KPW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C33 | C32 | sing | 1.51Å | 1.41Å | |
| C31 | C32 | doub | 1.38Å | 1.40Å | Aromatic |
| C31 | C30 | sing | 1.39Å | 1.40Å | Aromatic |
| C32 | N34 | sing | 1.32Å | 1.37Å | Aromatic |
| C30 | C29 | doub | 1.38Å | 1.41Å | Aromatic |
| N34 | C28 | doub | 1.33Å | 1.35Å | Aromatic |
| C29 | C28 | sing | 1.39Å | 1.41Å | Aromatic |
| C28 | C27 | sing | 1.48Å | 1.36Å | |
| N26 | C27 | doub | 1.31Å | 1.32Å | Aromatic |
| N26 | N25 | sing | 1.41Å | 1.32Å | Aromatic |
| C27 | C18 | sing | 1.42Å | 1.37Å | Aromatic |
| N25 | C24 | sing | 1.47Å | 1.45Å | |
| N25 | C19 | sing | 1.35Å | 1.36Å | Aromatic |
| C18 | C16 | sing | 1.48Å | 1.39Å | |
| C18 | C19 | doub | 1.37Å | 1.36Å | Aromatic |
| C24 | C21 | sing | 1.54Å | 1.54Å | |
| C16 | C17 | doub | 1.39Å | 1.41Å | Aromatic |
| C16 | C15 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.43Å | |
| C17 | C12 | sing | 1.39Å | 1.43Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | N11 | sing | 1.39Å | 1.37Å | |
| C12 | N13 | doub | 1.32Å | 1.34Å | Aromatic |
| C14 | N13 | sing | 1.32Å | 1.39Å | Aromatic |
| N11 | C8 | sing | 1.40Å | 1.38Å | |
| C23 | C21 | sing | 1.53Å | 1.57Å | |
| C20 | C21 | sing | 1.55Å | 1.58Å | |
| C21 | C22 | sing | 1.53Å | 1.55Å | |
| C8 | C9 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | S2 | sing | 1.76Å | 1.79Å | |
| N1 | S2 | sing | 1.66Å | 1.64Å | |
| O3 | S2 | doub | 1.42Å | 1.52Å | |
| S2 | O4 | doub | 1.42Å | 1.48Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.08Å | 1.08Å | |
| N11 | H5 | sing | 0.97Å | 1.00Å | |
| C9 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C33 | H11 | sing | 1.09Å | 1.10Å | |
| C33 | H12 | sing | 1.09Å | 1.10Å | |
| C33 | H13 | sing | 1.09Å | 1.10Å | |
| C31 | H14 | sing | 1.08Å | 1.08Å | |
| C30 | H15 | sing | 1.08Å | 1.08Å | |
| C29 | H16 | sing | 1.08Å | 1.08Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C33 | C32 | C31 | 119.9° | 119.6° |
| C33 | C32 | N34 | 121.1° | 119.6° |
| C32 | C33 | H11 | 109.5° | 109.5° |
| C32 | C33 | H12 | 109.5° | 109.5° |
| C32 | C33 | H13 | 109.5° | 109.5° |
| C32 | C31 | C30 | 117.9° | 119.4° |
| C31 | C32 | N34 | 119.1° | 120.9° |
| C32 | C31 | H14 | 121.0° | 120.3° |
| C31 | C30 | C29 | 121.6° | 118.5° |
| C30 | C31 | H14 | 121.0° | 120.3° |
| C31 | C30 | H15 | 119.2° | 120.8° |
| C32 | N34 | C28 | 125.0° | 121.6° |
| C30 | C29 | C28 | 118.5° | 119.0° |
| C29 | C30 | H15 | 119.2° | 120.8° |
| C30 | C29 | H16 | 120.7° | 120.4° |
| N34 | C28 | C29 | 117.9° | 120.6° |
| N34 | C28 | C27 | 119.4° | 119.7° |
| C29 | C28 | C27 | 122.7° | 119.7° |
| C28 | C29 | H16 | 120.8° | 120.5° |
| C28 | C27 | N26 | 119.8° | 126.1° |
| C28 | C27 | C18 | 132.0° | 126.1° |
| C27 | N26 | N25 | 109.5° | 108.6° |
| N26 | C27 | C18 | 108.2° | 107.8° |
| N26 | N25 | C24 | 137.3° | 140.9° |
| N26 | N25 | C19 | 108.3° | 108.2° |
| C27 | C18 | C16 | 128.0° | 126.3° |
| C27 | C18 | C19 | 106.5° | 107.4° |
| C24 | N25 | C19 | 114.4° | 111.0° |
| N25 | C24 | C21 | 104.9° | 105.6° |
| N25 | C24 | H17 | 110.6° | 110.2° |
| N25 | C24 | H18 | 110.6° | 110.2° |
| N25 | C19 | C18 | 107.5° | 108.0° |
| N25 | C19 | C20 | 108.5° | 110.2° |
| C16 | C18 | C19 | 125.5° | 126.2° |
| C18 | C16 | C17 | 124.4° | 120.8° |
| C18 | C16 | C15 | 121.1° | 120.9° |
| C18 | C19 | C20 | 144.0° | 141.8° |
| C24 | C21 | C23 | 110.1° | 111.0° |
| C24 | C21 | C20 | 101.4° | 101.8° |
| C24 | C21 | C22 | 111.3° | 111.0° |
| C21 | C24 | H17 | 110.6° | 110.2° |
| C21 | C24 | H18 | 110.6° | 110.2° |
| C17 | C16 | C15 | 114.5° | 118.3° |
| C16 | C17 | C12 | 122.5° | 118.9° |
| C16 | C17 | H10 | 118.7° | 120.5° |
| C16 | C15 | C14 | 122.7° | 119.2° |
| C16 | C15 | H9 | 118.6° | 120.4° |
| C19 | C20 | C21 | 107.8° | 104.2° |
| C19 | C20 | H25 | 109.9° | 110.6° |
| C19 | C20 | H26 | 109.9° | 110.4° |
| C17 | C12 | N11 | 118.6° | 119.7° |
| C17 | C12 | N13 | 120.0° | 120.7° |
| C12 | C17 | H10 | 118.8° | 120.5° |
| C15 | C14 | N13 | 120.6° | 121.0° |
| C15 | C14 | H8 | 119.7° | 119.5° |
| C14 | C15 | H9 | 118.7° | 120.4° |
| N11 | C12 | N13 | 121.3° | 119.6° |
| C12 | N11 | C8 | 128.6° | 120.0° |
| C12 | N11 | H5 | 115.7° | 120.0° |
| C12 | N13 | C14 | 119.6° | 121.9° |
| N13 | C14 | H8 | 119.7° | 119.5° |
| N11 | C8 | C9 | 128.9° | 120.0° |
| N11 | C8 | C7 | 113.3° | 120.1° |
| C8 | N11 | H5 | 115.7° | 120.0° |
| C23 | C21 | C20 | 113.1° | 111.0° |
| C23 | C21 | C22 | 109.9° | 110.8° |
| C21 | C23 | H22 | 109.5° | 109.5° |
| C21 | C23 | H23 | 109.5° | 109.4° |
| C21 | C23 | H24 | 109.5° | 109.5° |
| C20 | C21 | C22 | 110.8° | 111.0° |
| C21 | C20 | H25 | 109.9° | 110.5° |
| C21 | C20 | H26 | 109.9° | 110.5° |
| C21 | C22 | H19 | 109.5° | 109.5° |
| C21 | C22 | H20 | 109.5° | 109.5° |
| C21 | C22 | H21 | 109.5° | 109.5° |
| C9 | C8 | C7 | 117.8° | 119.9° |
| C8 | C9 | C10 | 122.1° | 119.9° |
| C8 | C9 | H6 | 119.0° | 120.1° |
| C8 | C7 | C6 | 120.0° | 119.9° |
| C8 | C7 | H4 | 120.0° | 120.0° |
| C9 | C10 | C5 | 119.4° | 120.1° |
| C10 | C9 | H6 | 118.9° | 120.0° |
| C9 | C10 | H7 | 120.3° | 120.0° |
| C7 | C6 | C5 | 122.0° | 120.1° |
| C7 | C6 | H3 | 119.0° | 119.9° |
| C6 | C7 | H4 | 120.0° | 120.0° |
| C10 | C5 | C6 | 118.7° | 120.1° |
| C10 | C5 | S2 | 122.7° | 119.9° |
| C5 | C10 | H7 | 120.3° | 120.0° |
| C6 | C5 | S2 | 118.4° | 119.9° |
| C5 | C6 | H3 | 119.0° | 120.0° |
| C5 | S2 | N1 | 107.4° | 107.2° |
| C5 | S2 | O3 | 104.5° | 106.4° |
| C5 | S2 | O4 | 107.6° | 106.4° |
| N1 | S2 | O3 | 113.0° | 106.4° |
| N1 | S2 | O4 | 108.5° | 106.4° |
| S2 | N1 | H1 | 109.5° | 120.0° |
| S2 | N1 | H2 | 109.5° | 120.0° |
| O3 | S2 | O4 | 115.3° | 123.1° |
| H1 | N1 | H2 | 109.4° | 120.0° |
| H11 | C33 | H12 | 109.4° | 109.5° |
| H11 | C33 | H13 | 109.5° | 109.4° |
| H12 | C33 | H13 | 109.5° | 109.5° |
| H17 | C24 | H18 | 109.5° | 110.3° |
| H19 | C22 | H20 | 109.4° | 109.5° |
| H19 | C22 | H21 | 109.5° | 109.5° |
| H20 | C22 | H21 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H24 | 109.4° | 109.5° |
| H23 | C23 | H24 | 109.5° | 109.5° |
| H25 | C20 | H26 | 109.5° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C33 | C32 | C31 | N34 | 179.7° | 179.7° |
| C33 | C32 | C31 | C30 | 179.8° | 180.0° |
| C33 | C32 | N34 | C28 | 179.0° | 180.0° |
| C32 | C33 | H11 | H12 | 120.0° | 120.0° |
| C32 | C33 | H11 | H13 | 120.0° | 120.0° |
| C32 | C33 | H12 | H13 | 120.0° | 120.0° |
| C33 | C32 | C31 | H14 | 0.2° | 0.0° |
| C32 | C31 | C30 | H14 | 180.0° | 180.0° |
| C32 | C31 | C30 | C29 | 0.1° | 0.1° |
| C31 | C32 | N34 | C28 | 1.4° | 0.3° |
| C31 | C32 | C33 | H11 | 179.7° | 90.3° |
| C31 | C32 | C33 | H12 | 60.4° | 29.7° |
| C31 | C32 | C33 | H13 | 59.6° | 149.7° |
| C32 | C31 | C30 | H15 | 179.9° | 179.9° |
| C30 | C31 | C32 | N34 | 0.5° | 0.3° |
| C31 | C30 | C29 | H15 | 180.0° | 179.9° |
| C31 | C30 | C29 | C28 | 0.1° | 0.2° |
| C31 | C30 | C29 | H16 | 179.9° | 180.0° |
| C32 | N34 | C28 | C29 | 1.4° | 0.0° |
| C32 | N34 | C28 | C27 | 179.8° | 180.0° |
| N34 | C32 | C33 | H11 | 0.0° | 90.0° |
| N34 | C32 | C33 | H12 | 120.0° | 150.0° |
| N34 | C32 | C33 | H13 | 120.0° | 30.0° |
| N34 | C32 | C31 | H14 | 179.5° | 179.7° |
| C30 | C29 | C28 | N34 | 0.6° | 0.2° |
| C30 | C29 | C28 | H16 | 180.0° | 179.8° |
| C30 | C29 | C28 | C27 | 178.9° | 179.8° |
| C29 | C30 | C31 | H14 | 179.9° | 179.9° |
| N34 | C28 | C29 | C27 | 178.3° | 180.0° |
| N34 | C28 | C27 | N26 | 139.4° | 155.1° |
| N34 | C28 | C27 | C18 | 38.0° | 25.1° |
| N34 | C28 | C29 | H16 | 179.4° | 179.9° |
| C29 | C28 | C27 | N26 | 38.9° | 24.9° |
| C29 | C28 | C27 | C18 | 143.7° | 154.9° |
| C28 | C29 | C30 | H15 | 179.9° | 179.7° |
| C28 | C27 | N26 | C18 | 178.0° | 179.9° |
| C28 | C27 | N26 | N25 | 178.9° | 179.9° |
| C28 | C27 | C18 | C16 | 2.6° | 0.1° |
| C28 | C27 | C18 | C19 | 178.3° | 179.7° |
| C27 | C28 | C29 | H16 | 1.1° | 0.1° |
| C27 | N26 | N25 | C24 | 178.2° | 179.7° |
| C27 | N26 | N25 | C19 | 0.8° | 0.1° |
| N26 | C27 | C18 | C16 | 179.7° | 180.0° |
| N26 | C27 | C18 | C19 | 0.7° | 0.2° |
| N25 | N26 | C27 | C18 | 0.9° | 0.0° |
| N26 | N25 | C24 | C19 | 177.3° | 179.6° |
| N26 | N25 | C19 | C18 | 0.4° | 0.2° |
| N26 | N25 | C24 | C21 | 170.5° | 162.9° |
| N26 | N25 | C19 | C20 | 179.4° | 179.5° |
| N26 | N25 | C24 | H17 | 70.2° | 43.9° |
| N26 | N25 | C24 | H18 | 51.2° | 78.0° |
| C27 | C18 | C19 | N25 | 0.2° | 0.2° |
| C27 | C18 | C16 | C19 | 178.9° | 179.8° |
| C27 | C18 | C16 | C17 | 140.0° | 64.8° |
| C27 | C18 | C16 | C15 | 40.1° | 115.2° |
| C27 | C18 | C19 | C20 | 179.8° | 179.1° |
| C24 | N25 | C19 | C18 | 178.4° | 179.9° |
| N25 | C24 | C21 | H17 | 119.3° | 118.9° |
| N25 | C24 | C21 | H18 | 119.3° | 119.0° |
| C24 | N25 | C19 | C20 | 1.3° | 0.8° |
| N25 | C24 | C21 | C23 | 136.4° | 92.4° |
| N25 | C24 | C21 | C20 | 16.4° | 25.8° |
| N25 | C24 | C21 | C22 | 101.5° | 143.9° |
| N25 | C24 | H17 | H18 | 122.1° | 121.9° |
| N25 | C19 | C18 | C16 | 179.3° | 179.9° |
| N25 | C19 | C18 | C20 | 179.6° | 178.9° |
| C19 | N25 | C24 | C21 | 12.2° | 17.5° |
| N25 | C19 | C20 | C21 | 10.0° | 16.1° |
| C19 | N25 | C24 | H17 | 107.1° | 136.4° |
| C19 | N25 | C24 | H18 | 131.4° | 101.6° |
| N25 | C19 | C20 | H25 | 129.7° | 134.9° |
| N25 | C19 | C20 | H26 | 109.7° | 102.5° |
| C18 | C16 | C17 | C15 | 179.9° | 180.0° |
| C16 | C18 | C19 | C20 | 1.1° | 1.0° |
| C18 | C16 | C17 | C12 | 179.7° | 180.0° |
| C18 | C16 | C15 | C14 | 180.0° | 179.7° |
| C18 | C16 | C15 | H9 | 0.0° | 0.1° |
| C18 | C16 | C17 | H10 | 0.3° | 0.0° |
| C19 | C18 | C16 | C17 | 41.1° | 115.1° |
| C19 | C18 | C16 | C15 | 138.8° | 65.0° |
| C18 | C19 | C20 | C21 | 170.4° | 162.8° |
| C18 | C19 | C20 | H25 | 50.7° | 44.0° |
| C18 | C19 | C20 | H26 | 69.9° | 78.6° |
| C24 | C21 | C20 | C19 | 16.4° | 25.0° |
| C24 | C21 | C23 | C20 | 112.6° | 112.4° |
| C24 | C21 | C23 | C22 | 122.9° | 123.8° |
| C24 | C21 | C20 | C22 | 118.2° | 118.1° |
| C21 | C24 | H17 | H18 | 122.1° | 122.0° |
| C24 | C21 | C22 | H19 | 180.0° | 58.6° |
| C24 | C21 | C22 | H20 | 60.0° | 178.5° |
| C24 | C21 | C22 | H21 | 60.0° | 61.5° |
| C24 | C21 | C23 | H22 | 180.0° | 61.4° |
| C24 | C21 | C23 | H23 | 60.0° | 178.6° |
| C24 | C21 | C23 | H24 | 60.0° | 58.6° |
| C24 | C21 | C20 | H25 | 136.1° | 143.8° |
| C24 | C21 | C20 | H26 | 103.4° | 93.6° |
| C16 | C17 | C12 | H10 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 0.1° | 0.3° |
| C16 | C17 | C12 | N11 | 179.0° | 180.0° |
| C16 | C17 | C12 | N13 | 0.7° | 0.3° |
| C17 | C16 | C15 | H9 | 179.9° | 180.0° |
| C15 | C16 | C17 | C12 | 0.2° | 0.0° |
| C16 | C15 | C14 | H9 | 180.0° | 179.6° |
| C16 | C15 | C14 | N13 | 0.1° | 0.3° |
| C16 | C15 | C14 | H8 | 179.9° | 179.7° |
| C15 | C16 | C17 | H10 | 179.8° | 180.0° |
| C19 | C20 | C21 | C23 | 134.2° | 93.2° |
| C19 | C20 | C21 | H25 | 119.7° | 118.8° |
| C19 | C20 | C21 | H26 | 119.8° | 118.6° |
| C19 | C20 | C21 | C22 | 101.8° | 143.1° |
| C19 | C20 | H25 | H26 | 120.8° | 122.6° |
| C17 | C12 | N11 | N13 | 178.2° | 179.7° |
| C17 | C12 | N13 | C14 | 0.9° | 0.4° |
| C17 | C12 | N11 | C8 | 167.0° | 174.1° |
| C17 | C12 | N11 | H5 | 13.0° | 5.9° |
| C15 | C14 | N13 | C12 | 0.7° | 0.1° |
| C15 | C14 | N13 | H8 | 180.0° | 180.0° |
| N11 | C12 | N13 | C14 | 179.1° | 180.0° |
| C12 | N11 | C8 | H5 | 180.0° | 180.0° |
| C12 | N11 | C8 | C9 | 19.1° | 142.5° |
| C12 | N11 | C8 | C7 | 159.1° | 37.5° |
| N11 | C12 | C17 | H10 | 1.0° | 0.0° |
| N13 | C12 | N11 | C8 | 14.8° | 6.2° |
| N13 | C12 | N11 | H5 | 165.2° | 173.8° |
| C12 | N13 | C14 | H8 | 179.4° | 180.0° |
| N13 | C12 | C17 | H10 | 179.3° | 179.7° |
| N13 | C14 | C15 | H9 | 179.9° | 179.9° |
| N11 | C8 | C9 | C7 | 178.1° | 180.0° |
| N11 | C8 | C9 | C10 | 179.5° | 180.0° |
| N11 | C8 | C7 | C6 | 178.1° | 180.0° |
| N11 | C8 | C7 | H4 | 1.9° | 0.0° |
| N11 | C8 | C9 | H6 | 0.5° | 0.0° |
| C23 | C21 | C20 | C22 | 124.0° | 123.7° |
| C23 | C21 | C24 | H17 | 17.1° | 26.6° |
| C23 | C21 | C24 | H18 | 104.3° | 148.6° |
| C23 | C21 | C22 | H19 | 57.8° | 177.7° |
| C23 | C21 | C22 | H20 | 62.2° | 57.7° |
| C23 | C21 | C22 | H21 | 177.8° | 62.3° |
| C21 | C23 | H22 | H23 | 120.0° | 120.0° |
| C21 | C23 | H22 | H24 | 120.0° | 120.0° |
| C21 | C23 | H23 | H24 | 120.0° | 120.0° |
| C23 | C21 | C20 | H25 | 106.1° | 25.6° |
| C23 | C21 | C20 | H26 | 14.5° | 148.2° |
| C20 | C21 | C24 | H17 | 102.9° | 144.7° |
| C20 | C21 | C24 | H18 | 135.7° | 93.2° |
| C20 | C21 | C22 | H19 | 68.0° | 53.8° |
| C20 | C21 | C22 | H20 | 172.0° | 66.1° |
| C20 | C21 | C22 | H21 | 52.0° | 173.8° |
| C20 | C21 | C23 | H22 | 67.4° | 173.8° |
| C20 | C21 | C23 | H23 | 52.6° | 66.1° |
| C20 | C21 | C23 | H24 | 172.6° | 53.8° |
| C21 | C20 | H25 | H26 | 120.8° | 122.5° |
| C22 | C21 | C24 | H17 | 139.2° | 97.1° |
| C22 | C21 | C24 | H18 | 17.8° | 24.9° |
| C21 | C22 | H19 | H20 | 120.0° | 120.0° |
| C21 | C22 | H19 | H21 | 120.0° | 120.0° |
| C21 | C22 | H20 | H21 | 120.0° | 120.0° |
| C22 | C21 | C23 | H22 | 57.1° | 62.3° |
| C22 | C21 | C23 | H23 | 177.1° | 57.7° |
| C22 | C21 | C23 | H24 | 62.9° | 177.6° |
| C22 | C21 | C20 | H25 | 17.9° | 98.1° |
| C22 | C21 | C20 | H26 | 138.4° | 24.5° |
| C8 | C9 | C10 | H6 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 0.3° | 0.0° |
| C8 | C9 | C10 | C5 | 1.1° | 0.0° |
| C9 | C8 | C7 | H4 | 179.7° | 180.0° |
| C9 | C8 | N11 | H5 | 160.9° | 37.5° |
| C8 | C9 | C10 | H7 | 178.9° | 180.0° |
| C7 | C8 | C9 | C10 | 1.4° | 0.0° |
| C8 | C7 | C6 | H4 | 180.0° | 179.9° |
| C8 | C7 | C6 | C5 | 2.4° | 0.1° |
| C8 | C7 | C6 | H3 | 177.6° | 179.7° |
| C7 | C8 | N11 | H5 | 20.9° | 142.5° |
| C7 | C8 | C9 | H6 | 178.6° | 180.0° |
| C9 | C10 | C5 | H7 | 180.0° | 180.0° |
| C9 | C10 | C5 | C6 | 0.9° | 0.0° |
| C9 | C10 | C5 | S2 | 176.6° | 179.7° |
| C7 | C6 | C5 | C10 | 2.7° | 0.0° |
| C7 | C6 | C5 | H3 | 180.0° | 179.7° |
| C7 | C6 | C5 | S2 | 178.6° | 179.7° |
| C10 | C5 | C6 | S2 | 175.9° | 179.7° |
| C10 | C5 | S2 | N1 | 136.1° | 90.3° |
| C10 | C5 | S2 | O3 | 15.9° | 23.3° |
| C10 | C5 | S2 | O4 | 107.2° | 156.2° |
| C10 | C5 | C6 | H3 | 177.3° | 179.7° |
| C5 | C10 | C9 | H6 | 178.9° | 180.0° |
| C6 | C5 | S2 | N1 | 48.1° | 90.0° |
| C6 | C5 | S2 | O3 | 168.4° | 156.5° |
| C6 | C5 | S2 | O4 | 68.5° | 23.6° |
| C5 | C6 | C7 | H4 | 177.6° | 180.0° |
| C6 | C5 | C10 | H7 | 179.0° | 180.0° |
| C5 | S2 | N1 | O3 | 114.8° | 113.5° |
| C5 | S2 | N1 | O4 | 116.1° | 113.5° |
| C5 | S2 | O3 | O4 | 117.9° | 122.9° |
| C5 | S2 | N1 | H1 | 180.0° | 90.0° |
| C5 | S2 | N1 | H2 | 60.0° | 89.8° |
| S2 | C5 | C6 | H3 | 1.4° | 0.0° |
| S2 | C5 | C10 | H7 | 3.3° | 0.3° |
| N1 | S2 | O3 | O4 | 125.6° | 123.0° |
| S2 | N1 | H1 | H2 | 120.0° | 179.8° |
| O3 | S2 | N1 | H1 | 65.2° | 156.5° |
| O3 | S2 | N1 | H2 | 54.8° | 23.8° |
| O4 | S2 | N1 | H1 | 64.0° | 23.5° |
| O4 | S2 | N1 | H2 | 176.1° | 156.7° |
| H3 | C6 | C7 | H4 | 2.4° | 0.3° |
| H6 | C9 | C10 | H7 | 1.1° | 0.0° |
| H8 | C14 | C15 | H9 | 0.1° | 0.0° |
| H11 | C33 | H12 | H13 | 120.0° | 120.0° |
| H14 | C31 | C30 | H15 | 0.1° | 0.1° |
| H15 | C30 | C29 | H16 | 0.1° | 0.2° |
| H19 | C22 | H20 | H21 | 120.0° | 120.0° |
| H22 | C23 | H23 | H24 | 120.0° | 120.0° |
