2 | 110.7° | 109.5° |
| C8 | C7 | C6 | 110.0° | 109.5° |
| C8 | C7 | H11 | 106.6° | 109.5° |
| C7 | C8 | H12 | 107.7° | 109.5° |
| C7 | C8 | H13 | 107.7° | 109.5° |
| S1 | C8 | H12 | 107.7° | 109.4° |
| S1 | C8 | H13 | 107.7° | 109.4° |
| C8 | S1 | H24 | 102.0° | 103.0° |
| N2 | C7 | C6 | 115.1° | 109.5° |
| N2 | C7 | H11 | 107.4° | 109.5° |
| C7 | N2 | H15 | 118.5° | 120.0° |
| C7 | C6 | N1 | 118.0° | 120.0° |
| C6 | C7 | H11 | 106.5° | 109.5° |
| C6 | N1 | C5 | 121.3° | 120.0° |
| C6 | N1 | H10 | 119.4° | 120.0° |
| N1 | C5 | C4 | 112.5° | 109.5° |
| C5 | N1 | H10 | 119.4° | 120.0° |
| N1 | C5 | H9 | 108.7° | 109.4° |
| N1 | C5 | H8 | 108.7° | 109.5° |
| C5 | C4 | O1 | 110.6° | 119.9° |
| C5 | C4 | O2 | 125.3° | 120.0° |
| C4 | C5 | H9 | 108.7° | 109.5° |
| C4 | C5 | H8 | 108.7° | 109.5° |
| O1 | C4 | O2 | 124.1° | 120.0° |
| C4 | O1 | C2 | 118.5° | 117.0° |
| O1 | C2 | C3 | 107.0° | 109.5° |
| O1 | C2 | C1 | 107.4° | 109.5° |
| O1 | C2 | H4 | 109.9° | 109.5° |
| C3 | C2 | C1 | 113.9° | 109.5° |
| C3 | C2 | H4 | 109.2° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.4° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C1 | C2 | H4 | 109.2° | 109.5° |
| H21 | N3 | H22 | 109.5° | 111.0° |
| H9 | C5 | H8 | 109.5° | 109.5° |
| H12 | C8 | H13 | 109.5° | 109.5° |
| H17 | C10 | H16 | 109.4° | 109.4° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.5° |
| H3 | C1 | H1 | 109.5° | 109.4° |
| H18 | C11 | H19 | 109.5° | 109.4° |
| H6 | C3 | H7 | 109.5° | 109.6° |
| H6 | C3 | H5 | 109.4° | 109.5° |
| H7 | C3 | H5 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C13 | O5 | C12 | 179.9° | 179.9° |
| O6 | C13 | C12 | C11 | 54.4° | 100.1° |
| O6 | C13 | C12 | N3 | 178.2° | 20.0° |
| O6 | C13 | C12 | H20 | 63.6° | 139.9° |
| O6 | C13 | O5 | H14 | 0.0° | 0.1° |
| O5 | C13 | C12 | C11 | 125.5° | 80.0° |
| O5 | C13 | C12 | N3 | 1.7° | 159.9° |
| O5 | C13 | C12 | H20 | 116.5° | 40.0° |
| C13 | C12 | C11 | N3 | 123.1° | 120.0° |
| C13 | C12 | C11 | H20 | 118.0° | 120.0° |
| C13 | C12 | N3 | H20 | 117.9° | 120.0° |
| C13 | C12 | C11 | C10 | 72.1° | 175.0° |
| C13 | C12 | N3 | H21 | 180.0° | 64.0° |
| C13 | C12 | N3 | H22 | 60.0° | 60.0° |
| C13 | C12 | C11 | H18 | 48.8° | 55.0° |
| C13 | C12 | C11 | H19 | 167.0° | 65.0° |
| C12 | C13 | O5 | H14 | 179.9° | 180.0° |
| C11 | C12 | N3 | H20 | 118.5° | 120.0° |
| C12 | C11 | C10 | H18 | 120.9° | 120.1° |
| C12 | C11 | C10 | H19 | 120.9° | 120.0° |
| C12 | C11 | C10 | C9 | 93.2° | 180.0° |
| C11 | C12 | N3 | H21 | 56.3° | 176.0° |
| C11 | C12 | N3 | H22 | 176.3° | 60.0° |
| C12 | C11 | C10 | H17 | 145.6° | 60.0° |
| C12 | C11 | C10 | H16 | 27.9° | 60.0° |
| C12 | C11 | H18 | H19 | 117.2° | 120.0° |
| N3 | C12 | C11 | C10 | 51.0° | 65.0° |
| C12 | N3 | H21 | H22 | 120.0° | 123.9° |
| N3 | C12 | C11 | H18 | 171.9° | 175.0° |
| N3 | C12 | C11 | H19 | 69.9° | 55.1° |
| C11 | C10 | C9 | O4 | 46.8° | 0.0° |
| C11 | C10 | C9 | H17 | 121.1° | 120.0° |
| C11 | C10 | C9 | H16 | 121.2° | 120.1° |
| C11 | C10 | C9 | N2 | 133.0° | 180.0° |
| C11 | C10 | H17 | H16 | 116.4° | 120.0° |
| C10 | C11 | H18 | H19 | 117.3° | 120.0° |
| C10 | C11 | C12 | H20 | 169.8° | 55.0° |
| O4 | C9 | C10 | N2 | 179.9° | 180.0° |
| O4 | C9 | N2 | C7 | 57.8° | 0.0° |
| O4 | C9 | C10 | H17 | 74.3° | 120.0° |
| O4 | C9 | C10 | H16 | 168.0° | 120.1° |
| O4 | C9 | N2 | H15 | 122.2° | 180.0° |
| C10 | C9 | N2 | C7 | 122.1° | 180.0° |
| C9 | C10 | H17 | H16 | 116.4° | 119.9° |
| C9 | C10 | C11 | H18 | 27.6° | 60.0° |
| C9 | C10 | C11 | H19 | 145.9° | 60.0° |
| C10 | C9 | N2 | H15 | 57.9° | 0.0° |
| C9 | N2 | C7 | C8 | 115.5° | 85.0° |
| C9 | N2 | C7 | H15 | 180.0° | 180.0° |
| C9 | N2 | C7 | C6 | 119.0° | 155.0° |
| C9 | N2 | C7 | H11 | 0.6° | 35.0° |
| N2 | C9 | C10 | H17 | 105.8° | 59.9° |
| N2 | C9 | C10 | H16 | 11.9° | 59.9° |
| O3 | C6 | C7 | C8 | 109.6° | 120.0° |
| O3 | C6 | C7 | N2 | 124.5° | 0.0° |
| O3 | C6 | C7 | N1 | 177.6° | 179.9° |
| O3 | C6 | N1 | C5 | 8.7° | 0.1° |
| O3 | C6 | N1 | H10 | 171.4° | 179.7° |
| O3 | C6 | C7 | H11 | 5.5° | 120.0° |
| C7 | C8 | S1 | H12 | 121.0° | 120.0° |
| C7 | C8 | S1 | H13 | 121.0° | 120.0° |
| C8 | C7 | N2 | C6 | 125.5° | 120.0° |
| C8 | C7 | N2 | H11 | 116.0° | 120.0° |
| C8 | C7 | C6 | H11 | 115.2° | 120.0° |
| C8 | C7 | C6 | N1 | 67.9° | 60.0° |
| C7 | C8 | H12 | H13 | 116.8° | 120.1° |
| C8 | C7 | N2 | H15 | 64.5° | 95.0° |
| C7 | C8 | S1 | H24 | 180.0° | 180.0° |
| S1 | C8 | C7 | N2 | 42.0° | 65.0° |
| S1 | C8 | C7 | C6 | 86.3° | 175.0° |
| S1 | C8 | C7 | H11 | 158.5° | 55.0° |
| S1 | C8 | H12 | H13 | 116.8° | 119.9° |
| N2 | C7 | C6 | H11 | 118.9° | 120.0° |
| N2 | C7 | C6 | N1 | 58.0° | 180.0° |
| N2 | C7 | C8 | H12 | 79.0° | 175.0° |
| N2 | C7 | C8 | H13 | 163.0° | 54.9° |
| C7 | C6 | N1 | C5 | 168.7° | 180.0° |
| C7 | C6 | N1 | H10 | 11.2° | 0.3° |
| C6 | C7 | C8 | H12 | 152.6° | 55.0° |
| C6 | C7 | C8 | H13 | 34.6° | 65.1° |
| C6 | C7 | N2 | H15 | 61.0° | 25.0° |
| C6 | N1 | C5 | H10 | 180.0° | 179.7° |
| C6 | N1 | C5 | C4 | 174.1° | 179.7° |
| C6 | N1 | C5 | H9 | 65.4° | 59.7° |
| C6 | N1 | C5 | H8 | 53.7° | 60.3° |
| N1 | C6 | C7 | H11 | 176.9° | 60.0° |
| N1 | C5 | C4 | H9 | 120.4° | 120.0° |
| N1 | C5 | C4 | H8 | 120.4° | 120.0° |
| N1 | C5 | C4 | O1 | 61.8° | 180.0° |
| N1 | C5 | C4 | O2 | 119.2° | 0.0° |
| N1 | C5 | H9 | H8 | 118.6° | 120.0° |
| C5 | C4 | O1 | O2 | 179.0° | 179.9° |
| C5 | C4 | O1 | C2 | 176.6° | 180.0° |
| C4 | C5 | N1 | H10 | 5.9° | 0.0° |
| C4 | C5 | H9 | H8 | 118.6° | 120.0° |
| C4 | O1 | C2 | C3 | 169.7° | 150.0° |
| C4 | O1 | C2 | C1 | 67.6° | 89.9° |
| O1 | C4 | C5 | H9 | 177.7° | 60.1° |
| O1 | C4 | C5 | H8 | 58.6° | 60.0° |
| C4 | O1 | C2 | H4 | 51.2° | 30.0° |
| O2 | C4 | O1 | C2 | 2.4° | 0.0° |
| O2 | C4 | C5 | H9 | 1.3° | 120.0° |
| O2 | C4 | C5 | H8 | 120.4° | 120.0° |
| O1 | C2 | C3 | C1 | 118.6° | 120.0° |
| O1 | C2 | C3 | H4 | 119.0° | 120.0° |
| O1 | C2 | C1 | H4 | 119.2° | 120.0° |
| O1 | C2 | C1 | H2 | 180.0° | 60.0° |
| O1 | C2 | C1 | H3 | 60.0° | 180.0° |
| O1 | C2 | C1 | H1 | 60.0° | 60.0° |
| O1 | C2 | C3 | H6 | 180.0° | 60.1° |
| O1 | C2 | C3 | H7 | 60.0° | 60.0° |
| O1 | C2 | C3 | H5 | 60.0° | 180.0° |
| C3 | C2 | C1 | H4 | 122.4° | 120.0° |
| C3 | C2 | C1 | H2 | 61.7° | 60.0° |
| C3 | C2 | C1 | H3 | 178.4° | 60.0° |
| C3 | C2 | C1 | H1 | 58.4° | 180.0° |
| C2 | C3 | H6 | H7 | 120.0° | 120.0° |
| C2 | C3 | H6 | H5 | 120.0° | 119.9° |
| C2 | C3 | H7 | H5 | 120.0° | 119.9° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H1 | 120.0° | 120.0° |
| C2 | C1 | H3 | H1 | 120.0° | 120.1° |
| C1 | C2 | C3 | H6 | 61.4° | 59.9° |
| C1 | C2 | C3 | H7 | 58.6° | 179.9° |
| C1 | C2 | C3 | H5 | 178.6° | 60.0° |
| H10 | N1 | C5 | H9 | 114.6° | 120.0° |
| H10 | N1 | C5 | H8 | 126.3° | 120.0° |
| H21 | N3 | C12 | H20 | 62.1° | 56.0° |
| H22 | N3 | C12 | H20 | 57.9° | 180.0° |
| H11 | C7 | C8 | H12 | 37.5° | 65.0° |
| H11 | C7 | C8 | H13 | 80.5° | 174.9° |
| H11 | C7 | N2 | H15 | 179.4° | 145.0° |
| H12 | C8 | S1 | H24 | 59.0° | 60.0° |
| H13 | C8 | S1 | H24 | 59.0° | 60.0° |
| H17 | C10 | C11 | H18 | 93.5° | 60.1° |
| H17 | C10 | C11 | H19 | 24.7° | NaN° |
| H16 | C10 | C11 | H18 | 148.8° | 180.0° |
| H16 | C10 | C11 | H19 | 93.0° | 60.0° |
| H2 | C1 | H3 | H1 | 120.0° | 119.9° |
| H2 | C1 | C2 | H4 | 60.8° | 180.0° |
| H3 | C1 | C2 | H4 | 59.2° | 60.0° |
| H1 | C1 | C2 | H4 | 179.2° | 60.0° |
| H18 | C11 | C12 | H20 | 69.3° | 65.1° |
| H19 | C11 | C12 | H20 | 48.9° | 175.0° |
| H4 | C2 | C3 | H6 | 61.0° | 180.0° |
| H4 | C2 | C3 | H7 | 179.0° | 59.9° |
| H4 | C2 | C3 | H5 | 58.9° | 60.0° |
| H6 | C3 | H7 | H5 | 120.0° | 120.1° |
