UO9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| O2 | C11 | doub | 1.21Å | 1.24Å | |
| C18 | C16 | sing | 1.53Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C16 | S1 | sing | 1.81Å | 1.86Å | |
| C11 | N3 | sing | 1.34Å | 1.33Å | |
| C11 | C10 | sing | 1.51Å | 1.52Å | |
| N3 | C12 | sing | 1.47Å | 1.46Å | |
| O1 | C1 | doub | 1.22Å | 1.21Å | |
| C15 | O5 | sing | 1.45Å | 1.45Å | |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | O5 | sing | 1.35Å | 1.34Å | |
| C1 | N1 | sing | 1.35Å | 1.34Å | |
| C19 | S1 | sing | 1.76Å | 1.80Å | |
| C19 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C10 | C13 | sing | 1.55Å | 1.53Å | |
| S1 | O6 | doub | 1.42Å | 1.50Å | |
| C12 | C13 | sing | 1.54Å | 1.53Å | |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | C4 | sing | 1.53Å | 1.52Å | |
| N1 | C2 | sing | 1.46Å | 1.46Å | |
| C2 | C7 | sing | 1.51Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| N2 | C7 | sing | 1.35Å | 1.34Å | |
| N2 | C8 | sing | 1.47Å | 1.46Å | |
| C7 | O4 | doub | 1.21Å | 1.23Å | |
| C8 | C14 | sing | 1.53Å | 1.51Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C14 | O3 | sing | 1.43Å | 1.41Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| O3 | H26 | sing | 0.97Å | 0.95Å | |
| C20 | H27 | sing | 1.08Å | 1.08Å | |
| C22 | H28 | sing | 1.08Å | 1.08Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| C18 | H30 | sing | 1.09Å | 1.10Å | |
| C18 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.08Å | 1.08Å | |
| C23 | H33 | sing | 1.08Å | 1.08Å | |
| C24 | H34 | sing | 1.08Å | 1.08Å | |
| N1 | H35 | sing | 0.97Å | 1.00Å | |
| N2 | H36 | sing | 0.97Å | 1.00Å | |
| N3 | H37 | sing | 0.97Å | 1.00Å | |
| C14 | S2 | sing | 1.81Å | 34.91Å | |
| S2 | O7 | doub | 1.42Å | 0.00Å | |
| S2 | O8 | doub | 1.42Å | 0.00Å | |
| S2 | O9 | sing | 1.52Å | 0.00Å | |
| O9 | H14 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C18 | 111.6° | 109.5° |
| C17 | C16 | C15 | 109.0° | 109.4° |
| C17 | C16 | S1 | 108.0° | 109.5° |
| C16 | C17 | H23 | 109.5° | 109.5° |
| C16 | C17 | H24 | 109.5° | 109.5° |
| C16 | C17 | H25 | 109.5° | 109.5° |
| O2 | C11 | N3 | 125.4° | 125.0° |
| O2 | C11 | C10 | 125.4° | 124.9° |
| C18 | C16 | C15 | 108.7° | 109.4° |
| C18 | C16 | S1 | 112.6° | 109.5° |
| C16 | C18 | H29 | 109.5° | 109.5° |
| C16 | C18 | H30 | 109.5° | 109.5° |
| C16 | C18 | H31 | 109.5° | 109.5° |
| C15 | C16 | S1 | 106.8° | 109.5° |
| C16 | C15 | O5 | 109.4° | 109.5° |
| C16 | C15 | H21 | 109.5° | 109.4° |
| C16 | C15 | H22 | 109.5° | 109.4° |
| C16 | S1 | C19 | 101.5° | 103.0° |
| C16 | S1 | O6 | 106.1° | 109.5° |
| N3 | C11 | C10 | 109.2° | 110.1° |
| C11 | N3 | C12 | 114.0° | 111.3° |
| C11 | N3 | H37 | 123.0° | 124.3° |
| C11 | C10 | C9 | 112.8° | 110.5° |
| C11 | C10 | C13 | 103.9° | 104.2° |
| C11 | C10 | H4 | 108.3° | 110.6° |
| N3 | C12 | C13 | 103.4° | 105.5° |
| N3 | C12 | H17 | 111.0° | 110.3° |
| N3 | C12 | H18 | 111.0° | 110.3° |
| C12 | N3 | H37 | 123.0° | 124.4° |
| O1 | C1 | O5 | 124.3° | 120.0° |
| O1 | C1 | N1 | 124.6° | 120.0° |
| C15 | O5 | C1 | 114.3° | 117.0° |
| O5 | C15 | H21 | 109.5° | 109.5° |
| O5 | C15 | H22 | 109.5° | 109.5° |
| C20 | C21 | C22 | 120.4° | 120.1° |
| C21 | C20 | C19 | 119.6° | 119.9° |
| C21 | C20 | H27 | 120.2° | 120.0° |
| C20 | C21 | H32 | 119.8° | 120.0° |
| C21 | C22 | C23 | 119.9° | 120.0° |
| C21 | C22 | H28 | 120.1° | 120.0° |
| C22 | C21 | H32 | 119.8° | 120.0° |
| C20 | C19 | S1 | 120.0° | 120.0° |
| C20 | C19 | C24 | 120.2° | 120.0° |
| C19 | C20 | H27 | 120.2° | 120.0° |
| C22 | C23 | C24 | 120.2° | 120.0° |
| C23 | C22 | H28 | 120.1° | 120.0° |
| C22 | C23 | H33 | 119.9° | 120.0° |
| O5 | C1 | N1 | 111.0° | 120.0° |
| C1 | N1 | C2 | 120.1° | 120.0° |
| C1 | N1 | H35 | 119.9° | 120.0° |
| S1 | C19 | C24 | 119.8° | 120.0° |
| C19 | S1 | O6 | 106.4° | 103.0° |
| C19 | C24 | C23 | 119.8° | 120.0° |
| C19 | C24 | H34 | 120.1° | 120.0° |
| C9 | C10 | C13 | 115.2° | 110.5° |
| C10 | C9 | C8 | 113.5° | 109.5° |
| C9 | C10 | H4 | 108.2° | 110.4° |
| C10 | C9 | H19 | 108.4° | 109.5° |
| C10 | C9 | H20 | 108.5° | 109.5° |
| C10 | C13 | C12 | 104.9° | 101.8° |
| C13 | C10 | H4 | 108.2° | 110.5° |
| C10 | C13 | H15 | 110.6° | 110.9° |
| C10 | C13 | H16 | 110.6° | 111.0° |
| C12 | C13 | H15 | 110.6° | 111.0° |
| C12 | C13 | H16 | 110.6° | 111.1° |
| C13 | C12 | H17 | 111.0° | 110.3° |
| C13 | C12 | H18 | 111.0° | 110.2° |
| C24 | C23 | H33 | 119.9° | 119.9° |
| C23 | C24 | H34 | 120.1° | 120.0° |
| C9 | C8 | N2 | 111.6° | 109.5° |
| C9 | C8 | C14 | 111.1° | 109.5° |
| C9 | C8 | H12 | 107.7° | 109.5° |
| C8 | C9 | H19 | 108.5° | 109.4° |
| C8 | C9 | H20 | 108.5° | 109.5° |
| C6 | C4 | C3 | 111.2° | 109.4° |
| C6 | C4 | C5 | 110.7° | 109.5° |
| C6 | C4 | H8 | 108.2° | 109.5° |
| C4 | C6 | H9 | 109.5° | 109.5° |
| C4 | C6 | H10 | 109.5° | 109.5° |
| C4 | C6 | H11 | 109.5° | 109.4° |
| N1 | C2 | C7 | 112.0° | 109.5° |
| N1 | C2 | C3 | 110.8° | 109.5° |
| N1 | C2 | H5 | 108.7° | 109.5° |
| C2 | N1 | H35 | 119.9° | 120.0° |
| C7 | C2 | C3 | 109.6° | 109.5° |
| C2 | C7 | N2 | 116.8° | 120.0° |
| C2 | C7 | O4 | 120.4° | 120.0° |
| C7 | C2 | H5 | 107.8° | 109.5° |
| C2 | C3 | C4 | 115.5° | 109.5° |
| C3 | C2 | H5 | 107.8° | 109.4° |
| C2 | C3 | H6 | 107.9° | 109.5° |
| C2 | C3 | H7 | 108.0° | 109.4° |
| C7 | N2 | C8 | 122.7° | 120.0° |
| N2 | C7 | O4 | 122.8° | 120.0° |
| C7 | N2 | H36 | 118.6° | 120.0° |
| N2 | C8 | C14 | 110.0° | 109.5° |
| N2 | C8 | H12 | 108.5° | 109.5° |
| C8 | N2 | H36 | 118.7° | 120.0° |
| C8 | C14 | O3 | 111.2° | 109.4° |
| C14 | C8 | H12 | 107.9° | 109.4° |
| C8 | C14 | H13 | 98.4° | 109.5° |
| C8 | C14 | S2 | 95.8° | 109.5° |
| C3 | C4 | C5 | 110.6° | 109.5° |
| C4 | C3 | H6 | 108.0° | 109.5° |
| C4 | C3 | H7 | 108.0° | 109.4° |
| C3 | C4 | H8 | 108.0° | 109.5° |
| C4 | C5 | H1 | 109.5° | 109.5° |
| C4 | C5 | H2 | 109.5° | 109.4° |
| C4 | C5 | H3 | 109.4° | 109.5° |
| C5 | C4 | H8 | 108.0° | 109.5° |
| O3 | C14 | H13 | 99.0° | 109.5° |
| C14 | O3 | H26 | 109.5° | 114.0° |
| O3 | C14 | S2 | 149.5° | 109.5° |
| H1 | C5 | H2 | 109.5° | 109.5° |
| H1 | C5 | H3 | 109.5° | 109.5° |
| H2 | C5 | H3 | 109.4° | 109.5° |
| H6 | C3 | H7 | 109.4° | 109.5° |
| H9 | C6 | H10 | 109.4° | 109.5° |
| H9 | C6 | H11 | 109.5° | 109.5° |
| H10 | C6 | H11 | 109.5° | 109.5° |
| H13 | C14 | S2 | 90.4° | 109.5° |
| H15 | C13 | H16 | 109.5° | 110.8° |
| H17 | C12 | H18 | 109.5° | 110.2° |
| H19 | C9 | H20 | 109.5° | 109.5° |
| H21 | C15 | H22 | 109.5° | 109.5° |
| H23 | C17 | H24 | 109.5° | 109.4° |
| H23 | C17 | H25 | 109.5° | 109.5° |
| H24 | C17 | H25 | 109.5° | 109.4° |
| H29 | C18 | H30 | 109.5° | 109.5° |
| H29 | C18 | H31 | 109.5° | 109.4° |
| H30 | C18 | H31 | 109.5° | 109.4° |
| C14 | S2 | O7 | 90.0° | 110.5° |
| C14 | S2 | O8 | 90.0° | 110.5° |
| C14 | S2 | O9 | 90.0° | 104.4° |
| O7 | S2 | O8 | 90.0° | 121.1° |
| O7 | S2 | O9 | 90.0° | 104.2° |
| O8 | S2 | O9 | 90.0° | 104.3° |
| S2 | O9 | H14 | 90.0° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C18 | C15 | 120.3° | 120.0° |
| C17 | C16 | C18 | S1 | 121.6° | 120.0° |
| C17 | C16 | C15 | S1 | 116.4° | 120.0° |
| C17 | C16 | C15 | O5 | 162.5° | 60.0° |
| C17 | C16 | S1 | C19 | 83.9° | 60.0° |
| C17 | C16 | S1 | O6 | 165.1° | 49.0° |
| C17 | C16 | C15 | H21 | 77.6° | 60.0° |
| C17 | C16 | C15 | H22 | 42.5° | 180.0° |
| C16 | C17 | H23 | H24 | 120.0° | 120.0° |
| C16 | C17 | H23 | H25 | 120.0° | 120.1° |
| C16 | C17 | H24 | H25 | 120.0° | 120.0° |
| C17 | C16 | C18 | H29 | 180.0° | 180.0° |
| C17 | C16 | C18 | H30 | 60.0° | 60.0° |
| C17 | C16 | C18 | H31 | 60.0° | 60.0° |
| O2 | C11 | N3 | C10 | 178.3° | 180.0° |
| O2 | C11 | N3 | C12 | 174.6° | 179.6° |
| O2 | C11 | C10 | C9 | 46.0° | 45.1° |
| O2 | C11 | C10 | C13 | 171.4° | 163.8° |
| O2 | C11 | C10 | H4 | 73.7° | 77.5° |
| O2 | C11 | N3 | H37 | 5.4° | 0.4° |
| C18 | C16 | C15 | S1 | 121.7° | 120.0° |
| C18 | C16 | C15 | O5 | 40.6° | 60.0° |
| C18 | C16 | S1 | C19 | 39.7° | 60.0° |
| C18 | C16 | S1 | O6 | 71.2° | 169.1° |
| C18 | C16 | C15 | H21 | 160.6° | 180.0° |
| C18 | C16 | C15 | H22 | 79.4° | 60.0° |
| C18 | C16 | C17 | H23 | 180.0° | 60.0° |
| C18 | C16 | C17 | H24 | 60.0° | 60.0° |
| C18 | C16 | C17 | H25 | 60.0° | 180.0° |
| C16 | C18 | H29 | H30 | 120.0° | 120.0° |
| C16 | C18 | H29 | H31 | 120.0° | 120.0° |
| C16 | C18 | H30 | H31 | 120.0° | 120.0° |
| C16 | C15 | O5 | H21 | 120.0° | 120.0° |
| C16 | C15 | O5 | H22 | 120.0° | 120.0° |
| C16 | C15 | O5 | C1 | 153.1° | 180.0° |
| C15 | C16 | S1 | C19 | 158.9° | 180.0° |
| C15 | C16 | S1 | O6 | 48.0° | 71.0° |
| C16 | C15 | H21 | H22 | 120.0° | 119.9° |
| C15 | C16 | C17 | H23 | 59.9° | 60.0° |
| C15 | C16 | C17 | H24 | 179.9° | 180.0° |
| C15 | C16 | C17 | H25 | 60.1° | 60.0° |
| C15 | C16 | C18 | H29 | 59.7° | 60.0° |
| C15 | C16 | C18 | H30 | 60.3° | 180.0° |
| C15 | C16 | C18 | H31 | 179.7° | 60.0° |
| S1 | C16 | C15 | O5 | 81.1° | 180.0° |
| C16 | S1 | C19 | C20 | 96.4° | 89.7° |
| C16 | S1 | C19 | O6 | 110.8° | 113.9° |
| C16 | S1 | C19 | C24 | 82.6° | 90.0° |
| S1 | C16 | C15 | H21 | 38.9° | 60.0° |
| S1 | C16 | C15 | H22 | 158.9° | 60.0° |
| S1 | C16 | C17 | H23 | 55.7° | 180.0° |
| S1 | C16 | C17 | H24 | 64.3° | 60.0° |
| S1 | C16 | C17 | H25 | 175.7° | 60.0° |
| S1 | C16 | C18 | H29 | 58.4° | 60.0° |
| S1 | C16 | C18 | H30 | 178.4° | 60.1° |
| S1 | C16 | C18 | H31 | 61.7° | 180.0° |
| C11 | N3 | C12 | H37 | 180.0° | 180.0° |
| N3 | C11 | C10 | C9 | 135.7° | 134.9° |
| N3 | C11 | C10 | C13 | 10.2° | 16.2° |
| C11 | N3 | C12 | C13 | 16.0° | 17.0° |
| N3 | C11 | C10 | H4 | 104.6° | 102.5° |
| C11 | N3 | C12 | H17 | 103.0° | 136.1° |
| C11 | N3 | C12 | H18 | 135.0° | 102.0° |
| C10 | C11 | N3 | C12 | 3.8° | 0.4° |
| C11 | C10 | C9 | C13 | 119.1° | 114.8° |
| C11 | C10 | C9 | H4 | 119.8° | 122.7° |
| C11 | C10 | C13 | H4 | 114.9° | 118.8° |
| C11 | C10 | C13 | C12 | 19.2° | 24.7° |
| C11 | C10 | C9 | C8 | 178.8° | 179.6° |
| C11 | C10 | C13 | H15 | 100.1° | 93.4° |
| C11 | C10 | C13 | H16 | 138.5° | 143.0° |
| C11 | C10 | C9 | H19 | 60.6° | 60.4° |
| C11 | C10 | C9 | H20 | 58.1° | 59.6° |
| C10 | C11 | N3 | H37 | 176.2° | 179.6° |
| N3 | C12 | C13 | C10 | 21.1° | 25.4° |
| N3 | C12 | C13 | H17 | 119.0° | 119.1° |
| N3 | C12 | C13 | H18 | 119.0° | 119.0° |
| N3 | C12 | C13 | H15 | 98.2° | 92.7° |
| N3 | C12 | C13 | H16 | 140.4° | 143.5° |
| N3 | C12 | H17 | H18 | 122.8° | 121.9° |
| O1 | C1 | O5 | C15 | 7.9° | 0.1° |
| O1 | C1 | O5 | N1 | 178.0° | 179.9° |
| O1 | C1 | N1 | C2 | 13.7° | 5.1° |
| O1 | C1 | N1 | H35 | 166.3° | 175.0° |
| C15 | O5 | C1 | N1 | 170.1° | 180.0° |
| O5 | C15 | H21 | H22 | 120.0° | 120.1° |
| C20 | C21 | C22 | H32 | 180.0° | 180.0° |
| C21 | C20 | C19 | H27 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.1° | 0.3° |
| C21 | C20 | C19 | S1 | 179.6° | 180.0° |
| C21 | C20 | C19 | C24 | 0.6° | 0.4° |
| C20 | C21 | C22 | H28 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 0.4° | 0.0° |
| C21 | C22 | C23 | H28 | 180.0° | 179.7° |
| C21 | C22 | C23 | C24 | 0.1° | 0.3° |
| C22 | C21 | C20 | H27 | 179.6° | 179.9° |
| C21 | C22 | C23 | H33 | 180.0° | 179.7° |
| C20 | C19 | S1 | C24 | 179.0° | 179.7° |
| C20 | C19 | S1 | O6 | 152.8° | 24.2° |
| C20 | C19 | C24 | C23 | 0.5° | 0.3° |
| C19 | C20 | C21 | H32 | 179.6° | 179.9° |
| C20 | C19 | C24 | H34 | 179.5° | 179.7° |
| C22 | C23 | C24 | C19 | 0.2° | 0.0° |
| C22 | C23 | C24 | H33 | 180.0° | 180.0° |
| C23 | C22 | C21 | H32 | 179.9° | 179.7° |
| C22 | C23 | C24 | H34 | 179.8° | 180.0° |
| O5 | C1 | N1 | C2 | 164.3° | 175.0° |
| C1 | O5 | C15 | H21 | 86.9° | 60.1° |
| C1 | O5 | C15 | H22 | 33.1° | 60.0° |
| O5 | C1 | N1 | H35 | 15.7° | 4.9° |
| C1 | N1 | C2 | H35 | 180.0° | 179.9° |
| C1 | N1 | C2 | C7 | 64.3° | 151.7° |
| C1 | N1 | C2 | C3 | 172.9° | 88.3° |
| C1 | N1 | C2 | H5 | 54.7° | 31.7° |
| S1 | C19 | C24 | C23 | 179.5° | 180.0° |
| S1 | C19 | C20 | H27 | 0.4° | 0.1° |
| S1 | C19 | C24 | H34 | 0.5° | 0.0° |
| C24 | C19 | S1 | O6 | 28.2° | 156.2° |
| C19 | C24 | C23 | H34 | 180.0° | 180.0° |
| C24 | C19 | C20 | H27 | 179.4° | 179.8° |
| C19 | C24 | C23 | H33 | 179.8° | 180.0° |
| C9 | C10 | C13 | H4 | 121.1° | 122.5° |
| C9 | C10 | C13 | C12 | 143.1° | 143.4° |
| C10 | C9 | C8 | H19 | 120.6° | 120.0° |
| C10 | C9 | C8 | H20 | 120.6° | 120.1° |
| C10 | C9 | C8 | N2 | 68.9° | 62.9° |
| C10 | C9 | C8 | C14 | 168.0° | 177.1° |
| C10 | C9 | C8 | H12 | 50.1° | 57.1° |
| C9 | C10 | C13 | H15 | 23.8° | 25.3° |
| C9 | C10 | C13 | H16 | 97.6° | 98.3° |
| C10 | C9 | H19 | H20 | 118.1° | 120.1° |
| C10 | C13 | C12 | H15 | 119.3° | 118.1° |
| C10 | C13 | C12 | H16 | 119.3° | 118.2° |
| C13 | C10 | C9 | C8 | 62.2° | 65.6° |
| C10 | C13 | H15 | H16 | 122.1° | 123.7° |
| C10 | C13 | C12 | H17 | 98.0° | 144.5° |
| C10 | C13 | C12 | H18 | 140.1° | 93.6° |
| C13 | C10 | C9 | H19 | 58.4° | 54.3° |
| C13 | C10 | C9 | H20 | 177.2° | 174.4° |
| C12 | C13 | C10 | H4 | 95.7° | 94.0° |
| C12 | C13 | H15 | H16 | 122.1° | 123.9° |
| C13 | C12 | H17 | H18 | 122.8° | 121.9° |
| C13 | C12 | N3 | H37 | 163.9° | 163.0° |
| C24 | C23 | C22 | H28 | 179.9° | 180.0° |
| C9 | C8 | N2 | C7 | 106.9° | 60.7° |
| C9 | C8 | N2 | C14 | 123.7° | 120.0° |
| C9 | C8 | N2 | H12 | 118.5° | 120.0° |
| C9 | C8 | C14 | H12 | 117.8° | 120.0° |
| C9 | C8 | C14 | O3 | 172.3° | 58.6° |
| C8 | C9 | C10 | H4 | 59.0° | 56.9° |
| C9 | C8 | C14 | H13 | 69.2° | 61.4° |
| C8 | C9 | H19 | H20 | 118.2° | 120.0° |
| C9 | C8 | N2 | H36 | 73.1° | 119.2° |
| C9 | C8 | C14 | S2 | 22.0° | 178.6° |
| C6 | C4 | C3 | C2 | 65.4° | 66.5° |
| C6 | C4 | C3 | C5 | 123.4° | 120.0° |
| C6 | C4 | C3 | H8 | 118.5° | 120.0° |
| C6 | C4 | C5 | H8 | 118.3° | 120.0° |
| C6 | C4 | C5 | H1 | 180.0° | 180.0° |
| C6 | C4 | C5 | H2 | 60.0° | 60.0° |
| C6 | C4 | C5 | H3 | 60.0° | 60.0° |
| C6 | C4 | C3 | H6 | 173.7° | 53.5° |
| C6 | C4 | C3 | H7 | 55.5° | 173.5° |
| C4 | C6 | H9 | H10 | 120.0° | 120.0° |
| C4 | C6 | H9 | H11 | 120.0° | 120.0° |
| C4 | C6 | H10 | H11 | 120.0° | 120.0° |
| N1 | C2 | C7 | C3 | 123.4° | 120.0° |
| N1 | C2 | C7 | H5 | 119.5° | 120.0° |
| N1 | C2 | C3 | H5 | 118.8° | 120.0° |
| N1 | C2 | C7 | N2 | 144.9° | 166.7° |
| N1 | C2 | C7 | O4 | 35.0° | 13.3° |
| N1 | C2 | C3 | C4 | 57.8° | 173.5° |
| N1 | C2 | C3 | H6 | 63.1° | 53.5° |
| N1 | C2 | C3 | H7 | 178.7° | 66.5° |
| C7 | C2 | C3 | H5 | 117.0° | 120.0° |
| C2 | C7 | N2 | O4 | 179.8° | 180.0° |
| C2 | C7 | N2 | C8 | 178.2° | 175.3° |
| C7 | C2 | C3 | C4 | 178.0° | 66.4° |
| C7 | C2 | C3 | H6 | 61.1° | 173.5° |
| C7 | C2 | C3 | H7 | 57.1° | 53.5° |
| C7 | C2 | N1 | H35 | 115.7° | 28.4° |
| C2 | C7 | N2 | H36 | 1.9° | 4.8° |
| C3 | C2 | C7 | N2 | 91.7° | 73.3° |
| C3 | C2 | C7 | O4 | 88.5° | 106.7° |
| C2 | C3 | C4 | H6 | 120.9° | 120.1° |
| C2 | C3 | C4 | H7 | 120.9° | 120.0° |
| C2 | C3 | C4 | C5 | 171.2° | 173.5° |
| C2 | C3 | H6 | H7 | 117.3° | 120.0° |
| C2 | C3 | C4 | H8 | 53.1° | 53.4° |
| C3 | C2 | N1 | H35 | 7.1° | 91.7° |
| C7 | N2 | C8 | H36 | 180.0° | 179.9° |
| C7 | N2 | C8 | C14 | 129.3° | 59.3° |
| N2 | C7 | C2 | H5 | 25.3° | 46.7° |
| C7 | N2 | C8 | H12 | 11.6° | 179.3° |
| C8 | N2 | C7 | O4 | 1.7° | 4.7° |
| N2 | C8 | C14 | H12 | 118.2° | 120.0° |
| N2 | C8 | C14 | O3 | 63.6° | 178.7° |
| N2 | C8 | C14 | H13 | 166.7° | 58.7° |
| N2 | C8 | C9 | H19 | 170.5° | 177.2° |
| N2 | C8 | C9 | H20 | 51.7° | 57.2° |
| N2 | C8 | C14 | S2 | 102.1° | 61.4° |
| O4 | C7 | C2 | H5 | 154.5° | 133.3° |
| O4 | C7 | N2 | H36 | 178.3° | 175.2° |
| C8 | C14 | O3 | H13 | 102.7° | 120.0° |
| C8 | C14 | O3 | S2 | 150.9° | 120.0° |
| C8 | C14 | H13 | S2 | 96.0° | 120.0° |
| C14 | C8 | C9 | H19 | 47.4° | 57.2° |
| C14 | C8 | C9 | H20 | 71.4° | 62.8° |
| C8 | C14 | O3 | H26 | 180.0° | 60.0° |
| C14 | C8 | N2 | H36 | 50.6° | 120.8° |
| C8 | C14 | S2 | O7 | 90.0° | 51.2° |
| C8 | C14 | S2 | O8 | 90.0° | 172.0° |
| C8 | C14 | S2 | O9 | 90.0° | 60.4° |
| C3 | C4 | C5 | H8 | 118.0° | 120.0° |
| C3 | C4 | C5 | H1 | 56.3° | 60.0° |
| C3 | C4 | C5 | H2 | 63.7° | 180.0° |
| C3 | C4 | C5 | H3 | 176.3° | 60.0° |
| C4 | C3 | C2 | H5 | 61.0° | 53.5° |
| C4 | C3 | H6 | H7 | 117.3° | 120.0° |
| C3 | C4 | C6 | H9 | 180.0° | 175.9° |
| C3 | C4 | C6 | H10 | 60.0° | 55.9° |
| C3 | C4 | C6 | H11 | 60.0° | 64.1° |
| C4 | C5 | H1 | H2 | 120.0° | 119.9° |
| C4 | C5 | H1 | H3 | 120.0° | 120.0° |
| C4 | C5 | H2 | H3 | 120.0° | 120.0° |
| C5 | C4 | C3 | H6 | 50.3° | 66.5° |
| C5 | C4 | C3 | H7 | 67.9° | 53.5° |
| C5 | C4 | C6 | H9 | 56.6° | 64.2° |
| C5 | C4 | C6 | H10 | 63.3° | 175.8° |
| C5 | C4 | C6 | H11 | 176.7° | 55.8° |
| O3 | C14 | C8 | H12 | 54.6° | 61.4° |
| O3 | C14 | H13 | S2 | 150.9° | 120.0° |
| O3 | C14 | S2 | O7 | 90.0° | 68.8° |
| O3 | C14 | S2 | O8 | 90.0° | 68.0° |
| O3 | C14 | S2 | O9 | 90.0° | 179.7° |
| H1 | C5 | H2 | H3 | 120.0° | 120.0° |
| H1 | C5 | C4 | H8 | 61.7° | 60.0° |
| H2 | C5 | C4 | H8 | 178.3° | 60.0° |
| H3 | C5 | C4 | H8 | 58.3° | 180.0° |
| H4 | C10 | C13 | H15 | 145.0° | 147.9° |
| H4 | C10 | C13 | H16 | 23.5° | 24.2° |
| H4 | C10 | C9 | H19 | 179.6° | 176.9° |
| H4 | C10 | C9 | H20 | 61.6° | 63.1° |
| H5 | C2 | C3 | H6 | 178.1° | 66.5° |
| H5 | C2 | C3 | H7 | 59.9° | 173.5° |
| H5 | C2 | N1 | H35 | 125.3° | 148.4° |
| H6 | C3 | C4 | H8 | 67.8° | 173.5° |
| H7 | C3 | C4 | H8 | 174.0° | 66.5° |
| H8 | C4 | C6 | H9 | 61.6° | 55.9° |
| H8 | C4 | C6 | H10 | 178.5° | 64.1° |
| H8 | C4 | C6 | H11 | 58.5° | 175.9° |
| H9 | C6 | H10 | H11 | 120.0° | 120.0° |
| H12 | C8 | C14 | H13 | 48.5° | 178.6° |
| H12 | C8 | C9 | H19 | 70.5° | 62.8° |
| H12 | C8 | C9 | H20 | 170.7° | 177.2° |
| H12 | C8 | N2 | H36 | 168.4° | 0.8° |
| H12 | C8 | C14 | S2 | 139.8° | 58.6° |
| H13 | C14 | O3 | H26 | 77.3° | 60.0° |
| H13 | C14 | S2 | O7 | 90.0° | 171.2° |
| H13 | C14 | S2 | O8 | 90.0° | 52.0° |
| H13 | C14 | S2 | O9 | 90.0° | 59.6° |
| H15 | C13 | C12 | H17 | 142.8° | 26.4° |
| H15 | C13 | C12 | H18 | 20.8° | 148.3° |
| H16 | C13 | C12 | H17 | 21.3° | 97.4° |
| H16 | C13 | C12 | H18 | 100.6° | 24.5° |
| H17 | C12 | N3 | H37 | 77.0° | 43.9° |
| H18 | C12 | N3 | H37 | 44.9° | 78.0° |
| H23 | C17 | H24 | H25 | 120.0° | 119.9° |
| H26 | O3 | C14 | S2 | 29.1° | 180.0° |
| H27 | C20 | C21 | H32 | 0.4° | 0.0° |
| H28 | C22 | C21 | H32 | 0.1° | 0.0° |
| H28 | C22 | C23 | H33 | 0.0° | 0.0° |
| H29 | C18 | H30 | H31 | 120.0° | 119.9° |
| H33 | C23 | C24 | H34 | 0.2° | 0.0° |
| C14 | S2 | O7 | O8 | 90.0° | 131.5° |
| C14 | S2 | O7 | O9 | 90.0° | 111.7° |
| C14 | S2 | O8 | O9 | 90.0° | 111.7° |
| C14 | S2 | O9 | H14 | 90.0° | 180.0° |
| O7 | S2 | O8 | O9 | 90.0° | 116.7° |
| O7 | S2 | O9 | H14 | 90.0° | 64.0° |
| O8 | S2 | O9 | H14 | 90.0° | 63.9° |
