9KW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | O2 | sing | 1.43Å | 1.42Å | |
| C9 | C10 | sing | 1.53Å | 1.51Å | |
| O2 | C8 | sing | 1.43Å | 1.42Å | |
| C10 | N2 | sing | 1.47Å | 1.46Å | |
| C8 | C7 | sing | 1.53Å | 1.51Å | |
| N2 | C7 | sing | 1.47Å | 1.46Å | |
| N2 | C6 | sing | 1.40Å | 1.41Å | |
| C6 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | N1 | sing | 1.46Å | 1.46Å | |
| N3 | C11 | sing | 1.40Å | 1.42Å | |
| N3 | S | sing | 1.66Å | 1.64Å | |
| C11 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | N1 | sing | 1.39Å | 1.41Å | |
| C4 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| N1 | C2 | sing | 1.35Å | 1.37Å | |
| C13 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| O3 | S | doub | 1.42Å | 1.43Å | |
| C14 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| S | C12 | sing | 1.76Å | 1.76Å | |
| S | O4 | doub | 1.42Å | 1.43Å | |
| C22 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
| C23 | N | sing | 1.39Å | 1.41Å | |
| C12 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | O1 | doub | 1.22Å | 1.23Å | |
| C2 | C1 | sing | 1.49Å | 1.52Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C15 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| N | C1 | sing | 1.35Å | 1.38Å | |
| N | C | sing | 1.47Å | 1.46Å | |
| C1 | O | doub | 1.22Å | 1.22Å | |
| C21 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.51Å | 1.51Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| N3 | H15 | sing | 0.97Å | 1.00Å | |
| C | H16 | sing | 1.09Å | 1.10Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.08Å | 1.08Å | |
| C22 | H28 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C9 | C10 | 111.6° | 109.3° |
| C9 | O2 | C8 | 109.6° | 113.8° |
| O2 | C9 | H7 | 108.9° | 109.5° |
| O2 | C9 | H8 | 109.0° | 109.5° |
| C9 | C10 | N2 | 110.0° | 109.3° |
| C10 | C9 | H7 | 109.0° | 109.5° |
| C10 | C9 | H8 | 108.9° | 109.5° |
| C9 | C10 | H9 | 109.3° | 109.5° |
| C9 | C10 | H10 | 109.3° | 109.5° |
| O2 | C8 | C7 | 111.4° | 109.2° |
| O2 | C8 | H5 | 109.0° | 109.5° |
| O2 | C8 | H6 | 109.0° | 109.5° |
| C10 | N2 | C7 | 111.2° | 110.7° |
| C10 | N2 | C6 | 113.8° | 111.0° |
| N2 | C10 | H9 | 109.3° | 109.5° |
| N2 | C10 | H10 | 109.3° | 109.5° |
| C8 | C7 | N2 | 109.8° | 109.3° |
| C8 | C7 | H3 | 109.4° | 109.5° |
| C8 | C7 | H4 | 109.4° | 109.5° |
| C7 | C8 | H5 | 109.0° | 109.5° |
| C7 | C8 | H6 | 109.0° | 109.5° |
| C7 | N2 | C6 | 113.5° | 111.0° |
| N2 | C7 | H3 | 109.4° | 109.5° |
| N2 | C7 | H4 | 109.4° | 109.5° |
| N2 | C6 | C5 | 121.3° | 120.0° |
| N2 | C6 | C11 | 119.3° | 120.0° |
| C5 | C6 | C11 | 119.4° | 120.0° |
| C6 | C5 | C4 | 121.3° | 120.0° |
| C6 | C5 | H2 | 119.4° | 119.9° |
| C6 | C11 | N3 | 120.4° | 119.9° |
| C6 | C11 | C22 | 119.6° | 120.1° |
| C5 | C4 | N1 | 121.0° | 119.5° |
| C5 | C4 | C23 | 119.4° | 119.9° |
| C4 | C5 | H2 | 119.4° | 120.0° |
| C3 | N1 | C4 | 119.8° | 120.0° |
| C3 | N1 | C2 | 117.4° | 120.0° |
| N1 | C3 | H12 | 109.5° | 109.5° |
| N1 | C3 | H13 | 109.5° | 109.5° |
| N1 | C3 | H14 | 109.5° | 109.5° |
| C11 | N3 | S | 122.9° | 120.0° |
| N3 | C11 | C22 | 120.0° | 120.0° |
| C11 | N3 | H15 | 106.0° | 120.1° |
| N3 | S | O3 | 104.9° | 106.4° |
| N3 | S | C12 | 107.0° | 107.2° |
| N3 | S | O4 | 108.6° | 106.4° |
| S | N3 | H15 | 106.0° | 120.0° |
| C11 | C22 | C23 | 121.2° | 120.1° |
| C11 | C22 | H28 | 119.4° | 120.0° |
| N1 | C4 | C23 | 119.5° | 120.6° |
| C4 | N1 | C2 | 122.8° | 120.0° |
| C4 | C23 | C22 | 119.1° | 119.9° |
| C4 | C23 | N | 119.4° | 120.5° |
| N1 | C2 | O1 | 122.7° | 120.2° |
| N1 | C2 | C1 | 117.7° | 119.4° |
| C14 | C13 | C12 | 119.2° | 119.7° |
| C13 | C14 | C15 | 121.4° | 120.6° |
| C13 | C14 | H1 | 119.3° | 119.7° |
| C14 | C13 | H11 | 120.4° | 120.2° |
| C13 | C12 | S | 120.0° | 120.1° |
| C13 | C12 | C21 | 120.6° | 119.8° |
| C12 | C13 | H11 | 120.4° | 120.1° |
| O3 | S | C12 | 108.1° | 106.4° |
| O3 | S | O4 | 119.6° | 123.2° |
| C14 | C15 | C16 | 119.9° | 117.8° |
| C14 | C15 | C20 | 119.1° | 119.7° |
| C15 | C14 | H1 | 119.3° | 119.7° |
| C12 | S | O4 | 108.0° | 106.4° |
| S | C12 | C21 | 119.4° | 120.1° |
| C22 | C23 | N | 121.5° | 119.6° |
| C23 | C22 | H28 | 119.4° | 119.9° |
| C23 | N | C1 | 122.8° | 120.1° |
| C23 | N | C | 119.9° | 119.9° |
| C12 | C21 | C20 | 120.6° | 120.5° |
| C12 | C21 | H27 | 119.7° | 119.7° |
| O1 | C2 | C1 | 119.6° | 120.4° |
| C2 | C1 | N | 117.6° | 119.4° |
| C2 | C1 | O | 119.5° | 120.3° |
| C16 | C15 | C20 | 121.0° | 122.5° |
| C15 | C16 | C17 | 113.0° | 110.6° |
| C15 | C16 | H19 | 108.6° | 109.3° |
| C15 | C16 | H20 | 108.6° | 109.3° |
| C15 | C20 | C21 | 119.1° | 119.7° |
| C15 | C20 | C19 | 121.0° | 122.6° |
| C16 | C17 | C18 | 109.7° | 108.4° |
| C17 | C16 | H19 | 108.6° | 109.2° |
| C17 | C16 | H20 | 108.6° | 109.2° |
| C16 | C17 | H21 | 109.4° | 109.7° |
| C16 | C17 | H22 | 109.4° | 109.7° |
| C1 | N | C | 117.3° | 120.0° |
| N | C1 | O | 122.9° | 120.3° |
| N | C | H16 | 109.5° | 109.5° |
| N | C | H17 | 109.5° | 109.4° |
| N | C | H18 | 109.4° | 109.4° |
| C21 | C20 | C19 | 119.8° | 117.7° |
| C20 | C21 | H27 | 119.7° | 119.7° |
| C20 | C19 | C18 | 112.2° | 110.6° |
| C20 | C19 | H25 | 108.8° | 109.2° |
| C20 | C19 | H26 | 108.8° | 109.2° |
| C17 | C18 | C19 | 108.7° | 108.4° |
| C18 | C17 | H21 | 109.4° | 109.6° |
| C18 | C17 | H22 | 109.4° | 109.7° |
| C17 | C18 | H23 | 109.7° | 109.7° |
| C17 | C18 | H24 | 109.7° | 109.7° |
| C19 | C18 | H23 | 109.6° | 109.7° |
| C19 | C18 | H24 | 109.7° | 109.7° |
| C18 | C19 | H25 | 108.8° | 109.2° |
| C18 | C19 | H26 | 108.8° | 109.3° |
| H3 | C7 | H4 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.5° |
| H7 | C9 | H8 | 109.5° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H12 | C3 | H13 | 109.4° | 109.5° |
| H12 | C3 | H14 | 109.4° | 109.4° |
| H13 | C3 | H14 | 109.5° | 109.5° |
| H16 | C | H17 | 109.4° | 109.5° |
| H16 | C | H18 | 109.5° | 109.5° |
| H17 | C | H18 | 109.5° | 109.5° |
| H19 | C16 | H20 | 109.4° | 109.2° |
| H21 | C17 | H22 | 109.5° | 109.7° |
| H23 | C18 | H24 | 109.5° | 109.7° |
| H25 | C19 | H26 | 109.5° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C9 | C10 | H7 | 120.3° | 119.9° |
| O2 | C9 | C10 | H8 | 120.3° | 120.0° |
| O2 | C9 | C10 | N2 | 56.6° | 56.8° |
| C9 | O2 | C8 | C7 | 60.4° | 58.6° |
| C9 | O2 | C8 | H5 | 59.9° | 178.5° |
| C9 | O2 | C8 | H6 | 179.3° | 61.3° |
| O2 | C9 | H7 | H8 | 119.1° | 120.1° |
| O2 | C9 | C10 | H9 | 63.4° | 63.2° |
| O2 | C9 | C10 | H10 | 176.7° | 176.8° |
| C10 | C9 | O2 | C8 | 59.8° | 58.6° |
| C9 | C10 | N2 | H9 | 120.1° | 120.0° |
| C9 | C10 | N2 | H10 | 120.1° | 119.9° |
| C9 | C10 | N2 | C7 | 53.6° | 58.6° |
| C9 | C10 | N2 | C6 | 176.7° | 177.6° |
| C10 | C9 | H7 | H8 | 119.0° | 120.1° |
| C9 | C10 | H9 | H10 | 119.7° | 120.0° |
| O2 | C8 | C7 | H5 | 120.3° | 119.9° |
| O2 | C8 | C7 | H6 | 120.3° | 120.0° |
| O2 | C8 | C7 | N2 | 57.7° | 56.9° |
| O2 | C8 | C7 | H3 | 177.7° | 176.8° |
| O2 | C8 | C7 | H4 | 62.4° | 63.2° |
| O2 | C8 | H5 | H6 | 119.1° | 120.1° |
| C8 | O2 | C9 | H7 | 179.8° | 61.3° |
| C8 | O2 | C9 | H8 | 60.5° | 178.6° |
| C10 | N2 | C7 | C8 | 54.1° | 58.6° |
| C10 | N2 | C7 | C6 | 129.9° | 123.7° |
| C10 | N2 | C6 | C5 | 58.8° | 60.0° |
| C10 | N2 | C6 | C11 | 122.6° | 120.0° |
| C10 | N2 | C7 | H3 | 174.1° | 178.5° |
| C10 | N2 | C7 | H4 | 66.0° | 61.4° |
| N2 | C10 | C9 | H7 | 177.0° | 63.0° |
| N2 | C10 | C9 | H8 | 63.7° | 176.8° |
| N2 | C10 | H9 | H10 | 119.7° | 120.1° |
| C8 | C7 | N2 | H3 | 120.0° | 119.9° |
| C8 | C7 | N2 | H4 | 120.1° | 120.0° |
| C8 | C7 | N2 | C6 | 176.0° | 177.6° |
| C8 | C7 | H3 | H4 | 119.8° | 120.1° |
| C7 | C8 | H5 | H6 | 119.1° | 120.1° |
| C7 | N2 | C6 | C5 | 69.8° | 63.6° |
| C7 | N2 | C6 | C11 | 108.8° | 116.4° |
| N2 | C7 | H3 | H4 | 119.8° | 120.1° |
| N2 | C7 | C8 | H5 | 62.6° | 176.8° |
| N2 | C7 | C8 | H6 | 177.9° | 63.1° |
| C7 | N2 | C10 | H9 | 66.5° | 61.4° |
| C7 | N2 | C10 | H10 | 173.6° | 178.5° |
| N2 | C6 | C5 | C11 | 178.6° | 179.9° |
| N2 | C6 | C5 | C4 | 177.6° | 180.0° |
| N2 | C6 | C11 | N3 | 3.0° | 0.0° |
| N2 | C6 | C11 | C22 | 177.7° | 180.0° |
| N2 | C6 | C5 | H2 | 2.4° | 0.1° |
| C6 | N2 | C7 | H3 | 56.0° | 57.7° |
| C6 | N2 | C7 | H4 | 63.9° | 62.3° |
| C6 | N2 | C10 | H9 | 63.2° | 62.4° |
| C6 | N2 | C10 | H10 | 56.6° | 57.8° |
| C6 | C5 | C4 | H2 | 180.0° | 179.9° |
| C5 | C6 | C11 | N3 | 178.3° | 179.9° |
| C5 | C6 | C11 | C22 | 1.0° | 0.0° |
| C6 | C5 | C4 | N1 | 179.7° | 180.0° |
| C6 | C5 | C4 | C23 | 0.2° | 0.3° |
| C11 | C6 | C5 | C4 | 1.0° | 0.0° |
| C6 | C11 | N3 | C22 | 179.3° | 180.0° |
| C6 | C11 | N3 | S | 130.2° | 144.4° |
| C6 | C11 | C22 | C23 | 0.3° | 0.2° |
| C11 | C6 | C5 | H2 | 179.0° | 179.9° |
| C6 | C11 | N3 | H15 | 107.9° | 35.5° |
| C6 | C11 | C22 | H28 | 179.8° | 180.0° |
| C5 | C4 | N1 | C3 | 1.9° | 0.3° |
| C5 | C4 | N1 | C23 | 180.0° | 179.7° |
| C5 | C4 | N1 | C2 | 178.7° | 179.7° |
| C5 | C4 | C23 | C22 | 0.5° | 0.5° |
| C5 | C4 | C23 | N | 179.9° | 179.7° |
| C3 | N1 | C4 | C2 | 179.5° | 180.0° |
| C3 | N1 | C4 | C23 | 178.1° | 179.9° |
| C3 | N1 | C2 | O1 | 2.3° | 0.1° |
| C3 | N1 | C2 | C1 | 178.4° | 180.0° |
| N1 | C3 | H12 | H13 | 120.0° | 120.0° |
| N1 | C3 | H12 | H14 | 120.0° | 120.0° |
| N1 | C3 | H13 | H14 | 120.0° | 120.0° |
| C11 | N3 | S | H15 | 121.9° | 179.9° |
| C11 | N3 | S | O3 | 178.9° | 53.2° |
| C11 | N3 | S | C12 | 64.3° | 60.4° |
| C11 | N3 | S | O4 | 52.1° | 173.9° |
| N3 | C11 | C22 | C23 | 179.1° | 179.8° |
| N3 | C11 | C22 | H28 | 0.9° | 0.0° |
| S | N3 | C11 | C22 | 50.5° | 35.6° |
| N3 | S | C12 | C13 | 57.0° | 89.2° |
| N3 | S | O3 | C12 | 113.9° | 114.1° |
| N3 | S | O3 | O4 | 122.1° | 123.0° |
| N3 | S | C12 | O4 | 116.8° | 113.6° |
| N3 | S | C12 | C21 | 122.7° | 90.1° |
| C11 | C22 | C23 | C4 | 0.5° | 0.5° |
| C11 | C22 | C23 | H28 | 180.0° | 179.8° |
| C11 | C22 | C23 | N | 179.9° | 179.7° |
| C22 | C11 | N3 | H15 | 71.4° | 144.5° |
| N1 | C4 | C23 | C22 | 179.5° | 179.8° |
| N1 | C4 | C23 | N | 0.1° | 0.0° |
| C4 | N1 | C2 | O1 | 178.2° | 180.0° |
| C4 | N1 | C2 | C1 | 1.1° | 0.0° |
| N1 | C4 | C5 | H2 | 0.3° | 0.0° |
| C4 | N1 | C3 | H12 | 180.0° | 90.0° |
| C4 | N1 | C3 | H13 | 60.0° | 150.0° |
| C4 | N1 | C3 | H14 | 60.0° | 30.0° |
| C23 | C4 | N1 | C2 | 1.4° | 0.0° |
| C4 | C23 | C22 | N | 179.6° | 179.7° |
| C4 | C23 | N | C1 | 1.8° | 0.0° |
| C4 | C23 | N | C | 175.3° | 180.0° |
| C23 | C4 | C5 | H2 | 179.7° | 179.7° |
| C4 | C23 | C22 | H28 | 179.5° | 179.7° |
| N1 | C2 | O1 | C1 | 179.3° | 180.0° |
| N1 | C2 | C1 | N | 0.6° | 0.0° |
| N1 | C2 | C1 | O | 178.2° | 180.0° |
| C2 | N1 | C3 | H12 | 0.5° | 90.0° |
| C2 | N1 | C3 | H13 | 119.5° | 30.0° |
| C2 | N1 | C3 | H14 | 120.5° | 150.0° |
| C14 | C13 | C12 | H11 | 180.0° | 180.0° |
| C13 | C14 | C15 | H1 | 180.0° | 179.8° |
| C14 | C13 | C12 | S | 178.5° | 179.9° |
| C14 | C13 | C12 | C21 | 1.2° | 0.6° |
| C13 | C14 | C15 | C16 | 175.7° | 179.5° |
| C13 | C14 | C15 | C20 | 1.2° | 0.2° |
| C13 | C12 | S | O3 | 55.4° | 24.3° |
| C12 | C13 | C14 | C15 | 0.2° | 0.2° |
| C13 | C12 | S | C21 | 179.7° | 179.3° |
| C13 | C12 | S | O4 | 173.8° | 157.2° |
| C13 | C12 | C21 | C20 | 0.6° | 0.7° |
| C12 | C13 | C14 | H1 | 179.7° | 179.7° |
| C13 | C12 | C21 | H27 | 179.3° | 179.9° |
| O3 | S | C12 | O4 | 130.8° | 132.9° |
| O3 | S | C12 | C21 | 124.9° | 156.4° |
| O3 | S | N3 | H15 | 59.2° | 126.9° |
| C14 | C15 | C16 | C20 | 176.8° | 179.7° |
| C14 | C15 | C16 | C17 | 164.5° | 162.6° |
| C14 | C15 | C20 | C21 | 1.7° | 0.1° |
| C14 | C15 | C20 | C19 | 177.5° | 179.6° |
| C15 | C14 | C13 | H11 | 179.8° | 179.9° |
| C14 | C15 | C16 | H19 | 43.9° | 77.2° |
| C14 | C15 | C16 | H20 | 75.0° | 42.3° |
| S | C12 | C21 | C20 | 179.1° | 180.0° |
| S | C12 | C13 | H11 | 1.5° | 0.2° |
| C12 | S | N3 | H15 | 173.8° | 119.5° |
| S | C12 | C21 | H27 | 1.0° | 0.8° |
| O4 | S | C12 | C21 | 5.9° | 23.5° |
| O4 | S | N3 | H15 | 69.8° | 6.0° |
| C22 | C23 | N | C1 | 177.8° | 179.8° |
| C22 | C23 | N | C | 5.0° | 0.3° |
| C23 | N | C1 | C2 | 2.0° | 0.0° |
| C23 | N | C1 | C | 177.2° | 180.0° |
| C23 | N | C1 | O | 176.7° | 180.0° |
| C23 | N | C | H16 | 180.0° | 180.0° |
| C23 | N | C | H17 | 60.0° | 60.0° |
| C23 | N | C | H18 | 60.0° | 60.0° |
| N | C23 | C22 | H28 | 0.1° | 0.0° |
| C12 | C21 | C20 | C15 | 0.8° | 0.3° |
| C12 | C21 | C20 | H27 | 180.0° | 179.3° |
| C12 | C21 | C20 | C19 | 178.4° | 179.9° |
| C21 | C12 | C13 | H11 | 178.8° | 179.4° |
| O1 | C2 | C1 | N | 179.9° | 180.0° |
| O1 | C2 | C1 | O | 1.1° | 0.0° |
| C2 | C1 | N | O | 178.8° | 179.9° |
| C2 | C1 | N | C | 175.2° | 180.0° |
| C15 | C16 | C17 | H19 | 120.6° | 120.3° |
| C15 | C16 | C17 | H20 | 120.5° | 120.3° |
| C16 | C15 | C20 | C21 | 175.1° | 179.5° |
| C16 | C15 | C20 | C19 | 5.6° | 0.7° |
| C15 | C16 | C17 | C18 | 48.6° | 51.1° |
| C16 | C15 | C14 | H1 | 4.3° | 0.3° |
| C15 | C16 | H19 | H20 | 118.3° | 119.5° |
| C15 | C16 | C17 | H21 | 71.4° | 170.8° |
| C15 | C16 | C17 | H22 | 168.6° | 68.6° |
| C20 | C15 | C16 | C17 | 18.7° | 17.7° |
| C15 | C20 | C21 | C19 | 179.2° | 179.8° |
| C15 | C20 | C19 | C18 | 22.9° | 17.8° |
| C20 | C15 | C14 | H1 | 178.8° | 180.0° |
| C20 | C15 | C16 | H19 | 139.2° | 102.5° |
| C20 | C15 | C16 | H20 | 101.9° | 138.0° |
| C15 | C20 | C19 | H25 | 143.3° | 138.0° |
| C15 | C20 | C19 | H26 | 97.5° | 102.5° |
| C15 | C20 | C21 | H27 | 179.2° | 179.6° |
| C16 | C17 | C18 | H21 | 120.1° | 119.8° |
| C16 | C17 | C18 | H22 | 120.0° | 119.8° |
| C16 | C17 | C18 | C19 | 66.5° | 69.9° |
| C17 | C16 | H19 | H20 | 118.4° | 119.4° |
| C16 | C17 | H21 | H22 | 119.9° | 120.6° |
| C16 | C17 | C18 | H23 | 173.6° | 49.8° |
| C16 | C17 | C18 | H24 | 53.4° | 170.4° |
| C1 | N | C | H16 | 2.7° | 0.0° |
| C1 | N | C | H17 | 122.7° | 120.0° |
| C1 | N | C | H18 | 117.3° | 120.0° |
| C | N | C1 | O | 6.0° | 0.1° |
| N | C | H16 | H17 | 120.0° | 120.0° |
| N | C | H16 | H18 | 120.0° | 120.0° |
| N | C | H17 | H18 | 120.0° | 120.0° |
| C21 | C20 | C19 | C18 | 157.9° | 162.5° |
| C21 | C20 | C19 | H25 | 37.5° | 42.2° |
| C21 | C20 | C19 | H26 | 81.7° | 77.2° |
| C20 | C19 | C18 | C17 | 52.4° | 51.1° |
| C20 | C19 | C18 | H25 | 120.4° | 120.2° |
| C20 | C19 | C18 | H26 | 120.4° | 120.3° |
| C20 | C19 | C18 | H23 | 172.3° | 68.6° |
| C20 | C19 | C18 | H24 | 67.5° | 170.9° |
| C20 | C19 | H25 | H26 | 118.7° | 119.4° |
| C19 | C20 | C21 | H27 | 1.6° | 0.7° |
| C17 | C18 | C19 | H23 | 119.9° | 119.7° |
| C17 | C18 | C19 | H24 | 119.9° | 119.8° |
| C18 | C17 | C16 | H19 | 169.1° | 69.2° |
| C18 | C17 | C16 | H20 | 71.9° | 171.5° |
| C18 | C17 | H21 | H22 | 119.9° | 120.5° |
| C17 | C18 | H23 | H24 | 120.4° | 120.6° |
| C17 | C18 | C19 | H25 | 172.8° | 171.3° |
| C17 | C18 | C19 | H26 | 68.0° | 69.1° |
| C19 | C18 | C17 | H21 | 53.6° | 170.3° |
| C19 | C18 | C17 | H22 | 173.5° | 49.9° |
| C19 | C18 | H23 | H24 | 120.3° | 120.5° |
| C18 | C19 | H25 | H26 | 118.7° | 119.5° |
| H1 | C14 | C13 | H11 | 0.3° | 0.3° |
| H3 | C7 | C8 | H5 | 57.4° | 63.3° |
| H3 | C7 | C8 | H6 | 62.0° | 56.8° |
| H4 | C7 | C8 | H5 | 177.3° | 56.8° |
| H4 | C7 | C8 | H6 | 57.9° | 176.9° |
| H7 | C9 | C10 | H9 | 56.9° | 177.0° |
| H7 | C9 | C10 | H10 | 62.9° | 56.9° |
| H8 | C9 | C10 | H9 | 176.2° | 56.8° |
| H8 | C9 | C10 | H10 | 56.4° | 63.3° |
| H12 | C3 | H13 | H14 | 120.0° | 120.0° |
| H16 | C | H17 | H18 | 120.0° | 120.0° |
| H19 | C16 | C17 | H21 | 49.1° | 50.5° |
| H19 | C16 | C17 | H22 | 70.8° | 171.1° |
| H20 | C16 | C17 | H21 | 168.0° | 68.9° |
| H20 | C16 | C17 | H22 | 48.1° | 51.7° |
| H21 | C17 | C18 | H23 | 66.3° | 69.9° |
| H21 | C17 | C18 | H24 | 173.5° | 50.6° |
| H22 | C17 | C18 | H23 | 53.6° | 169.6° |
| H22 | C17 | C18 | H24 | 66.6° | 69.9° |
| H23 | C18 | C19 | H25 | 67.3° | 51.6° |
| H23 | C18 | C19 | H26 | 51.9° | 171.1° |
| H24 | C18 | C19 | H25 | 52.9° | 68.9° |
| H24 | C18 | C19 | H26 | 172.1° | 50.6° |
