JSC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| RU | C11 | sing | 2.18Å | 2.19Å | |
| RU | C12 | sing | 2.19Å | 2.19Å | |
| RU | C13 | sing | 2.20Å | 2.20Å | |
| RU | C14 | sing | 2.19Å | 2.20Å | |
| RU | C15 | sing | 2.18Å | 2.18Å | |
| RU | C16 | sing | 2.18Å | 2.21Å | |
| RU | C17 | sing | 2.19Å | 2.20Å | |
| RU | C18 | sing | 2.19Å | 2.18Å | |
| RU | C19 | sing | 2.18Å | 2.19Å | |
| RU | C20 | sing | 2.18Å | 2.18Å | |
| C11 | C12 | doub | 1.40Å | 1.38Å | |
| C11 | C15 | sing | 1.42Å | 1.39Å | |
| C12 | C13 | sing | 1.41Å | 1.39Å | |
| C13 | C14 | doub | 1.40Å | 1.38Å | |
| C14 | C15 | sing | 1.40Å | 1.39Å | |
| C16 | C17 | doub | 1.39Å | 1.39Å | |
| C16 | C20 | sing | 1.41Å | 1.39Å | |
| C17 | C18 | sing | 1.40Å | 1.39Å | |
| C18 | C19 | doub | 1.39Å | 1.40Å | |
| C18 | C24 | sing | 1.47Å | 1.49Å | |
| C19 | C20 | sing | 1.40Å | 1.38Å | |
| C24 | C25 | sing | 1.51Å | 1.52Å | |
| C24 | O28 | doub | 1.22Å | 1.23Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C26 | C27 | sing | 1.52Å | 1.52Å | |
| C27 | O29 | doub | 1.24Å | 1.23Å | |
| C27 | N30 | sing | 1.35Å | 1.34Å | |
| N30 | C31 | sing | 1.46Å | 1.44Å | |
| C31 | C32 | sing | 1.53Å | 1.50Å | |
| C31 | C34 | sing | 1.55Å | 1.52Å | |
| C32 | O38 | doub | 1.21Å | 1.23Å | |
| C32 | O67 | sing | 1.31Å | 1.33Å | |
| N33 | C34 | sing | 1.48Å | 1.45Å | |
| N33 | C51 | sing | 1.47Å | 1.45Å | |
| C34 | S49 | sing | 1.83Å | 1.81Å | |
| S49 | C50 | sing | 1.85Å | 1.77Å | |
| C50 | C51 | sing | 1.58Å | 1.54Å | |
| C50 | C52 | sing | 1.53Å | 1.53Å | |
| C50 | C53 | sing | 1.53Å | 1.54Å | |
| C51 | C63 | sing | 1.52Å | 1.48Å | |
| C63 | O64 | doub | 1.22Å | 1.22Å | |
| C63 | O65 | sing | 1.32Å | 1.33Å | |
| C25 | H10 | sing | 0.98Å | 1.10Å | |
| C25 | H11 | sing | 0.98Å | 1.10Å | |
| C26 | H12 | sing | 0.98Å | 1.10Å | |
| C26 | H13 | sing | 0.98Å | 1.10Å | |
| N30 | H14 | sing | 0.88Å | 1.00Å | |
| C31 | H15 | sing | 0.99Å | 1.10Å | |
| N33 | H16 | sing | 0.88Å | 1.00Å | |
| C34 | H18 | sing | 0.99Å | 1.10Å | |
| C51 | H19 | sing | 0.99Å | 1.10Å | |
| C52 | H20 | sing | 0.98Å | 1.10Å | |
| C52 | H21 | sing | 0.97Å | 1.10Å | |
| C52 | H22 | sing | 0.97Å | 1.10Å | |
| C53 | H23 | sing | 0.97Å | 1.10Å | |
| C53 | H24 | sing | 0.97Å | 1.10Å | |
| C53 | H25 | sing | 0.98Å | 1.10Å | |
| O65 | H26 | sing | 0.88Å | 0.95Å | |
| O67 | H27 | sing | 0.88Å | 0.95Å | |
| H1 | C11 | sing | 0.94Å | 1.10Å | |
| H2 | C12 | sing | 0.94Å | 1.10Å | |
| H3 | C13 | sing | 0.94Å | 1.10Å | |
| H4 | C14 | sing | 0.94Å | 1.10Å | |
| H5 | C15 | sing | 0.94Å | 1.10Å | |
| H6 | C16 | sing | 0.94Å | 1.10Å | |
| H7 | C17 | sing | 0.94Å | 1.10Å | |
| H8 | C19 | sing | 0.94Å | 1.10Å | |
| H9 | C20 | sing | 0.94Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | RU | C12 | 36.7° | 37.4° |
| C11 | RU | C13 | 61.4° | 62.4° |
| C11 | RU | C14 | 62.0° | 63.0° |
| C11 | RU | C15 | 37.2° | 37.9° |
| C11 | RU | C16 | 130.5° | 95.9° |
| C11 | RU | C17 | 111.6° | 128.3° |
| C11 | RU | C18 | 120.0° | 155.9° |
| C11 | RU | C19 | 152.4° | 125.5° |
| C11 | RU | C20 | 166.4° | 94.4° |
| RU | C11 | C12 | 71.5° | 71.6° |
| RU | C11 | C15 | 71.2° | 71.1° |
| RU | C11 | H1 | 111.6° | 122.8° |
| C12 | RU | C13 | 36.9° | 37.5° |
| C12 | RU | C14 | 61.7° | 62.9° |
| C12 | RU | C15 | 61.6° | 62.9° |
| C12 | RU | C16 | 114.2° | 115.5° |
| C12 | RU | C17 | 120.8° | 128.4° |
| C12 | RU | C18 | 149.7° | 159.9° |
| C12 | RU | C19 | 170.8° | 162.4° |
| C12 | RU | C20 | 134.6° | 129.8° |
| RU | C12 | C11 | 71.8° | 71.0° |
| RU | C12 | C13 | 72.2° | 71.7° |
| RU | C12 | H2 | 111.4° | 123.7° |
| C13 | RU | C14 | 36.6° | 37.2° |
| C13 | RU | C15 | 61.2° | 62.2° |
| C13 | RU | C16 | 125.3° | 153.0° |
| C13 | RU | C17 | 152.5° | 147.8° |
| C13 | RU | C18 | 170.5° | 141.4° |
| C13 | RU | C19 | 137.6° | 142.3° |
| C13 | RU | C20 | 118.8° | 149.3° |
| RU | C13 | C12 | 71.0° | 70.8° |
| RU | C13 | C14 | 71.5° | 71.0° |
| RU | C13 | H3 | 111.0° | 122.9° |
| C14 | RU | C15 | 37.0° | 37.4° |
| C14 | RU | C16 | 156.2° | 148.0° |
| C14 | RU | C17 | 167.1° | 167.8° |
| C14 | RU | C18 | 134.4° | 130.5° |
| C14 | RU | C19 | 118.5° | 108.4° |
| C14 | RU | C20 | 127.3° | 115.8° |
| RU | C14 | C13 | 71.9° | 71.7° |
| RU | C14 | C15 | 71.0° | 71.0° |
| RU | C14 | H4 | 111.6° | 123.9° |
| C15 | RU | C16 | 165.0° | 111.3° |
| C15 | RU | C17 | 131.0° | 147.4° |
| C15 | RU | C18 | 113.6° | 137.2° |
| C15 | RU | C19 | 124.9° | 100.6° |
| C15 | RU | C20 | 156.3° | 87.1° |
| RU | C15 | C11 | 71.6° | 70.9° |
| RU | C15 | C14 | 72.0° | 71.6° |
| RU | C15 | H5 | 111.5° | 122.6° |
| C16 | RU | C17 | 36.6° | 37.0° |
| C16 | RU | C18 | 61.9° | 62.4° |
| C16 | RU | C19 | 61.4° | 62.7° |
| C16 | RU | C20 | 36.8° | 37.8° |
| RU | C16 | C17 | 71.2° | 71.9° |
| RU | C16 | C20 | 70.1° | 71.0° |
| RU | C16 | H6 | 111.2° | 123.1° |
| C17 | RU | C18 | 37.0° | 37.3° |
| C17 | RU | C19 | 61.3° | 62.1° |
| C17 | RU | C20 | 61.4° | 62.2° |
| RU | C17 | C16 | 72.3° | 71.2° |
| RU | C17 | C18 | 70.5° | 71.2° |
| RU | C17 | H7 | 110.9° | 122.9° |
| C18 | RU | C19 | 37.4° | 37.1° |
| C18 | RU | C20 | 62.4° | 62.3° |
| RU | C18 | C17 | 72.5° | 71.5° |
| RU | C18 | C19 | 71.8° | 71.3° |
| RU | C18 | C24 | 118.8° | 123.5° |
| C19 | RU | C20 | 37.0° | 37.5° |
| RU | C19 | C18 | 70.8° | 71.7° |
| RU | C19 | C20 | 71.1° | 71.1° |
| RU | C19 | H8 | 111.3° | 123.0° |
| RU | C20 | C16 | 73.1° | 71.3° |
| RU | C20 | C19 | 72.0° | 71.5° |
| RU | C20 | H9 | 111.6° | 122.4° |
| C12 | C11 | C15 | 107.5° | 107.9° |
| C11 | C12 | C13 | 108.2° | 107.6° |
| C12 | C11 | H1 | 125.7° | 126.0° |
| C11 | C12 | H2 | 125.3° | 126.2° |
| C11 | C15 | C14 | 108.4° | 108.1° |
| C15 | C11 | H1 | 125.2° | 126.1° |
| C11 | C15 | H5 | 125.0° | 125.9° |
| C12 | C13 | C14 | 108.6° | 108.8° |
| C13 | C12 | H2 | 125.1° | 126.2° |
| C12 | C13 | H3 | 124.7° | 125.5° |
| C13 | C14 | C15 | 107.2° | 107.6° |
| C14 | C13 | H3 | 124.8° | 125.7° |
| C13 | C14 | H4 | 125.8° | 126.2° |
| C15 | C14 | H4 | 125.5° | 126.2° |
| C14 | C15 | H5 | 125.1° | 126.0° |
| C17 | C16 | C20 | 107.4° | 107.5° |
| C16 | C17 | C18 | 109.1° | 108.6° |
| C17 | C16 | H6 | 125.3° | 126.3° |
| C16 | C17 | H7 | 124.6° | 126.1° |
| C16 | C20 | C19 | 108.4° | 107.8° |
| C20 | C16 | H6 | 125.3° | 126.2° |
| C16 | C20 | H9 | 125.2° | 126.0° |
| C17 | C18 | C19 | 106.9° | 108.0° |
| C17 | C18 | C24 | 124.6° | 123.2° |
| C18 | C17 | H7 | 124.5° | 125.3° |
| C19 | C18 | C24 | 128.4° | 128.8° |
| C18 | C19 | C20 | 108.2° | 108.1° |
| C18 | C19 | H8 | 124.7° | 126.1° |
| C18 | C24 | C25 | 117.0° | 123.5° |
| C18 | C24 | O28 | 119.8° | 120.0° |
| C20 | C19 | H8 | 125.1° | 125.8° |
| C19 | C20 | H9 | 125.3° | 126.1° |
| C25 | C24 | O28 | 123.0° | 116.4° |
| C24 | C25 | C26 | 110.8° | 113.5° |
| C24 | C25 | H10 | 109.1° | 108.7° |
| C24 | C25 | H11 | 109.1° | 109.2° |
| C25 | C26 | C27 | 110.3° | 114.9° |
| C26 | C25 | H10 | 109.2° | 108.7° |
| C26 | C25 | H11 | 109.1° | 109.1° |
| C25 | C26 | H12 | 109.2° | 108.4° |
| C25 | C26 | H13 | 109.3° | 107.9° |
| C26 | C27 | O29 | 119.8° | 119.6° |
| C26 | C27 | N30 | 116.4° | 117.4° |
| C27 | C26 | H12 | 109.3° | 109.4° |
| C27 | C26 | H13 | 109.3° | 108.6° |
| O29 | C27 | N30 | 123.7° | 123.0° |
| C27 | N30 | C31 | 121.5° | 125.7° |
| C27 | N30 | H14 | 119.2° | 116.6° |
| N30 | C31 | C32 | 109.8° | 109.8° |
| N30 | C31 | C34 | 111.4° | 111.5° |
| C31 | N30 | H14 | 119.2° | 117.7° |
| N30 | C31 | H15 | 109.3° | 108.4° |
| C32 | C31 | C34 | 109.4° | 113.7° |
| C31 | C32 | O38 | 122.3° | 124.2° |
| C31 | C32 | O67 | 118.8° | 112.0° |
| C32 | C31 | H15 | 108.6° | 107.8° |
| C31 | C34 | N33 | 108.3° | 112.5° |
| C31 | C34 | S49 | 112.4° | 113.6° |
| C34 | C31 | H15 | 108.3° | 105.4° |
| C31 | C34 | H18 | 110.6° | 108.9° |
| O38 | C32 | O67 | 118.8° | 123.8° |
| C32 | O67 | H27 | 109.5° | 112.0° |
| C34 | N33 | C51 | 112.6° | 114.3° |
| N33 | C34 | S49 | 106.8° | 106.2° |
| C34 | N33 | H16 | 108.7° | 112.5° |
| N33 | C34 | H18 | 111.6° | 109.2° |
| N33 | C51 | C50 | 106.7° | 105.5° |
| N33 | C51 | C63 | 112.8° | 110.8° |
| C51 | N33 | H16 | 108.7° | 114.0° |
| N33 | C51 | H19 | 108.7° | 108.1° |
| C34 | S49 | C50 | 94.7° | 93.8° |
| S49 | C34 | H18 | 107.2° | 106.2° |
| S49 | C50 | C51 | 106.5° | 101.4° |
| S49 | C50 | C52 | 111.0° | 108.4° |
| S49 | C50 | C53 | 108.2° | 105.6° |
| C51 | C50 | C52 | 111.4° | 117.4° |
| C51 | C50 | C53 | 109.1° | 112.4° |
| C50 | C51 | C63 | 112.3° | 115.1° |
| C50 | C51 | H19 | 107.7° | 109.7° |
| C52 | C50 | C53 | 110.4° | 110.5° |
| C50 | C52 | H20 | 109.5° | 109.8° |
| C50 | C52 | H21 | 109.4° | 109.6° |
| C50 | C52 | H22 | 109.5° | 109.9° |
| C50 | C53 | H23 | 109.5° | 109.8° |
| C50 | C53 | H24 | 109.5° | 109.8° |
| C50 | C53 | H25 | 109.5° | 109.8° |
| C51 | C63 | O64 | 119.7° | 124.0° |
| C51 | C63 | O65 | 119.1° | 112.2° |
| C63 | C51 | H19 | 108.4° | 107.4° |
| O64 | C63 | O65 | 121.2° | 123.8° |
| C63 | O65 | H26 | 109.5° | 111.7° |
| H10 | C25 | H11 | 109.5° | 107.4° |
| H12 | C26 | H13 | 109.5° | 107.4° |
| H20 | C52 | H21 | 109.5° | 109.0° |
| H20 | C52 | H22 | 109.5° | 109.5° |
| H21 | C52 | H22 | 109.5° | 109.1° |
| H23 | C53 | H24 | 109.4° | 109.2° |
| H23 | C53 | H25 | 109.5° | 109.2° |
| H24 | C53 | H25 | 109.5° | 108.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | RU | C12 | C13 | 116.9° | 116.8° |
| C11 | RU | C12 | C14 | 80.2° | 80.2° |
| C11 | RU | C12 | C15 | 37.9° | 37.9° |
| C11 | RU | C12 | C16 | 126.0° | 64.0° |
| C11 | RU | C12 | C17 | 85.2° | 105.4° |
| C11 | RU | C12 | C18 | 50.7° | 143.1° |
| C11 | RU | C12 | C19 | 174.4° | 16.0° |
| C11 | RU | C12 | C20 | 163.9° | 22.0° |
| C11 | RU | C13 | C14 | 80.7° | 80.9° |
| C11 | RU | C13 | C15 | 42.7° | 43.1° |
| C11 | RU | C13 | C16 | 121.4° | 39.4° |
| C11 | RU | C13 | C17 | 81.8° | 118.7° |
| C11 | RU | C13 | C18 | 101.1° | 175.1° |
| C11 | RU | C13 | C19 | 154.1° | 113.2° |
| C11 | RU | C13 | C20 | 164.5° | 44.6° |
| C11 | RU | C14 | C15 | 37.5° | 37.7° |
| C11 | RU | C14 | C16 | 128.1° | 53.3° |
| C11 | RU | C14 | C17 | 62.8° | 158.8° |
| C11 | RU | C14 | C18 | 105.8° | 155.9° |
| C11 | RU | C14 | C19 | 148.6° | 121.1° |
| C11 | RU | C14 | C20 | 168.2° | 81.3° |
| C11 | RU | C15 | C16 | 39.9° | 71.3° |
| C11 | RU | C15 | C17 | 70.0° | 82.1° |
| C11 | RU | C15 | C18 | 109.2° | 143.1° |
| C11 | RU | C15 | C19 | 150.3° | 136.0° |
| C11 | RU | C15 | C20 | 176.2° | 100.9° |
| C11 | RU | C16 | C17 | 70.1° | 153.9° |
| C11 | RU | C16 | C18 | 106.9° | 169.1° |
| C11 | RU | C16 | C19 | 149.6° | 127.1° |
| C11 | RU | C16 | C20 | 172.6° | 89.5° |
| C11 | RU | C17 | C18 | 111.7° | 152.1° |
| C11 | RU | C17 | C19 | 150.5° | 114.7° |
| C11 | RU | C17 | C20 | 167.1° | 72.1° |
| C11 | RU | C18 | C19 | 158.5° | 53.0° |
| C11 | RU | C18 | C20 | 164.7° | 15.3° |
| C11 | RU | C19 | C20 | 161.3° | 39.1° |
| RU | C11 | C12 | H1 | 103.7° | 117.7° |
| RU | C11 | C15 | H1 | 103.6° | 117.4° |
| C11 | RU | C18 | C24 | 34.0° | 177.6° |
| RU | C11 | C12 | H2 | 103.8° | 118.4° |
| C11 | RU | C13 | H3 | 158.2° | 158.3° |
| C11 | RU | C14 | H4 | 159.1° | 159.1° |
| RU | C11 | C15 | H5 | 103.8° | 117.0° |
| C11 | RU | C16 | H6 | 51.4° | 31.9° |
| C11 | RU | C17 | H7 | 8.8° | 87.5° |
| C11 | RU | C19 | H8 | 77.4° | 81.9° |
| C11 | RU | C20 | H9 | 97.3° | 27.4° |
| C12 | RU | C13 | C14 | 118.1° | 118.7° |
| C12 | RU | C13 | C15 | 80.1° | 80.8° |
| C12 | RU | C13 | C16 | 83.9° | 1.6° |
| C12 | RU | C13 | C17 | 44.4° | 81.0° |
| C12 | RU | C13 | C18 | 138.6° | 147.1° |
| C12 | RU | C13 | C19 | 168.4° | 151.0° |
| C12 | RU | C13 | C20 | 127.0° | 82.3° |
| C12 | RU | C14 | C15 | 79.3° | 79.9° |
| C12 | RU | C14 | C16 | 86.3° | 95.5° |
| C12 | RU | C14 | C17 | 104.7° | 159.0° |
| C12 | RU | C14 | C18 | 147.7° | 161.9° |
| C12 | RU | C14 | C19 | 169.5° | 163.3° |
| C12 | RU | C14 | C20 | 126.3° | 123.5° |
| C12 | RU | C15 | C16 | 77.3° | 108.7° |
| C12 | RU | C15 | C17 | 107.4° | 119.6° |
| C12 | RU | C15 | C18 | 146.6° | 179.5° |
| C12 | RU | C15 | C19 | 172.3° | 173.4° |
| C12 | RU | C15 | C20 | 138.8° | 138.3° |
| C12 | RU | C16 | C17 | 109.6° | 120.6° |
| C12 | RU | C16 | C18 | 146.4° | 157.6° |
| C12 | RU | C16 | C19 | 170.9° | 160.4° |
| C12 | RU | C16 | C20 | 133.1° | 122.9° |
| C12 | RU | C17 | C18 | 151.6° | 159.7° |
| C12 | RU | C17 | C19 | 169.6° | 163.0° |
| C12 | RU | C17 | C20 | 127.3° | 120.4° |
| C12 | RU | C18 | C19 | 169.2° | 169.7° |
| C12 | RU | C18 | C20 | 132.4° | 132.1° |
| C12 | RU | C19 | C20 | 25.9° | 51.0° |
| RU | C12 | C13 | H2 | 104.0° | 118.8° |
| C12 | RU | C18 | C24 | 66.3° | 65.7° |
| RU | C12 | C13 | H3 | 102.8° | 117.2° |
| C12 | RU | C14 | H4 | 159.0° | 158.7° |
| C12 | RU | C15 | H5 | 158.7° | 158.5° |
| C12 | RU | C16 | H6 | 11.9° | 1.4° |
| C12 | RU | C17 | H7 | 31.1° | 39.2° |
| C12 | RU | C19 | H8 | 95.3° | 70.0° |
| C12 | RU | C20 | H9 | 52.7° | 40.6° |
| C13 | RU | C14 | C15 | 116.3° | 116.8° |
| C13 | RU | C14 | C16 | 49.4° | 132.4° |
| C13 | RU | C14 | C17 | 141.6° | 122.1° |
| C13 | RU | C14 | C18 | 175.4° | 125.1° |
| C13 | RU | C14 | C19 | 132.6° | 159.8° |
| C13 | RU | C14 | C20 | 89.4° | 160.3° |
| C13 | RU | C15 | C16 | 119.5° | 151.1° |
| C13 | RU | C15 | C17 | 149.7° | 162.0° |
| C13 | RU | C15 | C18 | 171.2° | 137.0° |
| C13 | RU | C15 | C19 | 130.0° | 144.1° |
| C13 | RU | C15 | C20 | 96.6° | 179.2° |
| C13 | RU | C16 | C17 | 150.4° | 119.5° |
| C13 | RU | C16 | C18 | 172.8° | 156.5° |
| C13 | RU | C16 | C19 | 130.1° | 161.5° |
| C13 | RU | C16 | C20 | 92.3° | 124.0° |
| C13 | RU | C17 | C18 | 179.2° | 109.6° |
| C13 | RU | C17 | C19 | 140.4° | 146.9° |
| C13 | RU | C17 | C20 | 98.1° | 170.4° |
| C13 | RU | C18 | C19 | 62.6° | 116.4° |
| C13 | RU | C18 | C20 | 99.4° | 154.0° |
| C13 | RU | C19 | C20 | 74.5° | 128.6° |
| RU | C13 | C14 | H3 | 103.2° | 117.4° |
| C13 | RU | C18 | C24 | 61.8° | 8.3° |
| C13 | RU | C11 | H1 | 159.6° | 159.3° |
| RU | C13 | C14 | H4 | 103.9° | 119.1° |
| C13 | RU | C15 | H5 | 159.1° | 159.1° |
| C13 | RU | C16 | H6 | 28.9° | 2.5° |
| C13 | RU | C17 | H7 | 60.3° | 10.8° |
| C13 | RU | C19 | H8 | 46.7° | 7.6° |
| C13 | RU | C20 | H9 | 10.4° | 11.2° |
| C14 | RU | C15 | C16 | 157.2° | 171.2° |
| C14 | RU | C15 | C17 | 172.7° | 160.3° |
| C14 | RU | C15 | C18 | 133.6° | 99.4° |
| C14 | RU | C15 | C19 | 92.4° | 106.5° |
| C14 | RU | C15 | C20 | 58.9° | 141.6° |
| C14 | RU | C16 | C17 | 175.9° | 160.2° |
| C14 | RU | C16 | C18 | 139.1° | 123.2° |
| C14 | RU | C16 | C19 | 96.4° | 81.2° |
| C14 | RU | C16 | C20 | 58.6° | 43.6° |
| C14 | RU | C17 | C18 | 54.1° | 3.7° |
| C14 | RU | C17 | C19 | 92.9° | 41.0° |
| C14 | RU | C17 | C20 | 135.2° | 83.7° |
| C14 | RU | C18 | C19 | 79.6° | 63.8° |
| C14 | RU | C18 | C20 | 116.4° | 101.4° |
| C14 | RU | C19 | C20 | 115.1° | 108.7° |
| RU | C14 | C15 | H4 | 103.4° | 118.6° |
| C14 | RU | C18 | C24 | 44.9° | 60.8° |
| C14 | RU | C11 | H1 | 158.6° | 158.6° |
| C14 | RU | C12 | H2 | 158.2° | 158.4° |
| RU | C14 | C15 | H5 | 104.0° | 117.4° |
| C14 | RU | C16 | H6 | 62.6° | 77.8° |
| C14 | RU | C17 | H7 | 66.4° | 116.7° |
| C14 | RU | C19 | H8 | 6.1° | 12.3° |
| C14 | RU | C20 | H9 | 32.5° | 34.7° |
| C15 | RU | C16 | C17 | 39.4° | 170.3° |
| C15 | RU | C16 | C18 | 76.2° | 133.2° |
| C15 | RU | C16 | C19 | 118.9° | 91.3° |
| C15 | RU | C16 | C20 | 156.7° | 53.7° |
| C15 | RU | C17 | C18 | 74.1° | 101.2° |
| C15 | RU | C17 | C19 | 112.9° | 63.9° |
| C15 | RU | C17 | C20 | 155.2° | 21.3° |
| C15 | RU | C18 | C19 | 117.2° | 11.7° |
| C15 | RU | C18 | C20 | 154.0° | 49.3° |
| C15 | RU | C19 | C20 | 158.3° | 70.7° |
| C15 | RU | C18 | C24 | 7.3° | 113.0° |
| C15 | RU | C12 | H2 | 159.5° | 159.3° |
| C15 | RU | C13 | H3 | 159.1° | 158.6° |
| C15 | RU | C16 | H6 | 82.1° | 67.7° |
| C15 | RU | C17 | H7 | 46.4° | 138.3° |
| C15 | RU | C19 | H8 | 37.1° | 50.3° |
| C15 | RU | C20 | H9 | 72.9° | 9.9° |
| C16 | RU | C17 | C18 | 118.5° | 118.2° |
| C16 | RU | C17 | C19 | 79.7° | 80.9° |
| C16 | RU | C17 | C20 | 37.4° | 38.3° |
| C16 | RU | C18 | C19 | 78.7° | 80.5° |
| C16 | RU | C18 | C20 | 41.9° | 42.8° |
| C16 | RU | C19 | C20 | 37.7° | 37.8° |
| RU | C16 | C17 | H6 | 103.1° | 118.2° |
| RU | C16 | C20 | H6 | 102.4° | 117.6° |
| C16 | RU | C18 | C24 | 156.8° | 154.9° |
| C16 | RU | C11 | H1 | 46.1° | 3.9° |
| C16 | RU | C12 | H2 | 4.4° | 57.4° |
| C16 | RU | C13 | H3 | 36.9° | 118.9° |
| C16 | RU | C14 | H4 | 72.8° | 105.8° |
| C16 | RU | C15 | H5 | 81.4° | 49.8° |
| RU | C16 | C17 | H7 | 103.6° | 117.5° |
| C16 | RU | C19 | H8 | 158.9° | 158.8° |
| RU | C16 | C20 | H9 | 104.8° | 116.9° |
| C17 | RU | C18 | C19 | 115.1° | 117.2° |
| C17 | RU | C18 | C20 | 78.3° | 79.6° |
| C17 | RU | C19 | C20 | 79.6° | 79.8° |
| RU | C17 | C18 | H7 | 102.5° | 117.6° |
| C17 | RU | C18 | C24 | 120.4° | 118.1° |
| C17 | RU | C11 | H1 | 9.0° | 15.8° |
| C17 | RU | C12 | H2 | 36.4° | 16.0° |
| C17 | RU | C13 | H3 | 76.4° | 39.5° |
| C17 | RU | C14 | H4 | 96.3° | 0.3° |
| C17 | RU | C15 | H5 | 51.2° | 38.9° |
| C17 | RU | C19 | H8 | 159.2° | 159.2° |
| C17 | RU | C20 | H9 | 158.9° | 158.8° |
| C18 | RU | C19 | C20 | 118.0° | 117.3° |
| RU | C18 | C19 | C24 | 112.8° | 118.4° |
| RU | C18 | C24 | C25 | 90.9° | 83.6° |
| RU | C18 | C24 | O28 | 82.8° | 97.2° |
| C18 | RU | C11 | H1 | 31.2° | 28.2° |
| C18 | RU | C12 | H2 | 71.0° | 21.8° |
| C18 | RU | C13 | H3 | 100.6° | 26.6° |
| C18 | RU | C14 | H4 | 53.3° | 3.2° |
| C18 | RU | C15 | H5 | 12.1° | 22.1° |
| C18 | RU | C16 | H6 | 158.3° | 159.1° |
| RU | C18 | C19 | H8 | 103.1° | 117.9° |
| C18 | RU | C20 | H9 | 158.9° | 158.8° |
| RU | C19 | C20 | H8 | 103.2° | 117.5° |
| C19 | RU | C11 | H1 | 60.0° | 64.4° |
| C19 | RU | C12 | H2 | 64.0° | 137.4° |
| C19 | RU | C13 | H3 | 47.6° | 88.5° |
| C19 | RU | C14 | H4 | 10.5° | 38.0° |
| C19 | RU | C15 | H5 | 29.0° | 14.9° |
| C19 | RU | C16 | H6 | 159.0° | 159.0° |
| C19 | RU | C17 | H7 | 159.3° | 157.8° |
| RU | C19 | C20 | H9 | 104.1° | 117.0° |
| C20 | RU | C18 | C24 | 161.3° | 162.3° |
| C20 | RU | C11 | H1 | 65.2° | 41.7° |
| C20 | RU | C12 | H2 | 42.3° | 99.4° |
| C20 | RU | C13 | H3 | 6.2° | 157.2° |
| C20 | RU | C14 | H4 | 32.7° | 77.8° |
| C20 | RU | C15 | H5 | 62.5° | 20.2° |
| C20 | RU | C17 | H7 | 158.4° | 159.6° |
| C12 | C11 | C15 | H1 | 166.2° | 179.9° |
| C11 | C12 | C13 | H2 | 167.2° | 178.9° |
| C11 | C12 | C13 | C14 | 1.2° | 1.1° |
| C12 | C11 | C15 | C14 | 0.3° | 0.2° |
| C11 | C12 | C13 | H3 | 166.0° | 179.5° |
| C12 | C11 | C15 | H5 | 166.5° | 179.5° |
| C15 | C11 | C12 | C13 | 0.9° | 0.5° |
| C11 | C15 | C14 | C13 | 0.4° | 0.9° |
| C11 | C15 | C14 | H5 | 166.8° | 179.3° |
| C15 | C11 | C12 | H2 | 166.2° | 179.4° |
| C11 | C15 | C14 | H4 | 166.2° | 179.5° |
| C12 | C13 | C14 | H3 | 164.8° | 178.4° |
| C12 | C13 | C14 | C15 | 1.0° | 1.2° |
| C13 | C12 | C11 | H1 | 167.1° | 179.6° |
| C12 | C13 | C14 | H4 | 165.6° | 179.9° |
| C13 | C14 | C15 | H4 | 166.6° | 178.6° |
| C14 | C13 | C12 | H2 | 166.0° | 180.0° |
| C13 | C14 | C15 | H5 | 167.2° | 179.9° |
| C14 | C15 | C11 | H1 | 166.6° | 179.7° |
| C15 | C14 | C13 | H3 | 165.8° | 179.7° |
| C17 | C16 | C20 | H6 | 164.2° | 179.3° |
| C16 | C17 | C18 | H7 | 164.9° | 179.2° |
| C16 | C17 | C18 | C19 | 1.7° | 0.6° |
| C16 | C17 | C18 | C24 | 175.7° | 179.8° |
| C17 | C16 | C20 | C19 | 2.0° | 0.5° |
| C17 | C16 | C20 | H9 | 166.6° | 179.9° |
| C20 | C16 | C17 | C18 | 0.1° | 0.7° |
| C16 | C20 | C19 | C18 | 3.1° | 0.1° |
| C16 | C20 | C19 | H9 | 168.6° | 179.4° |
| C20 | C16 | C17 | H7 | 164.7° | 179.9° |
| C16 | C20 | C19 | H8 | 167.6° | 179.9° |
| C17 | C18 | C19 | C24 | 177.3° | 179.2° |
| C17 | C18 | C19 | C20 | 2.9° | 0.3° |
| C17 | C18 | C24 | C25 | 178.8° | 172.4° |
| C17 | C18 | C24 | O28 | 5.1° | 8.4° |
| C18 | C17 | C16 | H6 | 164.4° | 180.0° |
| C17 | C18 | C19 | H8 | 167.6° | 179.7° |
| C18 | C19 | C20 | H8 | 164.6° | 180.0° |
| C19 | C18 | C24 | C25 | 1.9° | 8.5° |
| C19 | C18 | C24 | O28 | 171.8° | 170.6° |
| C19 | C18 | C17 | H7 | 166.6° | 179.9° |
| C18 | C19 | C20 | H9 | 165.5° | 179.6° |
| C24 | C18 | C19 | C20 | 174.4° | 179.4° |
| C18 | C24 | C25 | O28 | 173.5° | 179.2° |
| C18 | C24 | C25 | C26 | 168.7° | 100.4° |
| C18 | C24 | C25 | H10 | 48.4° | 138.5° |
| C18 | C24 | C25 | H11 | 71.1° | 21.6° |
| C24 | C18 | C17 | H7 | 10.8° | 0.9° |
| C24 | C18 | C19 | H8 | 9.7° | 0.5° |
| C19 | C20 | C16 | H6 | 166.2° | 179.9° |
| C24 | C25 | C26 | H10 | 120.2° | 121.2° |
| C24 | C25 | C26 | H11 | 120.2° | 122.0° |
| C24 | C25 | C26 | C27 | 72.9° | 149.1° |
| C24 | C25 | H10 | H11 | 119.4° | 118.1° |
| C24 | C25 | C26 | H12 | 167.0° | 26.4° |
| C24 | C25 | C26 | H13 | 47.2° | 89.6° |
| O28 | C24 | C25 | C26 | 4.8° | 80.4° |
| O28 | C24 | C25 | H10 | 125.1° | 40.7° |
| O28 | C24 | C25 | H11 | 115.4° | 157.6° |
| C25 | C26 | C27 | H12 | 120.1° | 122.2° |
| C25 | C26 | C27 | H13 | 120.1° | 120.9° |
| C25 | C26 | C27 | O29 | 52.0° | 73.7° |
| C25 | C26 | C27 | N30 | 130.6° | 105.8° |
| C26 | C25 | H10 | H11 | 119.4° | 117.9° |
| C25 | C26 | H12 | H13 | 119.6° | 116.3° |
| C26 | C27 | O29 | N30 | 177.2° | 179.5° |
| C26 | C27 | N30 | C31 | 177.9° | 175.0° |
| C27 | C26 | C25 | H10 | 47.3° | 89.7° |
| C27 | C26 | C25 | H11 | 166.9° | 27.1° |
| C27 | C26 | H12 | H13 | 119.6° | 117.7° |
| C26 | C27 | N30 | H14 | 2.1° | 7.1° |
| O29 | C27 | N30 | C31 | 0.6° | 5.5° |
| O29 | C27 | C26 | H12 | 68.1° | 164.1° |
| O29 | C27 | C26 | H13 | 172.1° | 47.1° |
| O29 | C27 | N30 | H14 | 179.4° | 172.3° |
| C27 | N30 | C31 | H14 | 180.0° | 177.8° |
| C27 | N30 | C31 | C32 | 71.1° | 106.2° |
| C27 | N30 | C31 | C34 | 167.5° | 126.9° |
| N30 | C27 | C26 | H12 | 109.3° | 16.4° |
| N30 | C27 | C26 | H13 | 10.5° | 133.4° |
| C27 | N30 | C31 | H15 | 47.9° | 11.3° |
| N30 | C31 | C32 | C34 | 122.5° | 125.6° |
| N30 | C31 | C32 | H15 | 119.4° | 117.9° |
| N30 | C31 | C34 | H15 | 120.2° | 117.5° |
| N30 | C31 | C32 | O38 | 45.7° | 33.2° |
| N30 | C31 | C32 | O67 | 136.4° | 147.1° |
| N30 | C31 | C34 | N33 | 69.6° | 167.4° |
| N30 | C31 | C34 | S49 | 172.6° | 72.0° |
| N30 | C31 | C34 | H18 | 52.9° | 46.2° |
| C32 | C31 | C34 | H15 | 118.2° | 117.8° |
| C31 | C32 | O38 | O67 | 177.9° | 179.7° |
| C32 | C31 | C34 | N33 | 168.7° | 67.9° |
| C32 | C31 | C34 | S49 | 50.9° | 52.7° |
| C32 | C31 | N30 | H14 | 108.9° | 71.6° |
| C32 | C31 | C34 | H18 | 68.8° | 170.9° |
| C31 | C32 | O67 | H27 | 177.9° | 180.0° |
| C34 | C31 | C32 | O38 | 76.8° | 92.5° |
| C34 | C31 | C32 | O67 | 101.1° | 87.3° |
| C31 | C34 | N33 | S49 | 121.3° | 124.8° |
| C31 | C34 | N33 | H18 | 121.9° | 121.0° |
| C31 | C34 | N33 | C51 | 94.2° | 109.2° |
| C31 | C34 | S49 | H18 | 121.7° | 119.7° |
| C31 | C34 | S49 | C50 | 113.0° | 135.0° |
| C34 | C31 | N30 | H14 | 12.5° | 55.3° |
| C31 | C34 | N33 | H16 | 26.3° | 118.8° |
| O38 | C32 | C31 | H15 | 165.2° | 151.0° |
| O38 | C32 | O67 | H27 | 0.0° | 0.3° |
| O67 | C32 | C31 | H15 | 17.0° | 29.2° |
| C34 | N33 | C51 | H16 | 120.5° | 131.2° |
| N33 | C34 | S49 | H18 | 119.7° | 116.2° |
| N33 | C34 | S49 | C50 | 5.6° | 10.9° |
| C34 | N33 | C51 | C50 | 38.9° | 40.2° |
| C34 | N33 | C51 | C63 | 162.7° | 165.4° |
| N33 | C34 | C31 | H15 | 50.5° | 49.9° |
| C34 | N33 | C51 | H19 | 77.0° | 77.1° |
| C51 | N33 | C34 | S49 | 27.1° | 15.6° |
| N33 | C51 | C50 | S49 | 32.1° | 43.7° |
| N33 | C51 | C50 | C63 | 124.2° | 122.5° |
| N33 | C51 | C50 | H19 | 116.6° | 116.2° |
| N33 | C51 | C50 | C52 | 153.3° | 74.1° |
| N33 | C51 | C50 | C53 | 84.5° | 156.1° |
| N33 | C51 | C63 | H19 | 120.5° | 117.8° |
| N33 | C51 | C63 | O64 | 17.7° | 28.9° |
| N33 | C51 | C63 | O65 | 161.4° | 150.9° |
| C51 | N33 | C34 | H18 | 143.9° | 129.8° |
| C34 | S49 | C50 | C51 | 15.1° | 31.2° |
| C34 | S49 | C50 | C52 | 136.6° | 92.9° |
| C34 | S49 | C50 | C53 | 102.1° | 148.6° |
| S49 | C34 | C31 | H15 | 67.2° | 170.6° |
| S49 | C34 | N33 | H16 | 147.6° | 116.4° |
| S49 | C50 | C51 | C52 | 121.3° | 117.9° |
| S49 | C50 | C51 | C53 | 116.6° | 112.4° |
| S49 | C50 | C52 | C53 | 120.1° | 115.4° |
| S49 | C50 | C51 | C63 | 156.2° | 166.3° |
| C50 | S49 | C34 | H18 | 125.3° | 105.3° |
| S49 | C50 | C51 | H19 | 84.5° | 72.4° |
| S49 | C50 | C52 | H20 | 180.0° | 55.6° |
| S49 | C50 | C52 | H21 | 60.0° | 64.1° |
| S49 | C50 | C52 | H22 | 60.0° | 176.0° |
| S49 | C50 | C53 | H23 | 180.0° | 178.5° |
| S49 | C50 | C53 | H24 | 60.0° | 58.4° |
| S49 | C50 | C53 | H25 | 60.0° | 61.3° |
| C51 | C50 | C52 | C53 | 121.4° | 130.6° |
| C50 | C51 | C63 | H19 | 118.8° | 122.5° |
| C50 | C51 | C63 | O64 | 102.9° | 90.8° |
| C50 | C51 | C63 | O65 | 77.9° | 89.4° |
| C50 | C51 | N33 | H16 | 159.4° | 91.1° |
| C51 | C50 | C52 | H20 | 61.5° | 169.6° |
| C51 | C50 | C52 | H21 | 178.6° | 49.9° |
| C51 | C50 | C52 | H22 | 58.6° | 70.0° |
| C51 | C50 | C53 | H23 | 64.5° | 68.8° |
| C51 | C50 | C53 | H24 | 55.5° | 51.3° |
| C51 | C50 | C53 | H25 | 175.5° | 171.0° |
| C52 | C50 | C51 | C63 | 82.5° | 48.4° |
| C52 | C50 | C51 | H19 | 36.8° | 169.7° |
| C50 | C52 | H20 | H21 | 120.0° | 120.1° |
| C50 | C52 | H20 | H22 | 120.0° | 120.7° |
| C50 | C52 | H21 | H22 | 120.0° | 120.3° |
| C52 | C50 | C53 | H23 | 58.3° | 64.4° |
| C52 | C50 | C53 | H24 | 178.3° | 175.5° |
| C52 | C50 | C53 | H25 | 61.7° | 55.8° |
| C53 | C50 | C51 | C63 | 39.6° | 81.4° |
| C53 | C50 | C51 | H19 | 158.9° | 39.9° |
| C53 | C50 | C52 | H20 | 59.9° | 59.8° |
| C53 | C50 | C52 | H21 | 60.1° | 179.5° |
| C53 | C50 | C52 | H22 | 179.9° | 60.6° |
| C50 | C53 | H23 | H24 | 120.0° | 120.5° |
| C50 | C53 | H23 | H25 | 120.0° | 120.5° |
| C50 | C53 | H24 | H25 | 120.0° | 120.3° |
| C51 | C63 | O64 | O65 | 179.1° | 179.7° |
| C63 | C51 | N33 | H16 | 76.8° | 34.2° |
| C51 | C63 | O65 | H26 | 179.1° | 179.7° |
| O64 | C63 | C51 | H19 | 138.2° | 146.7° |
| O64 | C63 | O65 | H26 | 0.0° | 0.1° |
| O65 | C63 | C51 | H19 | 40.9° | 33.1° |
| H10 | C25 | C26 | H12 | 72.8° | 147.6° |
| H10 | C25 | C26 | H13 | 167.4° | 31.5° |
| H11 | C25 | C26 | H12 | 46.8° | 95.6° |
| H11 | C25 | C26 | H13 | 73.0° | 148.3° |
| H14 | N30 | C31 | H15 | 132.1° | 170.9° |
| H15 | C31 | C34 | H18 | 173.1° | 71.3° |
| H16 | N33 | C34 | H18 | 95.6° | 2.2° |
| H16 | N33 | C51 | H19 | 43.5° | 151.6° |
| H20 | C52 | H21 | H22 | 120.0° | 119.5° |
| H23 | C53 | H24 | H25 | 120.0° | 119.2° |
| H1 | C11 | C12 | H2 | 0.1° | 0.7° |
| H1 | C11 | C15 | H5 | 0.2° | 0.4° |
| H2 | C12 | C13 | H3 | 1.2° | 1.6° |
| H3 | C13 | C14 | H4 | 0.8° | 1.7° |
| H4 | C14 | C15 | H5 | 0.6° | 1.2° |
| H6 | C16 | C17 | H7 | 0.5° | 0.7° |
| H6 | C16 | C20 | H9 | 2.4° | 0.7° |
| H8 | C19 | C20 | H9 | 0.9° | 0.5° |






