GXR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C8 | sing | 1.53Å | 1.53Å | |
| C6 | C8 | sing | 1.55Å | 1.54Å | |
| C6 | C2 | sing | 1.53Å | 1.52Å | |
| C8 | C5 | sing | 1.55Å | 1.58Å | |
| C12 | C1 | sing | 1.53Å | 1.54Å | |
| O3 | C15 | doub | 1.21Å | 1.22Å | |
| C11 | C13 | sing | 1.53Å | 1.54Å | |
| C11 | C3 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.51Å | 1.49Å | |
| C15 | C5 | sing | 1.51Å | 1.57Å | |
| C15 | C20 | sing | 1.51Å | 1.52Å | |
| C2 | C3 | sing | 1.52Å | 1.52Å | |
| C2 | C1 | sing | 1.55Å | 1.50Å | |
| C5 | C1 | sing | 1.53Å | 1.59Å | |
| C5 | O1 | sing | 1.43Å | 1.39Å | |
| C3 | C4 | sing | 1.54Å | 1.51Å | |
| C17 | C10 | sing | 1.53Å | 1.55Å | |
| C1 | C7 | sing | 1.52Å | 1.51Å | |
| C20 | O4 | sing | 1.43Å | 1.39Å | |
| C14 | C10 | sing | 1.50Å | 1.50Å | |
| C14 | C19 | doub | 1.33Å | 1.34Å | |
| C10 | C4 | sing | 1.53Å | 1.53Å | |
| C10 | C18 | sing | 1.49Å | 1.51Å | |
| C4 | C9 | sing | 1.53Å | 1.58Å | |
| C4 | CL1 | sing | 1.80Å | 1.87Å | |
| O2 | C9 | sing | 1.43Å | 1.40Å | |
| C19 | C22 | sing | 1.47Å | 1.47Å | |
| C7 | C9 | sing | 1.54Å | 1.55Å | |
| O5 | C22 | doub | 1.22Å | 1.22Å | |
| C22 | C21 | sing | 1.50Å | 1.47Å | |
| C18 | C21 | doub | 1.32Å | 1.33Å | |
| C6 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C9 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| O2 | H5 | sing | 0.97Å | 0.95Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.08Å | 1.08Å | |
| C19 | H24 | sing | 1.08Å | 1.08Å | |
| C2 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.08Å | 1.08Å | |
| C8 | H31 | sing | 1.09Å | 1.10Å | |
| O1 | H32 | sing | 0.97Å | 0.95Å | |
| O4 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C8 | C6 | 111.3° | 110.1° |
| C16 | C8 | C5 | 116.4° | 110.0° |
| C8 | C16 | H16 | 109.5° | 109.5° |
| C8 | C16 | H17 | 109.5° | 109.5° |
| C8 | C16 | H18 | 109.5° | 109.5° |
| C16 | C8 | H31 | 108.0° | 110.1° |
| C8 | C6 | C2 | 106.0° | 103.0° |
| C6 | C8 | C5 | 105.5° | 106.4° |
| C8 | C6 | H1 | 110.3° | 110.7° |
| C8 | C6 | H2 | 110.3° | 110.7° |
| C6 | C8 | H31 | 107.9° | 110.1° |
| C6 | C2 | C3 | 119.4° | 115.7° |
| C6 | C2 | C1 | 103.6° | 101.7° |
| C2 | C6 | H1 | 110.3° | 110.7° |
| C2 | C6 | H2 | 110.3° | 110.7° |
| C6 | C2 | H26 | 106.2° | 110.3° |
| C8 | C5 | C15 | 115.7° | 110.3° |
| C8 | C5 | C1 | 102.1° | 105.3° |
| C8 | C5 | O1 | 104.6° | 110.3° |
| C5 | C8 | H31 | 107.4° | 110.1° |
| C12 | C1 | C2 | 106.9° | 109.9° |
| C12 | C1 | C5 | 113.1° | 109.8° |
| C12 | C1 | C7 | 109.6° | 109.8° |
| C1 | C12 | H10 | 109.5° | 109.5° |
| C1 | C12 | H11 | 109.5° | 109.4° |
| C1 | C12 | H12 | 109.5° | 109.4° |
| O3 | C15 | C5 | 118.8° | 120.1° |
| O3 | C15 | C20 | 117.1° | 120.0° |
| C13 | C11 | C3 | 114.6° | 109.6° |
| C11 | C13 | C14 | 110.7° | 107.6° |
| C13 | C11 | H8 | 108.2° | 109.5° |
| C13 | C11 | H9 | 108.2° | 109.4° |
| C11 | C13 | H13 | 109.2° | 109.7° |
| C11 | C13 | H14 | 109.2° | 109.8° |
| C11 | C3 | C2 | 113.9° | 110.6° |
| C11 | C3 | C4 | 108.8° | 109.6° |
| C11 | C3 | H4 | 106.6° | 109.7° |
| C3 | C11 | H8 | 108.2° | 110.5° |
| C3 | C11 | H9 | 108.2° | 108.4° |
| C13 | C14 | C10 | 115.9° | 117.5° |
| C13 | C14 | C19 | 119.2° | 118.9° |
| C14 | C13 | H13 | 109.2° | 108.9° |
| C14 | C13 | H14 | 109.2° | 111.1° |
| C5 | C15 | C20 | 124.1° | 119.9° |
| C15 | C5 | C1 | 120.5° | 110.3° |
| C15 | C5 | O1 | 101.8° | 110.3° |
| C15 | C20 | O4 | 112.5° | 109.4° |
| C15 | C20 | H27 | 108.7° | 109.4° |
| C15 | C20 | H28 | 108.7° | 109.4° |
| C3 | C2 | C1 | 114.1° | 107.1° |
| C2 | C3 | C4 | 113.6° | 107.6° |
| C2 | C3 | H4 | 106.6° | 109.7° |
| C3 | C2 | H26 | 106.2° | 110.4° |
| C2 | C1 | C5 | 101.5° | 103.4° |
| C2 | C1 | C7 | 109.7° | 107.2° |
| C1 | C2 | H26 | 106.5° | 111.2° |
| C1 | C5 | O1 | 111.4° | 110.3° |
| C5 | C1 | C7 | 115.4° | 116.5° |
| C5 | O1 | H32 | 109.5° | 114.0° |
| C3 | C4 | C10 | 110.5° | 108.9° |
| C3 | C4 | C9 | 114.4° | 111.7° |
| C3 | C4 | CL1 | 102.6° | 108.5° |
| C4 | C3 | H4 | 106.8° | 109.7° |
| C17 | C10 | C14 | 106.0° | 107.0° |
| C17 | C10 | C4 | 113.7° | 107.7° |
| C17 | C10 | C18 | 106.0° | 107.7° |
| C10 | C17 | H19 | 109.5° | 109.5° |
| C10 | C17 | H20 | 109.5° | 109.5° |
| C10 | C17 | H21 | 109.5° | 109.5° |
| C1 | C7 | C9 | 113.8° | 107.2° |
| C1 | C7 | H6 | 108.4° | 109.9° |
| C1 | C7 | H7 | 108.4° | 109.9° |
| O4 | C20 | H27 | 108.7° | 109.5° |
| O4 | C20 | H28 | 108.7° | 109.5° |
| C20 | O4 | H33 | 109.5° | 114.0° |
| C10 | C14 | C19 | 119.6° | 123.6° |
| C14 | C10 | C4 | 109.2° | 109.5° |
| C14 | C10 | C18 | 109.5° | 113.9° |
| C14 | C19 | C22 | 120.9° | 120.5° |
| C14 | C19 | H24 | 119.5° | 119.7° |
| C4 | C10 | C18 | 112.2° | 110.8° |
| C10 | C4 | C9 | 116.2° | 109.3° |
| C10 | C4 | CL1 | 105.8° | 109.2° |
| C10 | C18 | C21 | 120.4° | 124.0° |
| C10 | C18 | H22 | 119.8° | 118.0° |
| C9 | C4 | CL1 | 105.8° | 109.2° |
| C4 | C9 | O2 | 111.4° | 109.0° |
| C4 | C9 | C7 | 115.6° | 111.8° |
| C4 | C9 | H3 | 105.4° | 109.0° |
| O2 | C9 | C7 | 110.7° | 108.3° |
| O2 | C9 | H3 | 107.4° | 109.8° |
| C9 | O2 | H5 | 109.5° | 114.0° |
| C19 | C22 | O5 | 123.5° | 120.8° |
| C19 | C22 | C21 | 113.4° | 118.0° |
| C22 | C19 | H24 | 119.5° | 119.7° |
| C7 | C9 | H3 | 105.7° | 109.0° |
| C9 | C7 | H6 | 108.4° | 109.9° |
| C9 | C7 | H7 | 108.4° | 109.9° |
| O5 | C22 | C21 | 123.0° | 121.2° |
| C22 | C21 | C18 | 119.4° | 119.9° |
| C22 | C21 | H29 | 120.3° | 120.0° |
| C21 | C18 | H22 | 119.8° | 118.0° |
| C18 | C21 | H29 | 120.3° | 120.1° |
| H1 | C6 | H2 | 109.5° | 110.8° |
| H6 | C7 | H7 | 109.5° | 110.0° |
| H8 | C11 | H9 | 109.5° | 109.5° |
| H10 | C12 | H11 | 109.5° | 109.5° |
| H10 | C12 | H12 | 109.5° | 109.5° |
| H11 | C12 | H12 | 109.5° | 109.5° |
| H13 | C13 | H14 | 109.4° | 109.8° |
| H16 | C16 | H17 | 109.4° | 109.5° |
| H16 | C16 | H18 | 109.5° | 109.4° |
| H17 | C16 | H18 | 109.5° | 109.5° |
| H19 | C17 | H20 | 109.5° | 109.4° |
| H19 | C17 | H21 | 109.5° | 109.4° |
| H20 | C17 | H21 | 109.5° | 109.4° |
| H27 | C20 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C8 | C6 | C5 | 127.2° | 119.2° |
| C16 | C8 | C6 | H31 | 118.3° | 121.5° |
| C16 | C8 | C6 | C2 | 135.4° | 143.1° |
| C16 | C8 | C5 | H31 | 121.1° | 121.5° |
| C16 | C8 | C5 | C15 | 28.0° | 3.2° |
| C16 | C8 | C5 | C1 | 104.8° | 115.8° |
| C16 | C8 | C5 | O1 | 139.0° | 125.3° |
| C16 | C8 | C6 | H1 | 105.2° | 24.7° |
| C16 | C8 | C6 | H2 | 16.0° | 98.5° |
| C8 | C16 | H16 | H17 | 120.0° | 120.1° |
| C8 | C16 | H16 | H18 | 120.0° | 120.0° |
| C8 | C16 | H17 | H18 | 120.0° | 120.0° |
| C8 | C6 | C2 | H1 | 119.5° | 118.4° |
| C8 | C6 | C2 | H2 | 119.4° | 118.3° |
| C6 | C8 | C5 | H31 | 114.9° | 119.3° |
| C6 | C8 | C5 | C15 | 151.9° | 122.4° |
| C8 | C6 | C2 | C3 | 162.7° | 157.2° |
| C8 | C6 | C2 | C1 | 34.5° | 41.5° |
| C6 | C8 | C5 | C1 | 19.2° | 3.4° |
| C6 | C8 | C5 | O1 | 97.0° | 115.5° |
| C8 | C6 | H1 | H2 | 121.6° | 123.2° |
| C6 | C8 | C16 | H16 | 180.0° | 61.5° |
| C6 | C8 | C16 | H17 | 60.0° | 178.5° |
| C6 | C8 | C16 | H18 | 60.0° | 58.5° |
| C8 | C6 | C2 | H26 | 77.5° | 76.5° |
| C2 | C6 | C8 | C5 | 8.2° | 23.9° |
| C6 | C2 | C1 | C12 | 72.5° | 72.9° |
| C6 | C2 | C3 | C11 | 57.9° | 63.6° |
| C6 | C2 | C3 | C1 | 123.2° | 112.6° |
| C6 | C2 | C3 | H26 | 119.8° | 126.2° |
| C6 | C2 | C1 | H26 | 111.8° | 117.5° |
| C6 | C2 | C1 | C5 | 46.2° | 44.3° |
| C6 | C2 | C3 | C4 | 176.7° | 176.8° |
| C6 | C2 | C1 | C7 | 168.7° | 167.9° |
| C2 | C6 | H1 | H2 | 121.6° | 123.3° |
| C6 | C2 | C3 | H4 | 59.4° | 57.5° |
| C2 | C6 | C8 | H31 | 106.3° | 95.4° |
| C8 | C5 | C1 | C12 | 74.0° | 88.1° |
| C8 | C5 | C15 | O3 | 45.6° | 59.5° |
| C8 | C5 | C15 | C1 | 123.6° | 115.9° |
| C8 | C5 | C15 | O1 | 112.7° | 122.1° |
| C8 | C5 | C15 | C20 | 136.1° | 120.5° |
| C8 | C5 | C1 | C2 | 40.1° | 29.2° |
| C8 | C5 | C1 | O1 | 111.2° | 118.9° |
| C8 | C5 | C1 | C7 | 158.6° | 146.4° |
| C5 | C8 | C6 | H1 | 127.7° | 94.5° |
| C5 | C8 | C6 | H2 | 111.2° | 142.3° |
| C5 | C8 | C16 | H16 | 59.1° | 178.4° |
| C5 | C8 | C16 | H17 | 60.9° | 61.6° |
| C5 | C8 | C16 | H18 | 179.1° | 58.5° |
| C8 | C5 | O1 | H32 | 96.6° | 64.1° |
| C12 | C1 | C5 | C15 | 55.9° | 30.9° |
| C12 | C1 | C2 | C3 | 58.9° | 49.0° |
| C12 | C1 | C2 | C5 | 118.7° | 117.2° |
| C12 | C1 | C2 | C7 | 118.8° | 119.3° |
| C12 | C1 | C5 | C7 | 127.4° | 125.5° |
| C12 | C1 | C5 | O1 | 174.9° | 153.0° |
| C12 | C1 | C7 | C9 | 63.7° | 54.5° |
| C12 | C1 | C7 | H6 | 56.9° | 174.0° |
| C12 | C1 | C7 | H7 | 175.6° | 64.9° |
| C1 | C12 | H10 | H11 | 120.0° | 120.0° |
| C1 | C12 | H10 | H12 | 120.0° | 120.0° |
| C1 | C12 | H11 | H12 | 120.0° | 120.0° |
| C12 | C1 | C2 | H26 | 175.7° | 169.7° |
| O3 | C15 | C5 | C20 | 178.3° | 180.0° |
| O3 | C15 | C5 | C1 | 169.1° | 56.4° |
| O3 | C15 | C5 | O1 | 67.2° | 178.5° |
| O3 | C15 | C20 | O4 | 75.3° | 0.0° |
| O3 | C15 | C20 | H27 | 164.2° | 120.0° |
| O3 | C15 | C20 | H28 | 45.1° | 120.0° |
| C13 | C11 | C3 | H8 | 120.8° | 120.7° |
| C13 | C11 | C3 | H9 | 120.8° | 119.3° |
| C11 | C13 | C14 | H13 | 120.2° | 118.8° |
| C11 | C13 | C14 | H14 | 120.2° | 120.2° |
| C13 | C11 | C3 | C2 | 178.1° | 177.6° |
| C13 | C11 | C3 | C4 | 54.0° | 64.1° |
| C11 | C13 | C14 | C10 | 48.1° | 53.4° |
| C11 | C13 | C14 | C19 | 157.7° | 128.7° |
| C13 | C11 | C3 | H4 | 60.8° | 56.4° |
| C13 | C11 | H8 | H9 | 117.7° | 119.9° |
| C11 | C13 | H13 | H14 | 119.4° | 120.7° |
| C3 | C11 | C13 | C14 | 47.5° | 56.5° |
| C11 | C3 | C2 | C4 | 125.4° | 119.6° |
| C11 | C3 | C2 | H4 | 117.3° | 121.1° |
| C11 | C3 | C2 | C1 | 178.9° | 176.2° |
| C11 | C3 | C4 | H4 | 114.7° | 120.5° |
| C11 | C3 | C4 | C10 | 59.5° | 62.2° |
| C11 | C3 | C4 | C9 | 167.0° | 177.0° |
| C11 | C3 | C4 | CL1 | 52.9° | 56.5° |
| C3 | C11 | H8 | H9 | 117.6° | 119.3° |
| C3 | C11 | C13 | H13 | 167.7° | 174.8° |
| C3 | C11 | C13 | H14 | 72.7° | 64.5° |
| C11 | C3 | C2 | H26 | 61.9° | 62.6° |
| C13 | C14 | C10 | C17 | 68.2° | 63.4° |
| C13 | C14 | C10 | C19 | 154.1° | 177.8° |
| C13 | C14 | C10 | C4 | 54.7° | 53.0° |
| C13 | C14 | C10 | C18 | 177.9° | 177.7° |
| C13 | C14 | C19 | C22 | 146.9° | 179.1° |
| C14 | C13 | C11 | H8 | 168.2° | 64.8° |
| C14 | C13 | C11 | H9 | 73.3° | 175.2° |
| C14 | C13 | H13 | H14 | 119.5° | 121.8° |
| C13 | C14 | C19 | H24 | 33.1° | 0.9° |
| C15 | C5 | C1 | C2 | 170.0° | 148.2° |
| C15 | C5 | C1 | O1 | 119.0° | 122.1° |
| C15 | C5 | C1 | C7 | 71.5° | 94.6° |
| C5 | C15 | C20 | O4 | 103.0° | 180.0° |
| C5 | C15 | C20 | H27 | 17.4° | 60.0° |
| C5 | C15 | C20 | H28 | 136.5° | 60.0° |
| C15 | C5 | C8 | H31 | 93.2° | 118.3° |
| C15 | C5 | O1 | H32 | 24.2° | 58.0° |
| C20 | C15 | C5 | C1 | 12.5° | 123.6° |
| C20 | C15 | C5 | O1 | 111.2° | 1.5° |
| C15 | C20 | O4 | H27 | 120.5° | 120.0° |
| C15 | C20 | O4 | H28 | 120.5° | 120.0° |
| C15 | C20 | H27 | H28 | 118.6° | 119.9° |
| C15 | C20 | O4 | H33 | 27.5° | 180.0° |
| C3 | C2 | C1 | H26 | 116.8° | 120.7° |
| C3 | C2 | C1 | C5 | 177.6° | 166.2° |
| C2 | C3 | C4 | H4 | 117.2° | 119.3° |
| C3 | C2 | C1 | C7 | 59.9° | 70.2° |
| C2 | C3 | C4 | C10 | 172.4° | 177.5° |
| C2 | C3 | C4 | C9 | 38.9° | 56.7° |
| C2 | C3 | C4 | CL1 | 75.2° | 63.7° |
| C3 | C2 | C6 | H1 | 77.8° | 38.9° |
| C3 | C2 | C6 | H2 | 43.3° | 84.5° |
| C2 | C3 | C11 | H8 | 57.3° | 61.7° |
| C2 | C3 | C11 | H9 | 61.2° | 58.2° |
| C2 | C1 | C5 | C7 | 118.5° | 117.2° |
| C2 | C1 | C5 | O1 | 71.1° | 89.8° |
| C1 | C2 | C3 | C4 | 53.5° | 64.1° |
| C2 | C1 | C7 | C9 | 53.3° | 64.8° |
| C1 | C2 | C6 | H1 | 154.0° | 76.9° |
| C1 | C2 | C6 | H2 | 84.9° | 159.8° |
| C1 | C2 | C3 | H4 | 63.8° | 55.1° |
| C2 | C1 | C7 | H6 | 173.9° | 54.6° |
| C2 | C1 | C7 | H7 | 67.3° | 175.8° |
| C2 | C1 | C12 | H10 | 180.0° | 170.5° |
| C2 | C1 | C12 | H11 | 60.0° | 50.5° |
| C2 | C1 | C12 | H12 | 60.0° | 69.4° |
| C5 | C1 | C7 | C9 | 167.2° | 179.9° |
| C5 | C1 | C7 | H6 | 72.2° | 60.5° |
| C5 | C1 | C7 | H7 | 46.5° | 60.7° |
| C5 | C1 | C12 | H10 | 69.2° | 76.4° |
| C5 | C1 | C12 | H11 | 170.8° | 163.6° |
| C5 | C1 | C12 | H12 | 50.8° | 43.6° |
| C5 | C1 | C2 | H26 | 65.6° | 73.2° |
| C1 | C5 | C8 | H31 | 134.1° | 122.7° |
| C1 | C5 | O1 | H32 | 153.9° | 180.0° |
| O1 | C5 | C1 | C7 | 47.5° | 27.4° |
| O1 | C5 | C8 | H31 | 17.9° | 3.8° |
| C3 | C4 | C10 | C17 | 58.4° | 61.4° |
| C3 | C4 | C10 | C14 | 59.7° | 54.6° |
| C3 | C4 | C10 | C9 | 132.5° | 122.2° |
| C3 | C4 | C10 | CL1 | 110.3° | 118.3° |
| C3 | C4 | C10 | C18 | 178.7° | 179.0° |
| C3 | C4 | C9 | CL1 | 112.2° | 120.0° |
| C3 | C4 | C9 | O2 | 93.4° | 65.7° |
| C3 | C4 | C9 | C7 | 34.1° | 53.9° |
| C3 | C4 | C9 | H3 | 150.4° | 174.5° |
| C4 | C3 | C11 | H8 | 174.8° | 56.6° |
| C4 | C3 | C11 | H9 | 66.8° | 176.6° |
| C4 | C3 | C2 | H26 | 63.5° | 57.0° |
| C17 | C10 | C14 | C4 | 122.9° | 116.4° |
| C17 | C10 | C14 | C18 | 113.9° | 118.9° |
| C17 | C10 | C14 | C19 | 85.9° | 114.5° |
| C17 | C10 | C4 | C18 | 120.3° | 117.6° |
| C17 | C10 | C4 | C9 | 74.1° | 60.8° |
| C17 | C10 | C4 | CL1 | 168.7° | 179.8° |
| C17 | C10 | C18 | C21 | 73.4° | 114.9° |
| C10 | C17 | H19 | H20 | 120.0° | 120.1° |
| C10 | C17 | H19 | H21 | 120.0° | 120.0° |
| C10 | C17 | H20 | H21 | 120.0° | 120.0° |
| C17 | C10 | C18 | H22 | 106.6° | 65.1° |
| C1 | C7 | C9 | C4 | 41.7° | 57.4° |
| C1 | C7 | C9 | O2 | 86.2° | 62.7° |
| C1 | C7 | C9 | H6 | 120.6° | 119.4° |
| C1 | C7 | C9 | H7 | 120.6° | 119.4° |
| C1 | C7 | C9 | H3 | 157.8° | 178.0° |
| C1 | C7 | H6 | H7 | 118.0° | 121.1° |
| C7 | C1 | C12 | H10 | 61.2° | 52.9° |
| C7 | C1 | C12 | H11 | 58.8° | 67.1° |
| C7 | C1 | C12 | H12 | 178.8° | 172.9° |
| C7 | C1 | C2 | H26 | 57.0° | 50.4° |
| O4 | C20 | H27 | H28 | 118.6° | 120.1° |
| C14 | C10 | C4 | C18 | 121.6° | 126.4° |
| C14 | C10 | C4 | C9 | 167.7° | 176.8° |
| C14 | C10 | C4 | CL1 | 50.6° | 63.8° |
| C10 | C14 | C19 | C22 | 6.4° | 3.1° |
| C14 | C10 | C18 | C21 | 40.5° | 3.6° |
| C10 | C14 | C13 | H13 | 168.2° | 172.2° |
| C10 | C14 | C13 | H14 | 72.2° | 66.7° |
| C14 | C10 | C17 | H19 | 180.0° | 163.9° |
| C14 | C10 | C17 | H20 | 60.0° | 43.9° |
| C14 | C10 | C17 | H21 | 60.0° | 76.1° |
| C14 | C10 | C18 | H22 | 139.5° | 176.4° |
| C10 | C14 | C19 | H24 | 173.6° | 176.9° |
| C19 | C14 | C10 | C4 | 151.2° | 129.1° |
| C19 | C14 | C10 | C18 | 28.0° | 4.5° |
| C14 | C19 | C22 | H24 | 180.0° | 180.0° |
| C14 | C19 | C22 | O5 | 147.4° | 177.8° |
| C14 | C19 | C22 | C21 | 31.6° | 0.6° |
| C19 | C14 | C13 | H13 | 37.5° | 9.9° |
| C19 | C14 | C13 | H14 | 82.1° | 111.2° |
| C10 | C4 | C9 | CL1 | 117.1° | 119.4° |
| C10 | C4 | C9 | O2 | 37.3° | 54.9° |
| C10 | C4 | C9 | C7 | 164.8° | 174.5° |
| C4 | C10 | C18 | C21 | 161.9° | 127.5° |
| C10 | C4 | C9 | H3 | 78.9° | 64.9° |
| C10 | C4 | C3 | H4 | 55.1° | 58.3° |
| C4 | C10 | C17 | H19 | 60.1° | 78.6° |
| C4 | C10 | C17 | H20 | 180.0° | 161.4° |
| C4 | C10 | C17 | H21 | 60.0° | 41.4° |
| C4 | C10 | C18 | H22 | 18.1° | 52.4° |
| C18 | C10 | C4 | C9 | 46.1° | 56.7° |
| C18 | C10 | C4 | CL1 | 71.0° | 62.7° |
| C10 | C18 | C21 | C22 | 17.0° | 1.5° |
| C10 | C18 | C21 | H22 | 180.0° | 179.9° |
| C18 | C10 | C17 | H19 | 63.7° | 41.0° |
| C18 | C10 | C17 | H20 | 56.3° | 79.0° |
| C18 | C10 | C17 | H21 | 176.3° | 161.0° |
| C10 | C18 | C21 | H29 | 163.1° | 179.5° |
| C4 | C9 | O2 | C7 | 130.1° | 121.8° |
| C4 | C9 | O2 | H3 | 114.9° | 119.3° |
| C4 | C9 | C7 | H3 | 116.1° | 120.6° |
| C9 | C4 | C3 | H4 | 78.3° | 62.6° |
| C4 | C9 | O2 | H5 | 180.0° | 179.3° |
| C4 | C9 | C7 | H6 | 162.3° | 62.0° |
| C4 | C9 | C7 | H7 | 79.0° | 176.8° |
| CL1 | C4 | C9 | O2 | 154.4° | 174.3° |
| CL1 | C4 | C9 | C7 | 78.1° | 66.1° |
| CL1 | C4 | C9 | H3 | 38.2° | 54.5° |
| CL1 | C4 | C3 | H4 | 167.5° | 177.0° |
| O2 | C9 | C7 | H3 | 116.0° | 119.4° |
| O2 | C9 | C7 | H6 | 34.5° | 178.0° |
| O2 | C9 | C7 | H7 | 153.2° | 56.8° |
| C19 | C22 | O5 | C21 | 179.0° | 177.0° |
| C19 | C22 | C21 | C18 | 19.3° | 0.2° |
| C19 | C22 | C21 | H29 | 160.7° | 178.8° |
| C7 | C9 | O2 | H5 | 49.9° | 58.9° |
| C9 | C7 | H6 | H7 | 118.1° | 121.2° |
| O5 | C22 | C21 | C18 | 159.8° | 176.9° |
| O5 | C22 | C19 | H24 | 32.6° | 2.2° |
| O5 | C22 | C21 | H29 | 20.2° | 4.1° |
| C22 | C21 | C18 | H29 | 180.0° | 179.0° |
| C22 | C21 | C18 | H22 | 163.0° | 178.5° |
| C21 | C22 | C19 | H24 | 148.3° | 179.4° |
| H1 | C6 | C2 | H26 | 42.0° | 165.1° |
| H1 | C6 | C8 | H31 | 13.1° | 146.3° |
| H2 | C6 | C2 | H26 | 163.1° | 41.8° |
| H2 | C6 | C8 | H31 | 134.2° | 23.0° |
| H3 | C9 | O2 | H5 | 65.1° | 60.0° |
| H3 | C9 | C7 | H6 | 81.6° | 58.6° |
| H3 | C9 | C7 | H7 | 37.2° | 62.6° |
| H4 | C3 | C11 | H8 | 60.0° | 177.1° |
| H4 | C3 | C11 | H9 | 178.5° | 62.9° |
| H4 | C3 | C2 | H26 | 179.2° | 176.3° |
| H8 | C11 | C13 | H13 | 71.6° | 53.4° |
| H8 | C11 | C13 | H14 | 48.0° | 174.2° |
| H9 | C11 | C13 | H13 | 46.9° | 66.5° |
| H9 | C11 | C13 | H14 | 166.5° | 54.2° |
| H10 | C12 | H11 | H12 | 120.0° | 120.1° |
| H16 | C16 | H17 | H18 | 120.0° | 119.9° |
| H16 | C16 | C8 | H31 | 61.8° | 60.1° |
| H17 | C16 | C8 | H31 | 178.2° | 59.9° |
| H18 | C16 | C8 | H31 | 58.2° | 180.0° |
| H19 | C17 | H20 | H21 | 120.0° | 119.9° |
| H22 | C18 | C21 | H29 | 16.9° | 0.5° |
| H27 | C20 | O4 | H33 | 148.0° | 60.0° |
| H28 | C20 | O4 | H33 | 92.9° | 60.0° |
