K2W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N3 | C7 | sing | 1.38Å | 1.32Å | |
| N2 | C5 | doub | 1.30Å | 1.32Å | Aromatic |
| N2 | C6 | sing | 1.35Å | 1.32Å | Aromatic |
| C7 | C6 | doub | 1.41Å | 1.32Å | Aromatic |
| C7 | N4 | sing | 1.33Å | 1.39Å | Aromatic |
| C5 | N1 | sing | 1.36Å | 1.33Å | Aromatic |
| C6 | C9 | sing | 1.41Å | 1.32Å | Aromatic |
| C1 | O1 | sing | 1.43Å | 1.41Å | |
| C1 | C2 | sing | 1.55Å | 1.51Å | |
| C1 | C4 | sing | 1.55Å | 1.51Å | |
| N4 | C8 | doub | 1.32Å | 1.31Å | Aromatic |
| N1 | C9 | sing | 1.37Å | 1.32Å | Aromatic |
| N1 | C4 | sing | 1.46Å | 1.46Å | |
| O7 | C2 | sing | 1.43Å | 1.43Å | |
| C2 | C3 | sing | 1.54Å | 1.49Å | |
| C9 | N5 | doub | 1.33Å | 1.33Å | Aromatic |
| C8 | N5 | sing | 1.32Å | 1.39Å | Aromatic |
| C4 | O2 | sing | 1.44Å | 1.41Å | |
| O2 | C3 | sing | 1.44Å | 1.41Å | |
| C3 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | N6 | sing | 1.47Å | 1.47Å | |
| N11 | C17 | sing | 1.38Å | 1.32Å | |
| N6 | C11 | sing | 1.47Å | 1.47Å | |
| C17 | N8 | doub | 1.33Å | 1.39Å | Aromatic |
| C17 | C16 | sing | 1.41Å | 1.32Å | Aromatic |
| N8 | C18 | sing | 1.32Å | 1.31Å | Aromatic |
| N7 | C16 | sing | 1.35Å | 1.33Å | Aromatic |
| N7 | C15 | doub | 1.31Å | 1.32Å | Aromatic |
| C16 | C19 | doub | 1.41Å | 1.33Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C18 | N9 | doub | 1.32Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.43Å | 1.39Å | |
| C15 | N10 | sing | 1.37Å | 1.32Å | Aromatic |
| C19 | N9 | sing | 1.33Å | 1.34Å | Aromatic |
| C19 | N10 | sing | 1.37Å | 1.32Å | Aromatic |
| O6 | C23 | sing | 1.44Å | 1.43Å | |
| O6 | C20 | sing | 1.44Å | 1.43Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C24 | O5 | sing | 1.43Å | 1.42Å | |
| C14 | C13 | trip | 1.17Å | 1.19Å | |
| C13 | C12 | sing | 1.47Å | 1.47Å | |
| N10 | C20 | sing | 1.46Å | 1.45Å | |
| C23 | C22 | sing | 1.54Å | 1.51Å | |
| C20 | C21 | sing | 1.55Å | 1.49Å | |
| C21 | C22 | sing | 1.55Å | 1.48Å | |
| C21 | O3 | sing | 1.43Å | 1.43Å | |
| C22 | O4 | sing | 1.43Å | 1.42Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C8 | H19 | sing | 1.08Å | 1.08Å | |
| N11 | H20 | sing | 0.97Å | 1.00Å | |
| N11 | H21 | sing | 0.97Å | 1.00Å | |
| N3 | H22 | sing | 0.97Å | 1.00Å | |
| N3 | H23 | sing | 0.97Å | 1.00Å | |
| N6 | H24 | sing | 1.01Å | 1.00Å | |
| O1 | H26 | sing | 0.97Å | 0.95Å | |
| O3 | H27 | sing | 0.97Å | 0.95Å | |
| O4 | H28 | sing | 0.97Å | 0.95Å | |
| O5 | H29 | sing | 0.97Å | 0.95Å | |
| O7 | H30 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N3 | C7 | C6 | 116.9° | 120.8° |
| N3 | C7 | N4 | 122.1° | 120.8° |
| C7 | N3 | H22 | 109.5° | 120.0° |
| C7 | N3 | H23 | 109.5° | 120.0° |
| C5 | N2 | C6 | 107.9° | 109.5° |
| N2 | C5 | N1 | 108.0° | 110.0° |
| N2 | C5 | H4 | 126.0° | 125.0° |
| N2 | C6 | C7 | 132.2° | 134.7° |
| N2 | C6 | C9 | 108.1° | 107.1° |
| C6 | C7 | N4 | 121.1° | 118.5° |
| C7 | C6 | C9 | 119.7° | 118.1° |
| C7 | N4 | C8 | 119.2° | 121.2° |
| C5 | N1 | C9 | 108.1° | 107.4° |
| C5 | N1 | C4 | 127.3° | 126.3° |
| N1 | C5 | H4 | 126.0° | 125.0° |
| C6 | C9 | N1 | 107.9° | 106.0° |
| C6 | C9 | N5 | 120.8° | 119.1° |
| O1 | C1 | C2 | 108.8° | 110.9° |
| O1 | C1 | C4 | 108.1° | 110.9° |
| O1 | C1 | H14 | 112.8° | 110.8° |
| C1 | O1 | H26 | 109.5° | 114.0° |
| C2 | C1 | C4 | 104.4° | 102.1° |
| C1 | C2 | O7 | 109.8° | 110.6° |
| C1 | C2 | C3 | 101.8° | 104.1° |
| C1 | C2 | H1 | 111.3° | 110.5° |
| C2 | C1 | H14 | 111.2° | 110.9° |
| C1 | C4 | N1 | 111.9° | 110.8° |
| C1 | C4 | O2 | 105.1° | 103.5° |
| C1 | C4 | H3 | 110.7° | 110.6° |
| C4 | C1 | H14 | 111.3° | 110.9° |
| N4 | C8 | N5 | 119.2° | 122.5° |
| N4 | C8 | H19 | 120.4° | 118.7° |
| C9 | N1 | C4 | 124.6° | 126.3° |
| N1 | C9 | N5 | 131.3° | 134.9° |
| N1 | C4 | O2 | 105.3° | 110.7° |
| N1 | C4 | H3 | 111.4° | 110.6° |
| O7 | C2 | C3 | 109.2° | 110.5° |
| O7 | C2 | H1 | 112.6° | 110.5° |
| C2 | O7 | H30 | 109.5° | 114.0° |
| C2 | C3 | O2 | 102.6° | 107.3° |
| C2 | C3 | C10 | 110.1° | 109.8° |
| C3 | C2 | H1 | 111.6° | 110.5° |
| C2 | C3 | H2 | 112.8° | 109.9° |
| C9 | N5 | C8 | 120.1° | 120.6° |
| N5 | C8 | H19 | 120.4° | 118.7° |
| C4 | O2 | C3 | 105.3° | 107.0° |
| O2 | C4 | H3 | 112.2° | 110.6° |
| O2 | C3 | C10 | 104.2° | 109.9° |
| O2 | C3 | H2 | 114.2° | 110.0° |
| C3 | C10 | N6 | 112.8° | 109.4° |
| C10 | C3 | H2 | 112.2° | 109.8° |
| C3 | C10 | H5 | 108.6° | 109.5° |
| C3 | C10 | H6 | 108.6° | 109.5° |
| C10 | N6 | C11 | 112.6° | 111.0° |
| N6 | C10 | H5 | 108.6° | 109.5° |
| N6 | C10 | H6 | 108.6° | 109.5° |
| C10 | N6 | H24 | 108.7° | 111.0° |
| N11 | C17 | N8 | 122.1° | 120.7° |
| N11 | C17 | C16 | 116.7° | 120.8° |
| C17 | N11 | H20 | 109.5° | 120.1° |
| C17 | N11 | H21 | 109.5° | 120.0° |
| N6 | C11 | C12 | 109.3° | 109.5° |
| N6 | C11 | H7 | 109.5° | 109.4° |
| N6 | C11 | H8 | 109.5° | 109.4° |
| C11 | N6 | H24 | 108.7° | 111.0° |
| N8 | C17 | C16 | 121.2° | 118.5° |
| C17 | N8 | C18 | 119.2° | 121.2° |
| C17 | C16 | N7 | 132.2° | 134.5° |
| C17 | C16 | C19 | 119.4° | 118.1° |
| N8 | C18 | N9 | 119.2° | 122.5° |
| N8 | C18 | H11 | 120.4° | 118.8° |
| C16 | N7 | C15 | 106.7° | 109.4° |
| N7 | C16 | C19 | 108.4° | 107.4° |
| N7 | C15 | C14 | 124.8° | 125.2° |
| N7 | C15 | N10 | 109.7° | 109.6° |
| C16 | C19 | N9 | 120.8° | 119.1° |
| C16 | C19 | N10 | 108.1° | 106.2° |
| C11 | C12 | C13 | 111.6° | 109.5° |
| C12 | C11 | H7 | 109.5° | 109.5° |
| C12 | C11 | H8 | 109.5° | 109.5° |
| C11 | C12 | H9 | 109.0° | 109.5° |
| C11 | C12 | H10 | 108.9° | 109.5° |
| C18 | N9 | C19 | 120.1° | 120.7° |
| N9 | C18 | H11 | 120.4° | 118.7° |
| C14 | C15 | N10 | 125.5° | 125.2° |
| C15 | C14 | C13 | 179.7° | 180.0° |
| C15 | N10 | C19 | 107.1° | 107.3° |
| C15 | N10 | C20 | 130.8° | 126.4° |
| N9 | C19 | N10 | 131.0° | 134.7° |
| C19 | N10 | C20 | 122.1° | 126.3° |
| C23 | O6 | C20 | 107.1° | 107.0° |
| O6 | C23 | C24 | 107.0° | 110.0° |
| O6 | C23 | C22 | 105.4° | 107.3° |
| O6 | C23 | H16 | 112.3° | 109.9° |
| O6 | C20 | N10 | 110.0° | 110.8° |
| O6 | C20 | C21 | 103.9° | 103.5° |
| O6 | C20 | H12 | 111.1° | 110.6° |
| C23 | C24 | O5 | 110.0° | 109.5° |
| C24 | C23 | C22 | 109.9° | 109.9° |
| C24 | C23 | H16 | 110.9° | 109.9° |
| C23 | C24 | H17 | 109.3° | 109.4° |
| C23 | C24 | H18 | 109.3° | 109.5° |
| O5 | C24 | H17 | 109.3° | 109.5° |
| O5 | C24 | H18 | 109.3° | 109.5° |
| C24 | O5 | H29 | 109.5° | 114.0° |
| C14 | C13 | C12 | 179.6° | 180.0° |
| C13 | C12 | H9 | 108.9° | 109.5° |
| C13 | C12 | H10 | 109.0° | 109.5° |
| N10 | C20 | C21 | 110.8° | 110.7° |
| N10 | C20 | H12 | 110.7° | 110.5° |
| C23 | C22 | C21 | 101.7° | 104.2° |
| C23 | C22 | O4 | 108.8° | 110.5° |
| C23 | C22 | H15 | 111.8° | 110.6° |
| C22 | C23 | H16 | 111.1° | 109.9° |
| C20 | C21 | C22 | 98.9° | 102.1° |
| C20 | C21 | O3 | 109.1° | 110.9° |
| C21 | C20 | H12 | 110.2° | 110.6° |
| C20 | C21 | H13 | 112.5° | 110.9° |
| C22 | C21 | O3 | 109.2° | 110.9° |
| C21 | C22 | O4 | 108.3° | 110.5° |
| C22 | C21 | H13 | 112.6° | 110.9° |
| C21 | C22 | H15 | 112.2° | 110.5° |
| O3 | C21 | H13 | 113.6° | 110.8° |
| C21 | O3 | H27 | 109.5° | 114.0° |
| O4 | C22 | H15 | 113.2° | 110.4° |
| C22 | O4 | H28 | 109.5° | 114.0° |
| H5 | C10 | H6 | 109.5° | 109.5° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H9 | C12 | H10 | 109.5° | 109.4° |
| H17 | C24 | H18 | 109.5° | 109.5° |
| H20 | N11 | H21 | 109.5° | 119.9° |
| H22 | N3 | H23 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | C7 | C6 | N2 | 0.0° | 0.5° |
| N3 | C7 | C6 | N4 | 179.9° | 180.0° |
| N3 | C7 | C6 | C9 | 179.9° | 180.0° |
| N3 | C7 | N4 | C8 | 180.0° | 179.9° |
| C7 | N3 | H22 | H23 | 120.0° | 180.0° |
| C5 | N2 | C6 | C7 | 179.9° | 179.8° |
| N2 | C5 | N1 | H4 | 180.0° | 179.8° |
| C5 | N2 | C6 | C9 | 0.0° | 0.2° |
| N2 | C5 | N1 | C9 | 0.2° | 0.2° |
| N2 | C5 | N1 | C4 | 179.4° | 179.8° |
| N2 | C6 | C7 | C9 | 179.9° | 179.6° |
| N2 | C6 | C7 | N4 | 179.9° | 179.6° |
| C6 | N2 | C5 | N1 | 0.1° | 0.0° |
| N2 | C6 | C9 | N1 | 0.2° | 0.3° |
| N2 | C6 | C9 | N5 | 179.9° | 179.6° |
| C6 | N2 | C5 | H4 | 179.9° | 179.8° |
| C6 | C7 | N4 | C8 | 0.1° | 0.1° |
| C7 | C6 | C9 | N1 | 179.8° | 180.0° |
| C7 | C6 | C9 | N5 | 0.2° | 0.0° |
| C6 | C7 | N3 | H22 | 179.9° | 0.0° |
| C6 | C7 | N3 | H23 | 59.9° | 180.0° |
| N4 | C7 | C6 | C9 | 0.2° | 0.0° |
| C7 | N4 | C8 | N5 | 0.1° | 0.2° |
| C7 | N4 | C8 | H19 | 179.9° | 180.0° |
| N4 | C7 | N3 | H22 | 0.0° | 180.0° |
| N4 | C7 | N3 | H23 | 120.0° | 0.0° |
| C5 | N1 | C9 | C6 | 0.2° | 0.3° |
| C5 | N1 | C4 | C1 | 64.0° | 90.6° |
| C5 | N1 | C9 | C4 | 179.2° | 180.0° |
| C5 | N1 | C9 | N5 | 179.8° | 179.6° |
| C5 | N1 | C4 | O2 | 49.6° | 23.6° |
| C5 | N1 | C4 | H3 | 171.5° | 146.4° |
| C6 | C9 | N1 | N5 | 180.0° | 179.9° |
| C6 | C9 | N1 | C4 | 179.4° | 179.7° |
| C6 | C9 | N5 | C8 | 0.2° | 0.1° |
| O1 | C1 | C2 | C4 | 115.2° | 118.2° |
| O1 | C1 | C2 | H14 | 124.8° | 123.5° |
| O1 | C1 | C4 | H14 | 124.3° | 123.6° |
| O1 | C1 | C4 | N1 | 122.0° | 86.2° |
| O1 | C1 | C2 | O7 | 18.7° | 20.4° |
| O1 | C1 | C2 | C3 | 96.9° | 139.1° |
| O1 | C1 | C4 | O2 | 124.3° | 155.2° |
| O1 | C1 | C2 | H1 | 144.1° | 102.2° |
| O1 | C1 | C4 | H3 | 2.9° | 36.7° |
| C2 | C1 | C4 | H14 | 120.0° | 118.2° |
| C2 | C1 | C4 | N1 | 122.4° | 155.6° |
| C1 | C2 | O7 | C3 | 110.8° | 114.8° |
| C1 | C2 | O7 | H1 | 124.6° | 122.6° |
| C1 | C2 | C3 | H1 | 118.9° | 118.6° |
| C2 | C1 | C4 | O2 | 8.6° | 37.0° |
| C1 | C2 | C3 | O2 | 39.3° | 2.0° |
| C1 | C2 | C3 | C10 | 149.7° | 121.5° |
| C1 | C2 | C3 | H2 | 84.1° | 117.6° |
| C2 | C1 | C4 | H3 | 112.8° | 81.5° |
| C2 | C1 | O1 | H26 | 180.0° | 61.4° |
| C1 | C2 | O7 | H30 | 180.0° | 65.2° |
| C1 | C4 | N1 | C9 | 116.9° | 89.4° |
| C1 | C4 | N1 | O2 | 113.6° | 114.2° |
| C1 | C4 | N1 | H3 | 124.5° | 122.9° |
| C4 | C1 | C2 | O7 | 133.9° | 97.9° |
| C4 | C1 | C2 | C3 | 18.3° | 20.9° |
| C1 | C4 | O2 | H3 | 120.4° | 118.4° |
| C1 | C4 | O2 | C3 | 34.5° | 40.0° |
| C4 | C1 | C2 | H1 | 100.8° | 139.6° |
| C4 | C1 | O1 | H26 | 67.2° | 174.2° |
| N4 | C8 | N5 | C9 | 0.1° | 0.2° |
| N4 | C8 | N5 | H19 | 180.0° | 179.8° |
| N1 | C9 | N5 | C8 | 179.8° | 179.9° |
| C9 | N1 | C4 | O2 | 129.4° | 156.5° |
| C9 | N1 | C4 | H3 | 7.6° | 33.6° |
| C9 | N1 | C5 | H4 | 179.8° | 180.0° |
| C4 | N1 | C9 | N5 | 0.6° | 0.4° |
| N1 | C4 | O2 | H3 | 121.3° | 122.9° |
| N1 | C4 | O2 | C3 | 152.7° | 158.7° |
| C4 | N1 | C5 | H4 | 0.6° | 0.0° |
| N1 | C4 | C1 | H14 | 2.4° | 37.4° |
| O7 | C2 | C3 | H1 | 125.1° | 122.6° |
| O7 | C2 | C3 | O2 | 155.3° | 120.8° |
| O7 | C2 | C3 | C10 | 94.3° | 119.7° |
| O7 | C2 | C3 | H2 | 31.9° | 1.2° |
| O7 | C2 | C1 | H14 | 106.1° | 143.9° |
| C2 | C3 | O2 | C4 | 46.8° | 26.5° |
| C2 | C3 | O2 | C10 | 114.8° | 119.4° |
| C2 | C3 | O2 | H2 | 122.4° | 119.5° |
| C2 | C3 | C10 | H2 | 126.5° | 121.0° |
| C2 | C3 | C10 | N6 | 139.5° | 175.0° |
| C2 | C3 | C10 | H5 | 19.0° | 55.0° |
| C2 | C3 | C10 | H6 | 100.1° | 65.1° |
| C3 | C2 | C1 | H14 | 138.4° | 97.4° |
| C3 | C2 | O7 | H30 | 69.1° | 180.0° |
| C9 | N5 | C8 | H19 | 179.9° | 179.9° |
| C4 | O2 | C3 | C10 | 161.6° | 145.9° |
| C4 | O2 | C3 | H2 | 75.6° | 93.0° |
| O2 | C4 | C1 | H14 | 111.4° | 81.2° |
| O2 | C3 | C10 | H2 | 124.1° | 121.2° |
| O2 | C3 | C10 | N6 | 111.1° | 67.1° |
| O2 | C3 | C2 | H1 | 79.6° | 116.6° |
| C3 | O2 | C4 | H3 | 86.0° | 78.4° |
| O2 | C3 | C10 | H5 | 128.4° | 172.8° |
| O2 | C3 | C10 | H6 | 9.3° | 52.8° |
| C3 | C10 | N6 | H5 | 120.5° | 120.0° |
| C3 | C10 | N6 | H6 | 120.5° | 120.0° |
| C3 | C10 | N6 | C11 | 47.4° | 180.0° |
| C10 | C3 | C2 | H1 | 30.8° | 2.9° |
| C3 | C10 | H5 | H6 | 118.5° | 120.0° |
| C3 | C10 | N6 | H24 | 73.1° | 56.0° |
| C10 | N6 | C11 | H24 | 120.5° | 124.0° |
| C10 | N6 | C11 | C12 | 134.7° | 180.0° |
| N6 | C10 | C3 | H2 | 13.0° | 54.0° |
| N6 | C10 | H5 | H6 | 118.5° | 120.0° |
| C10 | N6 | C11 | H7 | 105.3° | 60.0° |
| C10 | N6 | C11 | H8 | 14.7° | 60.0° |
| N11 | C17 | N8 | C16 | 179.8° | 180.0° |
| N11 | C17 | N8 | C18 | 179.9° | 180.0° |
| N11 | C17 | C16 | N7 | 0.1° | 0.0° |
| N11 | C17 | C16 | C19 | 179.8° | 180.0° |
| C17 | N11 | H20 | H21 | 120.0° | 180.0° |
| N6 | C11 | C12 | H7 | 120.0° | 120.0° |
| N6 | C11 | C12 | H8 | 120.0° | 120.0° |
| N6 | C11 | C12 | C13 | 110.8° | 180.0° |
| C11 | N6 | C10 | H5 | 167.9° | 60.0° |
| C11 | N6 | C10 | H6 | 73.1° | 60.0° |
| N6 | C11 | H7 | H8 | 120.1° | 119.9° |
| N6 | C11 | C12 | H9 | 9.5° | 59.9° |
| N6 | C11 | C12 | H10 | 128.8° | 60.0° |
| N8 | C17 | C16 | N7 | 179.9° | 179.9° |
| N8 | C17 | C16 | C19 | 0.0° | 0.0° |
| C17 | N8 | C18 | N9 | 0.4° | 0.0° |
| C17 | N8 | C18 | H11 | 179.6° | 180.0° |
| N8 | C17 | N11 | H20 | 0.0° | 0.0° |
| N8 | C17 | N11 | H21 | 120.0° | 180.0° |
| C16 | C17 | N8 | C18 | 0.3° | 0.0° |
| C17 | C16 | N7 | C19 | 179.9° | 179.9° |
| C17 | C16 | N7 | C15 | 179.9° | 180.0° |
| C17 | C16 | C19 | N9 | 0.2° | 0.0° |
| C17 | C16 | C19 | N10 | 180.0° | 180.0° |
| C16 | C17 | N11 | H20 | 179.9° | 180.0° |
| C16 | C17 | N11 | H21 | 59.9° | 0.0° |
| N8 | C18 | N9 | H11 | 180.0° | 180.0° |
| N8 | C18 | N9 | C19 | 0.2° | 0.0° |
| C16 | N7 | C15 | C14 | 179.9° | 180.0° |
| C16 | N7 | C15 | N10 | 0.1° | 0.0° |
| N7 | C16 | C19 | N9 | 179.9° | 180.0° |
| N7 | C16 | C19 | N10 | 0.1° | 0.0° |
| C15 | N7 | C16 | C19 | 0.0° | 0.0° |
| N7 | C15 | C14 | N10 | 179.8° | 179.9° |
| N7 | C15 | N10 | C19 | 0.1° | 0.0° |
| N7 | C15 | C14 | C13 | 175.9° | 122.8° |
| N7 | C15 | N10 | C20 | 179.5° | 180.0° |
| C16 | C19 | N9 | C18 | 0.1° | 0.1° |
| C16 | C19 | N10 | C15 | 0.1° | 0.0° |
| C16 | C19 | N9 | N10 | 179.8° | 180.0° |
| C16 | C19 | N10 | C20 | 179.6° | 180.0° |
| C11 | C12 | C13 | C14 | 165.1° | 65.1° |
| C11 | C12 | C13 | H9 | 120.3° | 120.1° |
| C11 | C12 | C13 | H10 | 120.3° | 120.0° |
| C12 | C11 | H7 | H8 | 120.1° | 120.0° |
| C11 | C12 | H9 | H10 | 119.0° | 120.0° |
| C12 | C11 | N6 | H24 | 14.3° | 56.0° |
| C18 | N9 | C19 | N10 | 179.9° | 180.0° |
| C14 | C15 | N10 | C19 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 88.4° | 172.2° |
| C14 | C15 | N10 | C20 | 0.3° | 0.1° |
| C15 | N10 | C19 | N9 | 179.9° | 180.0° |
| C15 | N10 | C19 | C20 | 179.7° | 180.0° |
| C15 | N10 | C20 | O6 | 81.2° | 39.1° |
| N10 | C15 | C14 | C13 | 3.9° | 57.2° |
| C15 | N10 | C20 | C21 | 33.1° | 75.0° |
| C15 | N10 | C20 | H12 | 155.7° | 162.1° |
| N9 | C19 | N10 | C20 | 0.2° | 0.0° |
| C19 | N9 | C18 | H11 | 179.8° | 180.0° |
| C19 | N10 | C20 | O6 | 99.2° | 140.8° |
| C19 | N10 | C20 | C21 | 146.5° | 105.0° |
| C19 | N10 | C20 | H12 | 24.0° | 17.8° |
| O6 | C23 | C24 | C22 | 114.0° | 117.9° |
| O6 | C23 | C24 | H16 | 122.7° | 121.1° |
| O6 | C23 | C24 | O5 | 154.8° | 67.0° |
| C23 | O6 | C20 | N10 | 147.7° | 158.6° |
| O6 | C23 | C22 | H16 | 121.9° | 119.4° |
| C23 | O6 | C20 | C21 | 29.0° | 40.0° |
| O6 | C23 | C22 | C21 | 28.2° | 2.0° |
| O6 | C23 | C22 | O4 | 86.0° | 120.7° |
| C23 | O6 | C20 | H12 | 89.4° | 78.5° |
| O6 | C23 | C22 | H15 | 148.1° | 116.7° |
| O6 | C23 | C24 | H17 | 34.7° | 172.9° |
| O6 | C23 | C24 | H18 | 85.1° | 52.9° |
| C20 | O6 | C23 | C24 | 117.4° | 146.0° |
| O6 | C20 | N10 | C21 | 114.3° | 114.2° |
| O6 | C20 | N10 | H12 | 123.1° | 123.0° |
| C20 | O6 | C23 | C22 | 0.5° | 26.5° |
| O6 | C20 | C21 | H12 | 119.1° | 118.5° |
| O6 | C20 | C21 | C22 | 45.7° | 37.0° |
| O6 | C20 | C21 | O3 | 159.7° | 155.2° |
| O6 | C20 | C21 | H13 | 73.3° | 81.2° |
| C20 | O6 | C23 | H16 | 120.7° | 92.9° |
| C23 | C24 | O5 | H17 | 120.1° | 120.0° |
| C23 | C24 | O5 | H18 | 120.1° | 120.0° |
| C24 | C23 | C22 | H16 | 123.1° | 121.0° |
| C24 | C23 | C22 | C21 | 86.9° | 121.6° |
| C24 | C23 | C22 | O4 | 159.0° | 119.7° |
| C24 | C23 | C22 | H15 | 33.1° | 2.8° |
| C23 | C24 | H17 | H18 | 119.7° | 120.0° |
| C23 | C24 | O5 | H29 | 180.0° | 179.9° |
| O5 | C24 | C23 | C22 | 40.8° | 175.0° |
| O5 | C24 | C23 | H16 | 82.5° | 54.0° |
| O5 | C24 | H17 | H18 | 119.7° | 120.0° |
| C14 | C13 | C12 | H9 | 74.5° | 55.0° |
| C14 | C13 | C12 | H10 | 44.8° | 174.9° |
| C13 | C12 | C11 | H7 | 129.2° | 60.0° |
| C13 | C12 | C11 | H8 | 9.2° | 60.0° |
| C13 | C12 | H9 | H10 | 119.0° | 120.0° |
| N10 | C20 | C21 | H12 | 122.8° | 122.8° |
| N10 | C20 | C21 | C22 | 163.8° | 155.7° |
| N10 | C20 | C21 | O3 | 82.2° | 86.1° |
| N10 | C20 | C21 | H13 | 44.7° | 37.5° |
| C23 | C22 | C21 | C20 | 44.1° | 20.9° |
| C23 | C22 | C21 | O4 | 114.6° | 118.7° |
| C23 | C22 | C21 | H15 | 119.7° | 118.8° |
| C23 | C22 | C21 | O3 | 158.0° | 139.1° |
| C23 | C22 | O4 | H15 | 125.0° | 122.6° |
| C23 | C22 | C21 | H13 | 74.8° | 97.3° |
| C22 | C23 | C24 | H17 | 79.3° | 55.0° |
| C22 | C23 | C24 | H18 | 160.9° | 65.0° |
| C23 | C22 | O4 | H28 | 180.0° | 65.2° |
| C20 | C21 | C22 | O3 | 113.9° | 118.3° |
| C20 | C21 | C22 | H13 | 119.0° | 118.2° |
| C20 | C21 | O3 | H13 | 126.3° | 123.6° |
| C20 | C21 | C22 | O4 | 70.5° | 97.8° |
| C20 | C21 | C22 | H15 | 163.8° | 139.7° |
| C20 | C21 | O3 | H27 | 180.0° | 180.0° |
| C22 | C21 | O3 | H13 | 126.6° | 123.6° |
| C21 | C22 | O4 | H15 | 125.1° | 122.6° |
| C22 | C21 | C20 | H12 | 73.4° | 81.5° |
| C21 | C22 | C23 | H16 | 150.0° | 117.4° |
| C22 | C21 | O3 | H27 | 72.9° | 67.3° |
| C21 | C22 | O4 | H28 | 70.1° | 180.0° |
| O3 | C21 | C22 | O4 | 43.4° | 20.4° |
| O3 | C21 | C20 | H12 | 40.6° | 36.7° |
| O3 | C21 | C22 | H15 | 82.3° | 102.1° |
| O4 | C22 | C21 | H13 | 170.6° | 144.0° |
| O4 | C22 | C23 | H16 | 35.8° | 1.3° |
| H1 | C2 | C3 | H2 | 157.0° | 123.8° |
| H1 | C2 | C1 | H14 | 19.3° | 21.3° |
| H1 | C2 | O7 | H30 | 55.4° | 57.4° |
| H2 | C3 | C10 | H5 | 107.5° | 66.0° |
| H2 | C3 | C10 | H6 | 133.4° | 174.0° |
| H3 | C4 | C1 | H14 | 127.2° | 160.3° |
| H5 | C10 | N6 | H24 | 47.4° | 176.0° |
| H6 | C10 | N6 | H24 | 166.4° | 64.0° |
| H7 | C11 | C12 | H9 | 110.5° | 60.0° |
| H7 | C11 | C12 | H10 | 8.9° | 180.0° |
| H7 | C11 | N6 | H24 | 134.2° | 64.0° |
| H8 | C11 | C12 | H9 | 129.5° | 180.0° |
| H8 | C11 | C12 | H10 | 111.2° | 60.0° |
| H8 | C11 | N6 | H24 | 105.7° | 176.0° |
| H12 | C20 | C21 | H13 | 167.6° | 160.3° |
| H13 | C21 | C22 | H15 | 44.8° | 21.5° |
| H13 | C21 | O3 | H27 | 53.7° | 56.4° |
| H14 | C1 | O1 | H26 | 56.2° | 62.2° |
| H15 | C22 | C23 | H16 | 90.0° | 123.9° |
| H15 | C22 | O4 | H28 | 55.0° | 57.4° |
| H16 | C23 | C24 | H17 | 157.4° | 66.0° |
| H16 | C23 | C24 | H18 | 37.6° | 174.0° |
| H17 | C24 | O5 | H29 | 59.9° | 60.0° |
| H18 | C24 | O5 | H29 | 59.9° | 60.1° |
