RSW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL | RU | sing | 2.40Å | 2.21Å | |
| C5 | C6 | doub | 1.39Å | 1.44Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.45Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.46Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.46Å | Aromatic |
| C7 | C8 | doub | 1.40Å | 1.45Å | Aromatic |
| C3 | C8 | sing | 1.42Å | 1.47Å | Aromatic |
| C3 | N2 | sing | 1.41Å | 1.45Å | Aromatic |
| C8 | C9 | sing | 1.45Å | 1.44Å | Aromatic |
| O4 | C28 | sing | 1.32Å | 1.35Å | |
| O | C11 | doub | 1.22Å | 1.28Å | |
| N2 | C1 | sing | 1.36Å | 1.39Å | Aromatic |
| N2 | RU | sing | 2.14Å | 1.91Å | |
| C9 | C1 | doub | 1.37Å | 1.43Å | Aromatic |
| C9 | C10 | sing | 1.40Å | 1.50Å | Aromatic |
| C11 | C10 | sing | 1.49Å | 1.41Å | |
| C11 | N12 | sing | 1.38Å | 1.36Å | |
| C1 | C20 | sing | 1.41Å | 1.43Å | Aromatic |
| RU | C23 | sing | 2.20Å | 2.14Å | |
| RU | N19 | sing | 2.16Å | 1.94Å | |
| RU | C24 | sing | 2.19Å | 2.15Å | |
| RU | C22 | sing | 2.21Å | 2.15Å | |
| RU | C25 | sing | 2.19Å | 2.17Å | |
| RU | C27 | sing | 2.20Å | 2.16Å | |
| RU | C26 | sing | 2.19Å | 2.19Å | |
| C10 | C14 | doub | 1.41Å | 1.44Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.42Å | Aromatic |
| N12 | C13 | sing | 1.39Å | 1.36Å | |
| C28 | C22 | sing | 1.50Å | 1.50Å | |
| C28 | O3 | doub | 1.23Å | 1.23Å | |
| C20 | N19 | doub | 1.36Å | 1.40Å | Aromatic |
| C20 | C15 | sing | 1.40Å | 1.47Å | Aromatic |
| C14 | C13 | sing | 1.49Å | 1.41Å | |
| C14 | C15 | sing | 1.43Å | 1.48Å | Aromatic |
| N19 | C18 | sing | 1.32Å | 1.43Å | Aromatic |
| C24 | C25 | doub | 1.37Å | 1.42Å | Aromatic |
| C13 | O2 | doub | 1.22Å | 1.28Å | |
| C22 | C27 | sing | 1.39Å | 1.42Å | Aromatic |
| C15 | C16 | doub | 1.41Å | 1.45Å | Aromatic |
| C18 | C17 | doub | 1.42Å | 1.45Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.45Å | Aromatic |
| C17 | C21 | sing | 1.51Å | 1.50Å | |
| C25 | C26 | sing | 1.37Å | 1.39Å | Aromatic |
| C27 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| C4 | H4 | sing | 0.94Å | 1.08Å | |
| C5 | H5 | sing | 0.94Å | 1.08Å | |
| C6 | H6 | sing | 0.94Å | 1.08Å | |
| C7 | H7 | sing | 0.93Å | 1.08Å | |
| N12 | HN12 | sing | 0.88Å | 1.00Å | |
| C16 | H16 | sing | 0.93Å | 1.08Å | |
| C18 | H18 | sing | 0.93Å | 1.08Å | |
| C21 | H121 | sing | 0.97Å | 1.10Å | |
| C21 | H221 | sing | 0.97Å | 1.10Å | |
| C21 | H321 | sing | 0.97Å | 1.10Å | |
| C23 | H23 | sing | 0.94Å | 1.10Å | |
| C24 | H24 | sing | 0.94Å | 1.10Å | |
| C25 | H25 | sing | 0.94Å | 1.10Å | |
| C26 | H26 | sing | 0.94Å | 1.10Å | |
| C27 | H27 | sing | 0.94Å | 1.10Å | |
| O4 | HO4 | sing | 0.88Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL | RU | N2 | 96.6° | 90.3° |
| CL | RU | C23 | 99.0° | 113.2° |
| CL | RU | N19 | 95.7° | 90.6° |
| CL | RU | C24 | 122.2° | 138.1° |
| CL | RU | C22 | 99.9° | 106.3° |
| CL | RU | C25 | 158.5° | 170.8° |
| CL | RU | C27 | 125.5° | 122.5° |
| CL | RU | C26 | 162.2° | 152.4° |
| C6 | C5 | C4 | 121.3° | 121.6° |
| C5 | C6 | C7 | 120.9° | 120.8° |
| C6 | C5 | H5 | 119.4° | 119.2° |
| C5 | C6 | H6 | 119.5° | 119.5° |
| C5 | C4 | C3 | 117.9° | 118.1° |
| C5 | C4 | H4 | 121.0° | 121.1° |
| C4 | C5 | H5 | 119.3° | 119.2° |
| C6 | C7 | C8 | 118.6° | 118.9° |
| C7 | C6 | H6 | 119.5° | 119.7° |
| C6 | C7 | H7 | 120.7° | 120.4° |
| C4 | C3 | C8 | 121.1° | 121.1° |
| C4 | C3 | N2 | 131.5° | 129.9° |
| C3 | C4 | H4 | 121.0° | 120.8° |
| C7 | C8 | C3 | 120.1° | 119.5° |
| C7 | C8 | C9 | 131.1° | 133.7° |
| C8 | C7 | H7 | 120.7° | 120.8° |
| C8 | C3 | N2 | 107.4° | 109.0° |
| C3 | C8 | C9 | 108.8° | 106.8° |
| C3 | N2 | C1 | 105.7° | 105.6° |
| C3 | N2 | RU | 146.7° | 145.5° |
| C8 | C9 | C1 | 104.3° | 104.9° |
| C8 | C9 | C10 | 142.2° | 137.4° |
| O4 | C28 | C22 | 122.9° | 116.7° |
| O4 | C28 | O3 | 115.9° | 121.5° |
| C28 | O4 | HO4 | 109.5° | 112.4° |
| O | C11 | C10 | 125.3° | 128.8° |
| O | C11 | N12 | 122.9° | 124.2° |
| C1 | N2 | RU | 107.7° | 108.9° |
| N2 | C1 | C9 | 113.8° | 113.8° |
| N2 | C1 | C20 | 119.7° | 122.7° |
| N2 | RU | C23 | 117.8° | 151.1° |
| N2 | RU | N19 | 89.0° | 79.8° |
| N2 | RU | C24 | 84.1° | 129.4° |
| N2 | RU | C22 | 153.2° | 122.6° |
| N2 | RU | C25 | 75.2° | 93.3° |
| N2 | RU | C27 | 136.8° | 87.8° |
| N2 | RU | C26 | 99.0° | 73.7° |
| C1 | C9 | C10 | 113.5° | 117.7° |
| C9 | C1 | C20 | 126.5° | 123.5° |
| C9 | C10 | C11 | 131.6° | 132.2° |
| C9 | C10 | C14 | 122.3° | 120.6° |
| C10 | C11 | N12 | 111.8° | 107.0° |
| C11 | C10 | C14 | 106.2° | 107.1° |
| C11 | N12 | C13 | 104.7° | 111.8° |
| C11 | N12 | HN12 | 127.6° | 124.5° |
| C1 | C20 | N19 | 114.6° | 116.9° |
| C1 | C20 | C15 | 120.1° | 120.0° |
| C23 | RU | N19 | 147.4° | 114.8° |
| C23 | RU | C24 | 37.9° | 36.8° |
| C23 | RU | C22 | 38.7° | 36.8° |
| C23 | RU | C25 | 68.9° | 66.2° |
| C23 | RU | C27 | 69.2° | 65.8° |
| C23 | RU | C26 | 81.2° | 77.9° |
| RU | C23 | C24 | 71.6° | 71.1° |
| RU | C23 | C22 | 71.3° | 71.9° |
| RU | C23 | H23 | 107.5° | 128.9° |
| N19 | RU | C24 | 142.0° | 85.0° |
| N19 | RU | C22 | 110.0° | 150.8° |
| N19 | RU | C25 | 103.8° | 81.7° |
| N19 | RU | C27 | 78.5° | 144.8° |
| N19 | RU | C26 | 76.1° | 107.9° |
| RU | N19 | C20 | 109.1° | 111.7° |
| RU | N19 | C18 | 132.4° | 130.6° |
| C24 | RU | C22 | 69.3° | 66.5° |
| C24 | RU | C25 | 38.3° | 36.5° |
| C24 | RU | C27 | 81.3° | 77.7° |
| C24 | RU | C26 | 68.3° | 65.7° |
| RU | C24 | C23 | 70.5° | 72.1° |
| RU | C24 | C25 | 71.5° | 71.7° |
| RU | C24 | H24 | 107.4° | 128.9° |
| C22 | RU | C25 | 81.9° | 78.8° |
| C22 | RU | C27 | 38.4° | 36.8° |
| C22 | RU | C26 | 69.1° | 66.7° |
| RU | C22 | C23 | 69.9° | 71.3° |
| RU | C22 | C28 | 130.6° | 130.0° |
| RU | C22 | C27 | 71.2° | 71.0° |
| C25 | RU | C27 | 68.2° | 66.2° |
| C25 | RU | C26 | 37.2° | 36.6° |
| RU | C25 | C24 | 70.1° | 71.8° |
| RU | C25 | C26 | 72.1° | 71.5° |
| RU | C25 | H25 | 107.3° | 129.2° |
| C27 | RU | C26 | 37.9° | 36.9° |
| RU | C27 | C22 | 70.4° | 72.1° |
| RU | C27 | C26 | 71.9° | 71.2° |
| RU | C27 | H27 | 107.3° | 128.6° |
| RU | C26 | C25 | 70.6° | 71.9° |
| RU | C26 | C27 | 70.2° | 72.0° |
| RU | C26 | H26 | 106.8° | 128.9° |
| C10 | C14 | C13 | 102.9° | 107.2° |
| C10 | C14 | C15 | 121.7° | 120.9° |
| C24 | C23 | C22 | 120.8° | 120.4° |
| C23 | C24 | C25 | 120.2° | 120.6° |
| C24 | C23 | H23 | 117.4° | 119.3° |
| C23 | C24 | H24 | 117.5° | 119.6° |
| C23 | C22 | C28 | 120.2° | 121.6° |
| C23 | C22 | C27 | 118.3° | 118.2° |
| C22 | C23 | H23 | 116.8° | 120.2° |
| N12 | C13 | C14 | 114.4° | 106.8° |
| N12 | C13 | O2 | 122.1° | 124.2° |
| C13 | N12 | HN12 | 127.6° | 123.7° |
| C22 | C28 | O3 | 121.2° | 121.8° |
| C28 | C22 | C27 | 121.5° | 120.2° |
| N19 | C20 | C15 | 125.3° | 123.1° |
| C20 | N19 | C18 | 118.5° | 117.7° |
| C20 | C15 | C14 | 115.9° | 117.3° |
| C20 | C15 | C16 | 115.2° | 117.8° |
| C13 | C14 | C15 | 135.4° | 131.8° |
| C14 | C13 | O2 | 123.5° | 129.0° |
| C14 | C15 | C16 | 128.9° | 124.9° |
| N19 | C18 | C17 | 119.4° | 123.9° |
| N19 | C18 | H18 | 120.3° | 118.2° |
| C24 | C25 | C26 | 120.1° | 119.7° |
| C25 | C24 | H24 | 117.0° | 119.8° |
| C24 | C25 | H25 | 117.1° | 120.2° |
| C22 | C27 | C26 | 120.5° | 120.8° |
| C22 | C27 | H27 | 117.0° | 119.9° |
| C15 | C16 | C17 | 120.1° | 119.5° |
| C15 | C16 | H16 | 119.9° | 120.6° |
| C18 | C17 | C16 | 121.5° | 118.0° |
| C18 | C17 | C21 | 119.0° | 120.0° |
| C17 | C18 | H18 | 120.3° | 117.9° |
| C16 | C17 | C21 | 119.5° | 122.0° |
| C17 | C16 | H16 | 120.0° | 120.0° |
| C17 | C21 | H121 | 109.5° | 109.8° |
| C17 | C21 | H221 | 109.5° | 109.7° |
| C17 | C21 | H321 | 109.5° | 109.4° |
| C25 | C26 | C27 | 120.1° | 120.3° |
| C26 | C25 | H25 | 117.7° | 120.1° |
| C25 | C26 | H26 | 117.1° | 119.8° |
| C27 | C26 | H26 | 116.6° | 119.9° |
| C26 | C27 | H27 | 117.1° | 119.3° |
| H121 | C21 | H221 | 109.5° | 109.2° |
| H121 | C21 | H321 | 109.5° | 109.4° |
| H221 | C21 | H321 | 109.4° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL | RU | N2 | C3 | 84.2° | 90.1° |
| CL | RU | N2 | C1 | 95.4° | 92.2° |
| CL | RU | N2 | C23 | 103.9° | 145.6° |
| CL | RU | N2 | N19 | 95.6° | 90.6° |
| CL | RU | N2 | C24 | 121.8° | 165.3° |
| CL | RU | N2 | C22 | 127.9° | 109.7° |
| CL | RU | N2 | C25 | 159.8° | 171.5° |
| CL | RU | N2 | C27 | 167.6° | 122.5° |
| CL | RU | N2 | C26 | 171.3° | 157.2° |
| CL | RU | C23 | N19 | 115.7° | 102.2° |
| CL | RU | C23 | C24 | 132.4° | 141.1° |
| CL | RU | C23 | C22 | 94.6° | 86.4° |
| CL | RU | C23 | C25 | 161.6° | 170.0° |
| CL | RU | C23 | C27 | 124.6° | 116.7° |
| CL | RU | C23 | C26 | 161.9° | 153.5° |
| CL | RU | N19 | C24 | 175.6° | 138.2° |
| CL | RU | N19 | C22 | 102.7° | 126.6° |
| CL | RU | N19 | C25 | 171.0° | 174.9° |
| CL | RU | N19 | C27 | 125.1° | 161.4° |
| CL | RU | N19 | C26 | 163.9° | 159.3° |
| CL | RU | C24 | C22 | 88.8° | 88.5° |
| CL | RU | C24 | C25 | 167.6° | 168.1° |
| CL | RU | C24 | C27 | 126.7° | 125.5° |
| CL | RU | C24 | C26 | 163.7° | 162.4° |
| CL | RU | C22 | C25 | 158.3° | 172.1° |
| CL | RU | C22 | C27 | 136.7° | 122.9° |
| CL | RU | C22 | C26 | 165.4° | 151.6° |
| CL | RU | C25 | C27 | 133.8° | 161.0° |
| CL | RU | C25 | C26 | 162.4° | 169.7° |
| CL | RU | C27 | C26 | 170.8° | 154.4° |
| CL | RU | C22 | C28 | 21.0° | 8.9° |
| CL | RU | N19 | C20 | 96.2° | 92.0° |
| CL | RU | N19 | C18 | 83.0° | 89.6° |
| CL | RU | C23 | H23 | 18.6° | 28.2° |
| CL | RU | C24 | H24 | 54.2° | 54.2° |
| CL | RU | C25 | H25 | 83.4° | 55.4° |
| CL | RU | C26 | H26 | 87.8° | 62.3° |
| CL | RU | C27 | H27 | 57.2° | 41.5° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.0° | 0.0° |
| C5 | C6 | C7 | C8 | 0.0° | 0.0° |
| C6 | C5 | C4 | H4 | 180.0° | 179.9° |
| C5 | C6 | C7 | H7 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 0.1° | 0.0° |
| C5 | C4 | C3 | H4 | 180.0° | 179.9° |
| C5 | C4 | C3 | C8 | 0.1° | 0.0° |
| C5 | C4 | C3 | N2 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.9° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C3 | 0.1° | 0.0° |
| C6 | C7 | C8 | C9 | 179.8° | 179.9° |
| C7 | C6 | C5 | H5 | 179.9° | 180.0° |
| C4 | C3 | C8 | C7 | 0.1° | 0.0° |
| C4 | C3 | C8 | N2 | 180.0° | 180.0° |
| C4 | C3 | C8 | C9 | 179.8° | 179.9° |
| C4 | C3 | N2 | C1 | 179.8° | 179.9° |
| C4 | C3 | N2 | RU | 0.3° | 2.4° |
| C3 | C4 | C5 | H5 | 180.0° | 180.0° |
| C7 | C8 | C3 | C9 | 179.9° | 179.9° |
| C7 | C8 | C3 | N2 | 179.9° | 180.0° |
| C7 | C8 | C9 | C1 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.1° | 0.0° |
| C8 | C7 | C6 | H6 | 180.0° | 180.0° |
| C8 | C3 | N2 | C1 | 0.2° | 0.1° |
| C8 | C3 | N2 | RU | 179.7° | 177.6° |
| C3 | C8 | C9 | C1 | 0.1° | 0.0° |
| C3 | C8 | C9 | C10 | 179.8° | 179.9° |
| C8 | C3 | C4 | H4 | 179.9° | 180.0° |
| C3 | C8 | C7 | H7 | 179.9° | 180.0° |
| N2 | C3 | C8 | C9 | 0.2° | 0.1° |
| C3 | N2 | C1 | RU | 179.7° | 178.6° |
| C3 | N2 | C1 | C9 | 0.1° | 0.1° |
| C3 | N2 | C1 | C20 | 179.8° | 179.9° |
| C3 | N2 | RU | C23 | 19.7° | 55.5° |
| C3 | N2 | RU | N19 | 179.8° | 179.3° |
| C3 | N2 | RU | C24 | 37.7° | 104.6° |
| C3 | N2 | RU | C22 | 43.7° | 19.6° |
| C3 | N2 | RU | C25 | 75.6° | 98.4° |
| C3 | N2 | RU | C27 | 108.2° | 32.4° |
| C3 | N2 | RU | C26 | 104.5° | 67.1° |
| N2 | C3 | C4 | H4 | 0.0° | 0.1° |
| C8 | C9 | C1 | N2 | 0.0° | 0.0° |
| C8 | C9 | C1 | C10 | 179.9° | 180.0° |
| C8 | C9 | C10 | C11 | 0.0° | 0.1° |
| C8 | C9 | C1 | C20 | 179.9° | 179.9° |
| C8 | C9 | C10 | C14 | 179.8° | 180.0° |
| C9 | C8 | C7 | H7 | 0.2° | 0.1° |
| O4 | C28 | C22 | RU | 88.6° | 91.9° |
| O4 | C28 | C22 | C23 | 0.0° | 0.4° |
| O4 | C28 | C22 | O3 | 179.9° | 180.0° |
| O4 | C28 | C22 | C27 | 179.8° | 178.2° |
| O | C11 | C10 | C9 | 0.1° | 0.0° |
| O | C11 | C10 | N12 | 180.0° | 180.0° |
| O | C11 | C10 | C14 | 180.0° | 179.9° |
| O | C11 | N12 | C13 | 180.0° | 180.0° |
| O | C11 | N12 | HN12 | 0.1° | 0.0° |
| N2 | C1 | C9 | C20 | 179.9° | 180.0° |
| N2 | C1 | C9 | C10 | 179.9° | 180.0° |
| C1 | N2 | RU | C23 | 160.8° | 122.1° |
| C1 | N2 | RU | N19 | 0.2° | 1.7° |
| C1 | N2 | RU | C24 | 142.8° | 73.1° |
| C1 | N2 | RU | C22 | 136.8° | 158.1° |
| C1 | N2 | RU | C25 | 104.8° | 79.3° |
| C1 | N2 | RU | C27 | 72.3° | 145.2° |
| C1 | N2 | RU | C26 | 76.0° | 110.6° |
| N2 | C1 | C20 | N19 | 0.2° | 0.0° |
| N2 | C1 | C20 | C15 | 179.9° | 180.0° |
| RU | N2 | C1 | C9 | 179.8° | 178.5° |
| RU | N2 | C1 | C20 | 0.1° | 1.5° |
| N2 | RU | C23 | N19 | 141.8° | 115.7° |
| N2 | RU | C23 | C24 | 30.0° | 76.8° |
| N2 | RU | C23 | C22 | 163.0° | 55.7° |
| N2 | RU | C23 | C25 | 59.1° | 47.9° |
| N2 | RU | C23 | C27 | 132.9° | 25.5° |
| N2 | RU | C23 | C26 | 95.6° | 11.3° |
| N2 | RU | N19 | C24 | 79.1° | 131.6° |
| N2 | RU | N19 | C22 | 160.8° | 143.2° |
| N2 | RU | N19 | C25 | 74.4° | 94.9° |
| N2 | RU | N19 | C27 | 138.4° | 71.2° |
| N2 | RU | N19 | C26 | 99.5° | 69.1° |
| N2 | RU | C24 | C22 | 177.1° | 113.7° |
| N2 | RU | C24 | C25 | 73.5° | 10.4° |
| N2 | RU | C24 | C27 | 139.2° | 76.7° |
| N2 | RU | C24 | C26 | 102.2° | 39.8° |
| N2 | RU | C22 | C25 | 31.1° | 86.7° |
| N2 | RU | C22 | C27 | 96.0° | 21.7° |
| N2 | RU | C22 | C26 | 67.3° | 50.4° |
| N2 | RU | C25 | C27 | 156.6° | 86.1° |
| N2 | RU | C25 | C26 | 128.0° | 56.8° |
| N2 | RU | C27 | C26 | 6.0° | 65.4° |
| N2 | RU | C22 | C28 | 148.2° | 92.3° |
| N2 | RU | N19 | C20 | 0.3° | 1.8° |
| N2 | RU | N19 | C18 | 179.5° | 179.8° |
| N2 | RU | C23 | H23 | 83.9° | 170.3° |
| N2 | RU | C24 | H24 | 39.9° | 103.6° |
| N2 | RU | C25 | H25 | 13.8° | 57.5° |
| N2 | RU | C26 | H26 | 63.0° | 5.4° |
| N2 | RU | C27 | H27 | 107.6° | 47.5° |
| C1 | C9 | C10 | C11 | 179.9° | 180.0° |
| C1 | C9 | C10 | C14 | 0.1° | 0.1° |
| C9 | C1 | C20 | N19 | 179.9° | 180.0° |
| C9 | C1 | C20 | C15 | 0.0° | 0.0° |
| C9 | C10 | C11 | C14 | 179.9° | 179.9° |
| C9 | C10 | C11 | N12 | 179.9° | 180.0° |
| C10 | C9 | C1 | C20 | 0.0° | 0.0° |
| C9 | C10 | C14 | C13 | 180.0° | 180.0° |
| C9 | C10 | C14 | C15 | 0.1° | 0.1° |
| C10 | C11 | N12 | C13 | 0.0° | 0.0° |
| C11 | C10 | C14 | C13 | 0.1° | 0.1° |
| C11 | C10 | C14 | C15 | 180.0° | 180.0° |
| C10 | C11 | N12 | HN12 | 180.0° | 180.0° |
| N12 | C11 | C10 | C14 | 0.0° | 0.1° |
| C11 | N12 | C13 | HN12 | 180.0° | 180.0° |
| C11 | N12 | C13 | C14 | 0.1° | 0.0° |
| C11 | N12 | C13 | O2 | 180.0° | 180.0° |
| C1 | C20 | N19 | RU | 0.3° | 1.5° |
| C1 | C20 | N19 | C15 | 179.9° | 180.0° |
| C1 | C20 | C15 | C14 | 0.0° | 0.0° |
| C1 | C20 | N19 | C18 | 179.6° | 179.8° |
| C1 | C20 | C15 | C16 | 179.9° | 180.0° |
| C23 | RU | N19 | C24 | 67.8° | 22.2° |
| C23 | RU | N19 | C22 | 13.9° | 10.6° |
| C23 | RU | N19 | C25 | 72.4° | 58.9° |
| C23 | RU | N19 | C27 | 8.5° | 82.6° |
| C23 | RU | N19 | C26 | 47.3° | 84.7° |
| C23 | RU | C24 | C22 | 29.3° | 28.8° |
| C23 | RU | C24 | C25 | 132.9° | 132.1° |
| C23 | RU | C24 | C27 | 67.1° | 65.8° |
| C23 | RU | C24 | C26 | 104.2° | 102.7° |
| C23 | RU | C22 | C25 | 66.2° | 65.0° |
| C23 | RU | C22 | C27 | 131.1° | 130.1° |
| C23 | RU | C22 | C26 | 102.4° | 101.3° |
| C23 | RU | C25 | C27 | 75.1° | 72.8° |
| C23 | RU | C25 | C26 | 103.7° | 102.2° |
| C23 | RU | C27 | C26 | 102.9° | 102.6° |
| RU | C23 | C24 | H23 | 100.6° | 124.7° |
| RU | C23 | C22 | H23 | 100.6° | 125.1° |
| RU | C23 | C22 | C28 | 126.1° | 126.1° |
| C23 | RU | N19 | C20 | 147.2° | 152.0° |
| C23 | RU | N19 | C18 | 33.6° | 26.4° |
| C23 | RU | C24 | H24 | 113.7° | 113.9° |
| C23 | RU | C25 | H25 | 142.0° | 143.6° |
| C23 | RU | C26 | H26 | 180.0° | 179.8° |
| C23 | RU | C27 | H27 | 143.5° | 144.5° |
| N19 | RU | C24 | C22 | 96.4° | 173.8° |
| N19 | RU | C24 | C25 | 7.3° | 82.8° |
| N19 | RU | C24 | C27 | 58.5° | 149.2° |
| N19 | RU | C24 | C26 | 21.4° | 112.3° |
| N19 | RU | C22 | C25 | 101.8° | 48.9° |
| N19 | RU | C22 | C27 | 36.9° | 113.9° |
| N19 | RU | C22 | C26 | 65.6° | 85.2° |
| N19 | RU | C25 | C27 | 71.4° | 165.3° |
| N19 | RU | C25 | C26 | 42.8° | 136.0° |
| N19 | RU | C27 | C26 | 82.0° | 3.4° |
| N19 | RU | C22 | C28 | 78.8° | 132.1° |
| RU | N19 | C20 | C18 | 179.3° | 178.7° |
| RU | N19 | C20 | C15 | 179.7° | 178.5° |
| RU | N19 | C18 | C17 | 179.6° | 178.2° |
| RU | N19 | C18 | H18 | 0.4° | 1.6° |
| N19 | RU | C23 | H23 | 134.3° | 74.0° |
| N19 | RU | C24 | H24 | 120.6° | 31.1° |
| N19 | RU | C25 | H25 | 71.4° | 21.7° |
| N19 | RU | C26 | H26 | 23.7° | 67.8° |
| N19 | RU | C27 | H27 | 31.6° | 116.3° |
| C24 | RU | C22 | C25 | 37.5° | 36.2° |
| C24 | RU | C22 | C27 | 102.4° | 101.2° |
| C24 | RU | C22 | C26 | 73.8° | 72.5° |
| C24 | RU | C25 | C27 | 104.0° | 101.9° |
| C24 | RU | C25 | C26 | 132.6° | 131.2° |
| C24 | RU | C27 | C26 | 65.6° | 65.7° |
| C24 | RU | C22 | C28 | 141.8° | 144.8° |
| C24 | RU | N19 | C20 | 79.4° | 129.8° |
| C24 | RU | N19 | C18 | 101.4° | 48.6° |
| RU | C24 | C25 | H24 | 100.6° | 124.9° |
| C24 | RU | C25 | H25 | 113.2° | 114.5° |
| C24 | RU | C26 | H26 | 142.9° | 143.5° |
| C24 | RU | C27 | H27 | 179.2° | 178.7° |
| C22 | RU | C25 | C27 | 37.3° | 36.5° |
| C22 | RU | C25 | C26 | 65.9° | 65.8° |
| C22 | RU | C27 | C26 | 133.2° | 132.7° |
| RU | C22 | C28 | C27 | 91.6° | 89.9° |
| RU | C22 | C28 | O3 | 91.5° | 88.1° |
| C22 | RU | N19 | C20 | 161.1° | 141.5° |
| C22 | RU | N19 | C18 | 19.7° | 37.0° |
| C22 | RU | C24 | H24 | 143.0° | 142.7° |
| C22 | RU | C25 | H25 | 179.9° | 179.9° |
| C22 | RU | C26 | H26 | 141.9° | 142.9° |
| C22 | RU | C27 | H27 | 113.2° | 114.4° |
| C25 | RU | C27 | C26 | 28.1° | 29.1° |
| C25 | RU | C22 | C28 | 179.3° | 179.0° |
| C25 | RU | N19 | C20 | 74.8° | 93.1° |
| C25 | RU | N19 | C18 | 106.0° | 85.3° |
| RU | C25 | C26 | H25 | 100.6° | 125.2° |
| C25 | RU | C23 | H23 | 143.0° | 141.8° |
| C25 | RU | C26 | H26 | 113.4° | 114.1° |
| C25 | RU | C27 | H27 | 141.7° | 142.0° |
| C27 | RU | N19 | C20 | 138.7° | 69.5° |
| C27 | RU | N19 | C18 | 42.1° | 109.0° |
| RU | C27 | C26 | H27 | 100.6° | 124.4° |
| C27 | RU | C23 | H23 | 143.2° | 144.8° |
| C27 | RU | C24 | H24 | 179.1° | 179.7° |
| C27 | RU | C25 | H25 | 142.8° | 143.6° |
| C27 | RU | C26 | H26 | 112.8° | 114.2° |
| C26 | RU | C22 | C28 | 144.4° | 142.7° |
| C26 | RU | N19 | C20 | 99.9° | 67.3° |
| C26 | RU | N19 | C18 | 81.0° | 111.1° |
| C26 | RU | C23 | H23 | 179.5° | 178.4° |
| C26 | RU | C24 | H24 | 142.0° | 143.4° |
| C10 | C14 | C13 | N12 | 0.1° | 0.0° |
| C10 | C14 | C15 | C20 | 0.1° | 0.1° |
| C10 | C14 | C13 | C15 | 179.9° | 179.9° |
| C10 | C14 | C13 | O2 | 180.0° | 180.0° |
| C10 | C14 | C15 | C16 | 180.0° | 179.9° |
| C24 | C23 | C22 | H23 | 154.5° | 179.1° |
| C24 | C23 | C22 | C28 | 180.0° | 179.8° |
| C23 | C24 | C25 | H24 | 153.6° | 180.0° |
| C24 | C23 | C22 | C27 | 0.2° | 1.2° |
| C23 | C24 | C25 | C26 | 1.1° | 0.1° |
| C23 | C24 | C25 | H25 | 152.9° | 179.7° |
| C23 | C22 | C28 | C27 | 179.8° | 178.6° |
| C23 | C22 | C28 | O3 | 179.9° | 179.5° |
| C22 | C23 | C24 | C25 | 0.3° | 0.5° |
| C23 | C22 | C27 | C26 | 0.1° | 1.4° |
| C22 | C23 | C24 | H24 | 153.7° | 179.5° |
| C23 | C22 | C27 | H27 | 153.5° | 179.8° |
| N12 | C13 | C14 | O2 | 179.9° | 180.0° |
| N12 | C13 | C14 | C15 | 180.0° | 179.9° |
| C28 | C22 | C27 | C26 | 179.7° | 180.0° |
| C28 | C22 | C23 | H23 | 25.5° | 1.1° |
| C28 | C22 | C27 | H27 | 26.7° | 1.1° |
| C22 | C28 | O4 | HO4 | 179.9° | 179.8° |
| O3 | C28 | C22 | C27 | 0.1° | 1.8° |
| O3 | C28 | O4 | HO4 | 0.0° | 0.1° |
| N19 | C20 | C15 | C14 | 180.0° | 180.0° |
| N19 | C20 | C15 | C16 | 0.1° | 0.0° |
| C20 | N19 | C18 | C17 | 0.4° | 0.2° |
| C20 | N19 | C18 | H18 | 179.6° | 179.9° |
| C20 | C15 | C14 | C13 | 180.0° | 179.9° |
| C20 | C15 | C14 | C16 | 179.9° | 180.0° |
| C15 | C20 | N19 | C18 | 0.4° | 0.2° |
| C20 | C15 | C16 | C17 | 0.1° | 0.1° |
| C20 | C15 | C16 | H16 | 179.9° | 179.9° |
| C13 | C14 | C15 | C16 | 0.2° | 0.0° |
| C14 | C13 | N12 | HN12 | 179.9° | 180.0° |
| C15 | C14 | C13 | O2 | 0.1° | 0.1° |
| C14 | C15 | C16 | C17 | 179.8° | 179.8° |
| C14 | C15 | C16 | H16 | 0.2° | 0.1° |
| N19 | C18 | C17 | H18 | 180.0° | 179.7° |
| N19 | C18 | C17 | C16 | 0.3° | 0.1° |
| N19 | C18 | C17 | C21 | 179.8° | 179.8° |
| C24 | C25 | C26 | H25 | 153.8° | 179.5° |
| C24 | C25 | C26 | C27 | 1.4° | 0.1° |
| C25 | C24 | C23 | H23 | 154.1° | 179.6° |
| C24 | C25 | C26 | H26 | 152.7° | 179.7° |
| O2 | C13 | N12 | HN12 | 0.0° | 0.0° |
| C22 | C27 | C26 | C25 | 0.9° | 0.8° |
| C22 | C27 | C26 | H27 | 153.5° | 178.9° |
| C27 | C22 | C23 | H23 | 154.7° | 179.7° |
| C22 | C27 | C26 | H26 | 152.3° | 179.5° |
| C15 | C16 | C17 | C18 | 0.0° | 0.1° |
| C15 | C16 | C17 | H16 | 180.0° | 179.7° |
| C15 | C16 | C17 | C21 | 179.9° | 179.9° |
| C18 | C17 | C16 | C21 | 180.0° | 179.8° |
| C18 | C17 | C16 | H16 | 180.0° | 179.9° |
| C18 | C17 | C21 | H121 | 90.0° | 151.9° |
| C18 | C17 | C21 | H221 | 150.0° | 31.9° |
| C18 | C17 | C21 | H321 | 30.0° | 88.0° |
| C16 | C17 | C18 | H18 | 179.8° | 179.8° |
| C16 | C17 | C21 | H121 | 90.0° | 28.3° |
| C16 | C17 | C21 | H221 | 30.0° | 148.3° |
| C16 | C17 | C21 | H321 | 150.0° | 91.8° |
| C21 | C17 | C16 | H16 | 0.1° | 0.3° |
| C21 | C17 | C18 | H18 | 0.2° | 0.0° |
| C17 | C21 | H121 | H221 | 120.0° | 120.3° |
| C17 | C21 | H121 | H321 | 120.0° | 120.1° |
| C17 | C21 | H221 | H321 | 120.0° | 120.0° |
| C25 | C26 | C27 | H26 | 151.4° | 179.7° |
| C26 | C25 | C24 | H24 | 154.7° | 179.9° |
| C25 | C26 | C27 | H27 | 152.6° | 179.7° |
| C27 | C26 | C25 | H25 | 152.4° | 179.5° |
| H4 | C4 | C5 | H5 | 0.0° | 0.1° |
| H5 | C5 | C6 | H6 | 0.1° | 0.0° |
| H6 | C6 | C7 | H7 | 0.0° | 0.0° |
| H121 | C21 | H221 | H321 | 120.0° | 119.7° |
| H23 | C23 | C24 | H24 | 0.6° | 0.4° |
| H24 | C24 | C25 | H25 | 0.7° | 0.4° |
| H25 | C25 | C26 | H26 | 1.1° | 0.2° |
| H26 | C26 | C27 | H27 | 1.2° | 0.7° |






