0UF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O5 | S1 | doub | 1.42Å | 1.53Å | |
| C24 | C18 | sing | 1.38Å | 1.53Å | |
| C24 | C25 | doub | 1.39Å | 1.53Å | |
| C22 | C16 | sing | 1.53Å | 1.53Å | |
| C18 | C9 | doub | 1.39Å | 1.33Å | |
| C25 | C19 | sing | 1.38Å | 1.53Å | |
| O4 | S1 | doub | 1.42Å | 1.53Å | |
| S1 | O6 | sing | 1.52Å | 1.53Å | |
| S1 | C13 | sing | 1.81Å | 1.83Å | |
| O3 | C12 | doub | 1.22Å | 1.23Å | |
| C1 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | N1 | sing | 1.46Å | 1.34Å | |
| C9 | N1 | sing | 1.36Å | 1.33Å | |
| C9 | O1 | sing | 1.34Å | 1.36Å | |
| C16 | C6 | sing | 1.53Å | 1.53Å | |
| C19 | C10 | doub | 1.40Å | 1.39Å | |
| C4 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | C10 | sing | 1.42Å | 1.39Å | |
| C12 | N3 | sing | 1.35Å | 1.34Å | |
| N1 | C8 | sing | 1.39Å | 1.34Å | |
| C3 | C6 | sing | 1.53Å | 1.53Å | |
| C3 | N3 | sing | 1.47Å | 1.48Å | |
| O1 | C14 | sing | 1.35Å | 1.36Å | |
| C10 | C11 | sing | 1.42Å | 1.39Å | |
| N3 | C7 | sing | 1.34Å | 1.34Å | |
| C8 | C14 | doub | 1.40Å | 1.33Å | Aromatic |
| C8 | C17 | sing | 1.39Å | 1.33Å | Aromatic |
| C14 | C20 | sing | 1.39Å | 1.33Å | Aromatic |
| C11 | O2 | doub | 1.22Å | 1.23Å | |
| C11 | N2 | sing | 1.35Å | 1.34Å | |
| C17 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | N2 | sing | 1.34Å | 1.34Å | |
| C7 | S2 | doub | 1.71Å | 1.75Å | |
| N2 | C2 | sing | 1.46Å | 1.48Å | |
| C23 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C2 | sing | 1.53Å | 1.53Å | |
| C5 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C21 | sing | 1.53Å | 1.53Å | |
| C13 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.08Å | 1.08Å | |
| C26 | H9 | sing | 1.08Å | 1.08Å | |
| C20 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H15 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.08Å | 1.08Å | |
| C2 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C5 | H22 | sing | 1.09Å | 1.10Å | |
| C5 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C3 | H29 | sing | 1.09Å | 1.10Å | |
| C3 | H30 | sing | 1.09Å | 1.10Å | |
| C6 | H31 | sing | 1.09Å | 1.10Å | |
| C6 | H32 | sing | 1.09Å | 1.10Å | |
| C16 | H33 | sing | 1.09Å | 1.10Å | |
| C16 | H34 | sing | 1.09Å | 1.10Å | |
| C22 | H35 | sing | 1.09Å | 1.10Å | |
| C22 | H36 | sing | 1.09Å | 1.10Å | |
| C22 | H37 | sing | 1.09Å | 1.10Å | |
| O6 | H38 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5 | S1 | O4 | 109.8° | 121.0° |
| O5 | S1 | O6 | 109.7° | 104.3° |
| O5 | S1 | C13 | 109.7° | 110.6° |
| C18 | C24 | C25 | 116.8° | 120.0° |
| C24 | C18 | C9 | 118.0° | 120.0° |
| C24 | C18 | H11 | 121.0° | 120.0° |
| C18 | C24 | H13 | 121.6° | 120.0° |
| C24 | C25 | C19 | 114.7° | 120.0° |
| C25 | C24 | H13 | 121.6° | 120.0° |
| C24 | C25 | H15 | 122.7° | 120.0° |
| C22 | C16 | C6 | 108.9° | 109.5° |
| C22 | C16 | H33 | 109.6° | 109.5° |
| C22 | C16 | H34 | 109.6° | 109.5° |
| C16 | C22 | H35 | 109.5° | 109.5° |
| C16 | C22 | H36 | 109.5° | 109.5° |
| C16 | C22 | H37 | 109.5° | 109.4° |
| C18 | C9 | N1 | 120.8° | 125.4° |
| C18 | C9 | O1 | 120.8° | 125.4° |
| C9 | C18 | H11 | 121.0° | 120.0° |
| C25 | C19 | C10 | 117.5° | 120.0° |
| C19 | C25 | H15 | 122.7° | 120.0° |
| C25 | C19 | H17 | 121.2° | 120.0° |
| O4 | S1 | O6 | 109.4° | 104.3° |
| O4 | S1 | C13 | 109.5° | 110.5° |
| O6 | S1 | C13 | 108.7° | 104.5° |
| S1 | O6 | H38 | 109.5° | 114.0° |
| S1 | C13 | C4 | 112.2° | 109.5° |
| S1 | C13 | H1 | 108.8° | 109.5° |
| S1 | C13 | H2 | 108.8° | 109.4° |
| O3 | C12 | C10 | 121.0° | 120.5° |
| O3 | C12 | N3 | 119.4° | 120.5° |
| C4 | C1 | N1 | 121.2° | 109.5° |
| C1 | C4 | C13 | 113.3° | 109.4° |
| C1 | C4 | H3 | 108.5° | 109.5° |
| C1 | C4 | H4 | 108.5° | 109.5° |
| C4 | C1 | H5 | 106.5° | 109.5° |
| C4 | C1 | H6 | 106.5° | 109.5° |
| C1 | N1 | C9 | 120.0° | 126.3° |
| C1 | N1 | C8 | 127.7° | 126.4° |
| N1 | C1 | H5 | 106.4° | 109.4° |
| N1 | C1 | H6 | 106.5° | 109.5° |
| N1 | C9 | O1 | 108.6° | 109.2° |
| C9 | N1 | C8 | 107.8° | 107.3° |
| C9 | O1 | C14 | 106.5° | 109.3° |
| C16 | C6 | C3 | 109.5° | 109.5° |
| C16 | C6 | H31 | 109.5° | 109.5° |
| C16 | C6 | H32 | 109.5° | 109.5° |
| C6 | C16 | H33 | 109.6° | 109.5° |
| C6 | C16 | H34 | 109.6° | 109.5° |
| C19 | C10 | C12 | 121.6° | 120.9° |
| C19 | C10 | C11 | 115.0° | 120.9° |
| C10 | C19 | H17 | 121.3° | 120.0° |
| C4 | C13 | H1 | 108.8° | 109.5° |
| C4 | C13 | H2 | 108.8° | 109.4° |
| C13 | C4 | H3 | 108.5° | 109.5° |
| C13 | C4 | H4 | 108.5° | 109.5° |
| C10 | C12 | N3 | 119.4° | 119.0° |
| C12 | C10 | C11 | 117.6° | 118.2° |
| C12 | N3 | C3 | 119.0° | 119.6° |
| C12 | N3 | C7 | 120.7° | 120.9° |
| N1 | C8 | C14 | 109.1° | 106.8° |
| N1 | C8 | C17 | 131.1° | 133.2° |
| C6 | C3 | N3 | 110.5° | 109.4° |
| C6 | C3 | H29 | 109.2° | 109.5° |
| C6 | C3 | H30 | 109.2° | 109.5° |
| C3 | C6 | H31 | 109.5° | 109.5° |
| C3 | C6 | H32 | 109.5° | 109.5° |
| C3 | N3 | C7 | 118.4° | 119.5° |
| N3 | C3 | H29 | 109.2° | 109.5° |
| N3 | C3 | H30 | 109.2° | 109.5° |
| O1 | C14 | C8 | 107.7° | 107.5° |
| O1 | C14 | C20 | 130.4° | 132.8° |
| C10 | C11 | O2 | 119.8° | 120.5° |
| C10 | C11 | N2 | 120.2° | 119.0° |
| N3 | C7 | N2 | 120.9° | 121.9° |
| N3 | C7 | S2 | 119.6° | 119.1° |
| C14 | C8 | C17 | 119.5° | 120.0° |
| C8 | C14 | C20 | 121.7° | 119.7° |
| C8 | C17 | C23 | 121.8° | 119.8° |
| C8 | C17 | H7 | 119.1° | 120.1° |
| C14 | C20 | C26 | 121.0° | 119.9° |
| C14 | C20 | H10 | 119.5° | 120.1° |
| O2 | C11 | N2 | 119.5° | 120.5° |
| C11 | N2 | C7 | 119.2° | 120.9° |
| C11 | N2 | C2 | 115.0° | 119.6° |
| C17 | C23 | C26 | 118.2° | 120.2° |
| C23 | C17 | H7 | 119.1° | 120.1° |
| C17 | C23 | H8 | 120.9° | 119.9° |
| C20 | C26 | C23 | 117.7° | 120.4° |
| C20 | C26 | H9 | 121.2° | 119.8° |
| C26 | C20 | H10 | 119.5° | 120.0° |
| N2 | C7 | S2 | 119.1° | 119.0° |
| C7 | N2 | C2 | 116.2° | 119.5° |
| N2 | C2 | C5 | 109.0° | 109.5° |
| N2 | C2 | H20 | 109.6° | 109.5° |
| N2 | C2 | H21 | 109.6° | 109.5° |
| C26 | C23 | H8 | 120.9° | 119.9° |
| C23 | C26 | H9 | 121.2° | 119.9° |
| C2 | C5 | C15 | 111.1° | 109.5° |
| C5 | C2 | H20 | 109.6° | 109.5° |
| C5 | C2 | H21 | 109.6° | 109.4° |
| C2 | C5 | H22 | 109.1° | 109.5° |
| C2 | C5 | H23 | 109.0° | 109.5° |
| C5 | C15 | C21 | 110.7° | 109.5° |
| C15 | C5 | H22 | 109.1° | 109.4° |
| C15 | C5 | H23 | 109.1° | 109.5° |
| C5 | C15 | H24 | 109.2° | 109.4° |
| C5 | C15 | H25 | 109.2° | 109.5° |
| C21 | C15 | H24 | 109.2° | 109.5° |
| C21 | C15 | H25 | 109.2° | 109.5° |
| C15 | C21 | H26 | 109.5° | 109.5° |
| C15 | C21 | H27 | 109.4° | 109.5° |
| C15 | C21 | H28 | 109.5° | 109.5° |
| H1 | C13 | H2 | 109.5° | 109.5° |
| H3 | C4 | H4 | 109.5° | 109.4° |
| H5 | C1 | H6 | 109.5° | 109.5° |
| H20 | C2 | H21 | 109.5° | 109.5° |
| H22 | C5 | H23 | 109.4° | 109.5° |
| H24 | C15 | H25 | 109.5° | 109.5° |
| H26 | C21 | H27 | 109.5° | 109.5° |
| H26 | C21 | H28 | 109.4° | 109.5° |
| H27 | C21 | H28 | 109.5° | 109.5° |
| H29 | C3 | H30 | 109.5° | 109.5° |
| H31 | C6 | H32 | 109.4° | 109.5° |
| H33 | C16 | H34 | 109.4° | 109.5° |
| H35 | C22 | H36 | 109.4° | 109.5° |
| H35 | C22 | H37 | 109.5° | 109.4° |
| H36 | C22 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5 | S1 | O4 | O6 | 120.4° | 116.7° |
| O5 | S1 | O4 | C13 | 120.5° | 131.5° |
| O5 | S1 | O6 | C13 | 120.0° | 116.1° |
| O5 | S1 | C13 | C4 | 55.2° | 68.3° |
| O5 | S1 | C13 | H1 | 175.6° | 171.7° |
| O5 | S1 | C13 | H2 | 65.2° | 51.6° |
| O5 | S1 | O6 | H38 | 120.4° | 63.9° |
| C18 | C24 | C25 | H13 | 180.0° | 179.9° |
| C24 | C18 | C9 | H11 | 180.0° | 179.9° |
| C18 | C24 | C25 | C19 | 54.2° | 0.0° |
| C24 | C18 | C9 | N1 | 94.2° | 180.0° |
| C24 | C18 | C9 | O1 | 123.7° | 0.1° |
| C18 | C24 | C25 | H15 | 125.8° | 180.0° |
| C25 | C24 | C18 | C9 | 65.1° | 180.0° |
| C24 | C25 | C19 | H15 | 180.0° | 180.0° |
| C24 | C25 | C19 | C10 | 141.0° | 174.9° |
| C25 | C24 | C18 | H11 | 114.9° | 0.1° |
| C24 | C25 | C19 | H17 | 39.1° | 5.1° |
| C22 | C16 | C6 | H33 | 119.9° | 120.0° |
| C22 | C16 | C6 | H34 | 119.9° | 120.0° |
| C22 | C16 | C6 | C3 | 61.6° | 180.0° |
| C22 | C16 | C6 | H31 | 178.4° | 60.0° |
| C22 | C16 | C6 | H32 | 58.5° | 60.0° |
| C22 | C16 | H33 | H34 | 120.2° | 120.0° |
| C16 | C22 | H35 | H36 | 120.0° | 120.0° |
| C16 | C22 | H35 | H37 | 120.0° | 119.9° |
| C16 | C22 | H36 | H37 | 120.0° | 120.0° |
| C18 | C9 | N1 | C1 | 11.2° | 0.1° |
| C18 | C9 | N1 | O1 | 146.2° | 179.9° |
| C18 | C9 | N1 | C8 | 146.8° | 179.7° |
| C18 | C9 | O1 | C14 | 144.1° | 179.7° |
| C9 | C18 | C24 | H13 | 114.9° | 0.1° |
| C25 | C19 | C10 | H17 | 180.0° | 180.0° |
| C25 | C19 | C10 | C12 | 55.5° | 6.2° |
| C25 | C19 | C10 | C11 | 151.9° | 173.4° |
| C19 | C25 | C24 | H13 | 125.8° | 180.0° |
| O4 | S1 | O6 | C13 | 119.5° | 116.1° |
| O4 | S1 | C13 | C4 | 65.4° | 68.4° |
| O4 | S1 | C13 | H1 | 55.1° | 51.6° |
| O4 | S1 | C13 | H2 | 174.2° | 171.6° |
| O4 | S1 | O6 | H38 | 0.0° | 64.0° |
| O6 | S1 | C13 | C4 | 175.1° | 180.0° |
| O6 | S1 | C13 | H1 | 64.4° | 60.0° |
| O6 | S1 | C13 | H2 | 54.8° | 60.0° |
| S1 | C13 | C4 | C1 | 52.0° | 180.0° |
| S1 | C13 | C4 | H1 | 120.4° | 120.0° |
| S1 | C13 | C4 | H2 | 120.4° | 120.0° |
| S1 | C13 | H1 | H2 | 118.8° | 120.0° |
| S1 | C13 | C4 | H3 | 68.5° | 60.0° |
| S1 | C13 | C4 | H4 | 172.6° | 60.0° |
| C13 | S1 | O6 | H38 | 119.6° | 180.0° |
| O3 | C12 | C10 | C19 | 21.6° | 0.0° |
| O3 | C12 | C10 | N3 | 174.7° | 180.0° |
| O3 | C12 | N3 | C3 | 28.3° | 0.1° |
| O3 | C12 | C10 | C11 | 173.5° | 179.7° |
| O3 | C12 | N3 | C7 | 167.2° | 180.0° |
| C4 | C1 | N1 | H5 | 121.6° | 120.0° |
| C4 | C1 | N1 | H6 | 121.6° | 120.0° |
| C4 | C1 | N1 | C9 | 178.7° | 90.3° |
| C1 | C4 | C13 | H3 | 120.6° | 120.0° |
| C1 | C4 | C13 | H4 | 120.5° | 120.0° |
| C4 | C1 | N1 | C8 | 28.1° | 90.0° |
| C1 | C4 | C13 | H1 | 68.4° | 60.0° |
| C1 | C4 | C13 | H2 | 172.4° | 60.0° |
| C1 | C4 | H3 | H4 | 118.2° | 120.0° |
| C4 | C1 | H5 | H6 | 114.7° | 120.1° |
| C1 | N1 | C9 | C8 | 158.0° | 179.8° |
| C1 | N1 | C9 | O1 | 157.3° | 179.8° |
| N1 | C1 | C4 | C13 | 68.6° | 179.9° |
| C1 | N1 | C8 | C14 | 152.5° | 180.0° |
| C1 | N1 | C8 | C17 | 21.7° | 0.0° |
| N1 | C1 | C4 | H3 | 170.9° | 60.0° |
| N1 | C1 | C4 | H4 | 52.0° | 60.0° |
| N1 | C1 | H5 | H6 | 114.7° | 120.0° |
| N1 | C9 | O1 | C14 | 2.1° | 0.4° |
| C9 | N1 | C8 | C14 | 3.2° | 0.2° |
| C9 | N1 | C8 | C17 | 177.4° | 179.8° |
| C9 | N1 | C1 | H5 | 57.0° | 149.7° |
| C9 | N1 | C1 | H6 | 59.7° | 29.8° |
| N1 | C9 | C18 | H11 | 85.8° | 0.1° |
| O1 | C9 | N1 | C8 | 0.7° | 0.4° |
| C9 | O1 | C14 | C8 | 4.0° | 0.3° |
| C9 | O1 | C14 | C20 | 170.6° | 179.8° |
| O1 | C9 | C18 | H11 | 56.3° | 179.8° |
| C16 | C6 | C3 | H31 | 120.0° | 120.0° |
| C16 | C6 | C3 | H32 | 120.0° | 120.0° |
| C16 | C6 | C3 | N3 | 179.8° | 180.0° |
| C16 | C6 | C3 | H29 | 59.6° | 60.0° |
| C16 | C6 | C3 | H30 | 60.1° | 60.0° |
| C16 | C6 | H31 | H32 | 120.0° | 120.0° |
| C6 | C16 | H33 | H34 | 120.3° | 120.0° |
| C6 | C16 | C22 | H35 | 180.0° | 60.0° |
| C6 | C16 | C22 | H36 | 60.0° | 60.0° |
| C6 | C16 | C22 | H37 | 60.0° | 180.0° |
| C19 | C10 | C12 | C11 | 151.9° | 179.6° |
| C19 | C10 | C12 | N3 | 153.2° | 180.0° |
| C19 | C10 | C11 | O2 | 44.4° | 0.1° |
| C19 | C10 | C11 | N2 | 143.2° | 180.0° |
| C10 | C19 | C25 | H15 | 39.1° | 5.1° |
| C4 | C13 | H1 | H2 | 118.8° | 120.0° |
| C13 | C4 | H3 | H4 | 118.3° | 120.0° |
| C13 | C4 | C1 | H5 | 169.8° | 60.0° |
| C13 | C4 | C1 | H6 | 53.1° | 60.0° |
| C10 | C12 | N3 | C3 | 156.9° | 179.9° |
| C10 | C12 | N3 | C7 | 7.7° | 0.0° |
| C12 | C10 | C11 | O2 | 161.9° | 179.7° |
| C12 | C10 | C11 | N2 | 10.5° | 0.3° |
| C12 | C10 | C19 | H17 | 124.5° | 173.8° |
| C12 | N3 | C3 | C6 | 107.0° | 90.0° |
| C12 | N3 | C3 | C7 | 164.9° | 179.9° |
| N3 | C12 | C10 | C11 | 1.3° | 0.3° |
| C12 | N3 | C7 | N2 | 2.4° | 0.4° |
| C12 | N3 | C7 | S2 | 175.5° | 180.0° |
| C12 | N3 | C3 | H29 | 13.2° | 150.0° |
| C12 | N3 | C3 | H30 | 132.9° | 29.9° |
| N1 | C8 | C14 | O1 | 4.5° | 0.0° |
| N1 | C8 | C14 | C17 | 175.0° | 180.0° |
| N1 | C8 | C14 | C20 | 170.7° | 180.0° |
| N1 | C8 | C17 | C23 | 168.6° | 180.0° |
| C8 | N1 | C1 | H5 | 149.8° | 30.0° |
| C8 | N1 | C1 | H6 | 93.5° | 150.0° |
| N1 | C8 | C17 | H7 | 11.4° | 0.0° |
| C6 | C3 | N3 | H29 | 120.1° | 120.0° |
| C6 | C3 | N3 | H30 | 120.1° | 120.0° |
| C6 | C3 | N3 | C7 | 58.0° | 90.1° |
| C6 | C3 | H29 | H30 | 119.5° | 120.0° |
| C3 | C6 | H31 | H32 | 120.0° | 120.0° |
| C3 | C6 | C16 | H33 | 58.4° | 60.0° |
| C3 | C6 | C16 | H34 | 178.5° | 60.0° |
| C3 | N3 | C7 | N2 | 162.3° | 179.7° |
| C3 | N3 | C7 | S2 | 10.9° | 0.1° |
| N3 | C3 | H29 | H30 | 119.6° | 120.0° |
| N3 | C3 | C6 | H31 | 60.2° | 60.0° |
| N3 | C3 | C6 | H32 | 59.7° | 60.0° |
| O1 | C14 | C8 | C20 | 175.2° | 179.9° |
| O1 | C14 | C8 | C17 | 179.5° | 180.0° |
| O1 | C14 | C20 | C26 | 174.6° | 180.0° |
| O1 | C14 | C20 | H10 | 5.4° | 0.0° |
| C10 | C11 | O2 | N2 | 172.4° | 180.0° |
| C10 | C11 | N2 | C7 | 16.0° | 0.0° |
| C10 | C11 | N2 | C2 | 129.0° | 180.0° |
| C11 | C10 | C19 | H17 | 28.1° | 6.6° |
| N3 | C7 | N2 | C11 | 9.6° | 0.4° |
| N3 | C7 | N2 | S2 | 173.2° | 179.6° |
| N3 | C7 | N2 | C2 | 135.0° | 179.6° |
| C7 | N3 | C3 | H29 | 178.1° | 29.9° |
| C7 | N3 | C3 | H30 | 62.2° | 149.9° |
| C14 | C8 | C17 | C23 | 5.1° | 0.0° |
| C8 | C14 | C20 | C26 | 0.6° | 0.0° |
| C14 | C8 | C17 | H7 | 174.9° | 180.0° |
| C8 | C14 | C20 | H10 | 179.5° | 180.0° |
| C17 | C8 | C14 | C20 | 4.3° | 0.0° |
| C8 | C17 | C23 | H7 | 180.0° | 180.0° |
| C8 | C17 | C23 | C26 | 2.2° | 0.0° |
| C8 | C17 | C23 | H8 | 177.8° | 180.0° |
| C14 | C20 | C26 | H10 | 180.0° | 180.0° |
| C14 | C20 | C26 | C23 | 2.3° | 0.0° |
| C14 | C20 | C26 | H9 | 177.7° | 180.0° |
| O2 | C11 | N2 | C7 | 156.4° | 179.9° |
| O2 | C11 | N2 | C2 | 58.6° | 0.0° |
| C11 | N2 | C7 | C2 | 144.6° | 180.0° |
| C11 | N2 | C7 | S2 | 163.6° | 180.0° |
| C11 | N2 | C2 | C5 | 33.8° | 90.0° |
| C11 | N2 | C2 | H20 | 153.7° | 150.0° |
| C11 | N2 | C2 | H21 | 86.1° | 30.0° |
| C17 | C23 | C26 | C20 | 1.4° | 0.0° |
| C17 | C23 | C26 | H8 | 180.0° | 180.0° |
| C17 | C23 | C26 | H9 | 178.5° | 179.9° |
| C20 | C26 | C23 | H9 | 180.0° | 179.9° |
| C20 | C26 | C23 | H8 | 178.5° | 180.0° |
| C7 | N2 | C2 | C5 | 112.3° | 90.0° |
| C7 | N2 | C2 | H20 | 7.6° | 30.0° |
| C7 | N2 | C2 | H21 | 127.7° | 150.1° |
| S2 | C7 | N2 | C2 | 51.8° | 0.0° |
| N2 | C2 | C5 | H20 | 119.9° | 120.0° |
| N2 | C2 | C5 | H21 | 119.9° | 120.0° |
| N2 | C2 | C5 | C15 | 170.9° | 180.0° |
| N2 | C2 | H20 | H21 | 120.2° | 120.1° |
| N2 | C2 | C5 | H22 | 68.8° | 60.0° |
| N2 | C2 | C5 | H23 | 50.6° | 60.0° |
| C26 | C23 | C17 | H7 | 177.8° | 180.0° |
| C23 | C26 | C20 | H10 | 177.7° | 180.0° |
| C2 | C5 | C15 | H22 | 120.3° | 120.0° |
| C2 | C5 | C15 | H23 | 120.3° | 120.0° |
| C2 | C5 | C15 | C21 | 48.5° | 180.0° |
| C5 | C2 | H20 | H21 | 120.2° | 120.0° |
| C2 | C5 | H22 | H23 | 119.2° | 120.0° |
| C2 | C5 | C15 | H24 | 168.7° | 60.0° |
| C2 | C5 | C15 | H25 | 71.6° | 60.0° |
| C5 | C15 | C21 | H24 | 120.2° | 120.0° |
| C5 | C15 | C21 | H25 | 120.2° | 120.0° |
| C15 | C5 | C2 | H20 | 50.9° | 60.0° |
| C15 | C5 | C2 | H21 | 69.2° | 60.0° |
| C15 | C5 | H22 | H23 | 119.3° | 120.0° |
| C5 | C15 | H24 | H25 | 119.5° | 120.0° |
| C5 | C15 | C21 | H26 | 180.0° | 60.0° |
| C5 | C15 | C21 | H27 | 60.0° | 60.0° |
| C5 | C15 | C21 | H28 | 60.0° | 180.0° |
| C21 | C15 | C5 | H22 | 71.7° | 60.0° |
| C21 | C15 | C5 | H23 | 168.8° | 60.0° |
| C21 | C15 | H24 | H25 | 119.4° | 120.0° |
| C15 | C21 | H26 | H27 | 120.0° | 120.0° |
| C15 | C21 | H26 | H28 | 120.0° | 120.0° |
| C15 | C21 | H27 | H28 | 120.0° | 120.0° |
| H1 | C13 | C4 | H3 | 171.1° | 180.0° |
| H1 | C13 | C4 | H4 | 52.2° | 60.0° |
| H2 | C13 | C4 | H3 | 51.9° | 60.0° |
| H2 | C13 | C4 | H4 | 67.0° | 180.0° |
| H3 | C4 | C1 | H5 | 49.2° | 180.0° |
| H3 | C4 | C1 | H6 | 67.5° | 60.0° |
| H4 | C4 | C1 | H5 | 69.6° | 60.0° |
| H4 | C4 | C1 | H6 | 173.6° | NaN° |
| H7 | C17 | C23 | H8 | 2.2° | 0.0° |
| H8 | C23 | C26 | H9 | 1.5° | 0.1° |
| H9 | C26 | C20 | H10 | 2.4° | 0.0° |
| H11 | C18 | C24 | H13 | 65.1° | 180.0° |
| H13 | C24 | C25 | H15 | 54.2° | 0.0° |
| H15 | C25 | C19 | H17 | 140.9° | 174.9° |
| H20 | C2 | C5 | H22 | 171.2° | 180.0° |
| H20 | C2 | C5 | H23 | 69.3° | 60.0° |
| H21 | C2 | C5 | H22 | 51.1° | 60.0° |
| H21 | C2 | C5 | H23 | 170.5° | 180.0° |
| H22 | C5 | C15 | H24 | 48.4° | 180.0° |
| H22 | C5 | C15 | H25 | 168.1° | 60.0° |
| H23 | C5 | C15 | H24 | 71.0° | 60.0° |
| H23 | C5 | C15 | H25 | 48.6° | 180.0° |
| H24 | C15 | C21 | H26 | 59.8° | 180.0° |
| H24 | C15 | C21 | H27 | 179.8° | 60.0° |
| H24 | C15 | C21 | H28 | 60.2° | 60.0° |
| H25 | C15 | C21 | H26 | 59.9° | 60.0° |
| H25 | C15 | C21 | H27 | 60.2° | 180.0° |
| H25 | C15 | C21 | H28 | 179.8° | 60.0° |
| H26 | C21 | H27 | H28 | 119.9° | 120.0° |
| H29 | C3 | C6 | H31 | 179.6° | 180.0° |
| H29 | C3 | C6 | H32 | 60.4° | 60.0° |
| H30 | C3 | C6 | H31 | 59.9° | 60.0° |
| H30 | C3 | C6 | H32 | 179.9° | 180.0° |
| H31 | C6 | C16 | H33 | 61.6° | 180.0° |
| H31 | C6 | C16 | H34 | 58.5° | 60.0° |
| H32 | C6 | C16 | H33 | 178.4° | 60.0° |
| H32 | C6 | C16 | H34 | 61.4° | 180.0° |
| H33 | C16 | C22 | H35 | 60.1° | 180.0° |
| H33 | C16 | C22 | H36 | 59.9° | 60.0° |
| H33 | C16 | C22 | H37 | 180.0° | 60.0° |
| H34 | C16 | C22 | H35 | 60.1° | 59.9° |
| H34 | C16 | C22 | H36 | 179.9° | 180.0° |
| H34 | C16 | C22 | H37 | 59.9° | 60.0° |
| H35 | C22 | H36 | H37 | 120.0° | 120.0° |
