DEX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.32Å | 1.33Å | |
| C1 | C10 | sing | 1.49Å | 1.50Å | |
| C1 | H1 | sing | 1.08Å | 1.09Å | |
| C2 | C3 | sing | 1.47Å | 1.50Å | |
| C2 | H2 | sing | 1.08Å | 1.09Å | |
| C3 | C4 | sing | 1.47Å | 1.50Å | |
| C3 | O1 | doub | 1.22Å | 1.23Å | |
| C4 | C5 | doub | 1.33Å | 1.33Å | |
| C4 | H4 | sing | 1.08Å | 1.09Å | |
| C5 | C6 | sing | 1.52Å | 1.50Å | |
| C5 | C10 | sing | 1.50Å | 1.50Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| C7 | H71 | sing | 1.09Å | 1.10Å | |
| C7 | H72 | sing | 1.09Å | 1.10Å | |
| C8 | C9 | sing | 1.54Å | 1.53Å | |
| C8 | C14 | sing | 1.52Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.11Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C11 | sing | 1.52Å | 1.53Å | |
| C9 | F1 | sing | 1.40Å | 1.36Å | |
| C10 | C19 | sing | 1.53Å | 1.53Å | |
| C11 | C12 | sing | 1.54Å | 1.53Å | |
| C11 | O2 | sing | 1.43Å | 1.42Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | H211 | sing | 1.09Å | 1.10Å | |
| C12 | H221 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.55Å | 1.53Å | |
| C13 | C17 | sing | 1.53Å | 1.53Å | |
| C13 | C18 | sing | 1.53Å | 1.53Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | H14 | sing | 1.09Å | 1.11Å | |
| C15 | C16 | sing | 1.55Å | 1.53Å | |
| C15 | H511 | sing | 1.09Å | 1.10Å | |
| C15 | H521 | sing | 1.09Å | 1.10Å | |
| C16 | C17 | sing | 1.55Å | 1.53Å | |
| C16 | C22 | sing | 1.53Å | 1.53Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | C20 | sing | 1.51Å | 1.52Å | |
| C17 | O3 | sing | 1.43Å | 1.42Å | |
| C18 | H811 | sing | 1.09Å | 1.10Å | |
| C18 | H821 | sing | 1.09Å | 1.11Å | |
| C18 | H831 | sing | 1.09Å | 1.11Å | |
| C19 | H911 | sing | 1.09Å | 1.11Å | |
| C19 | H921 | sing | 1.09Å | 1.10Å | |
| C19 | H931 | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C20 | O4 | doub | 1.21Å | 1.23Å | |
| C21 | O5 | sing | 1.43Å | 1.42Å | |
| C21 | H112 | sing | 1.09Å | 1.10Å | |
| C21 | H122 | sing | 1.09Å | 1.10Å | |
| C22 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C22 | H232 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.96Å | |
| O3 | H3 | sing | 0.97Å | 0.96Å | |
| O5 | H5 | sing | 0.97Å | 0.96Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C10 | 126.6° | 124.1° |
| C2 | C1 | H1 | 115.3° | 118.0° |
| C1 | C2 | C3 | 118.0° | 119.8° |
| C1 | C2 | H2 | 121.4° | 120.1° |
| C10 | C1 | H1 | 118.1° | 118.0° |
| C1 | C10 | C5 | 112.2° | 113.8° |
| C1 | C10 | C9 | 109.4° | 110.7° |
| C1 | C10 | C19 | 105.3° | 107.9° |
| C3 | C2 | H2 | 120.5° | 120.1° |
| C2 | C3 | C4 | 118.3° | 118.5° |
| C2 | C3 | O1 | 120.6° | 120.7° |
| C4 | C3 | O1 | 121.1° | 120.8° |
| C3 | C4 | C5 | 120.1° | 120.6° |
| C3 | C4 | H4 | 118.2° | 119.7° |
| C5 | C4 | H4 | 121.7° | 119.7° |
| C4 | C5 | C6 | 116.9° | 119.0° |
| C4 | C5 | C10 | 124.3° | 123.0° |
| C6 | C5 | C10 | 118.8° | 118.0° |
| C5 | C6 | C7 | 109.5° | 108.1° |
| C5 | C6 | H61 | 114.2° | 109.7° |
| C5 | C6 | H62 | 110.2° | 109.7° |
| C5 | C10 | C9 | 108.6° | 110.0° |
| C5 | C10 | C19 | 107.5° | 107.8° |
| C7 | C6 | H61 | 108.2° | 109.7° |
| C7 | C6 | H62 | 108.3° | 109.8° |
| C6 | C7 | C8 | 113.2° | 109.7° |
| C6 | C7 | H71 | 110.2° | 109.4° |
| C6 | C7 | H72 | 110.8° | 109.4° |
| H61 | C6 | H62 | 106.3° | 109.8° |
| C8 | C7 | H71 | 105.8° | 109.5° |
| C8 | C7 | H72 | 110.4° | 109.4° |
| C7 | C8 | C9 | 114.4° | 110.3° |
| C7 | C8 | C14 | 114.1° | 109.9° |
| C7 | C8 | H8 | 104.4° | 109.7° |
| H71 | C7 | H72 | 106.2° | 109.4° |
| C9 | C8 | C14 | 111.7° | 107.4° |
| C9 | C8 | H8 | 106.1° | 109.7° |
| C8 | C9 | C10 | 113.0° | 109.0° |
| C8 | C9 | C11 | 115.2° | 112.4° |
| C8 | C9 | F1 | 104.0° | 108.5° |
| C14 | C8 | H8 | 105.1° | 109.7° |
| C8 | C14 | C13 | 112.8° | 107.8° |
| C8 | C14 | C15 | 121.2° | 115.9° |
| C8 | C14 | H14 | 101.7° | 110.3° |
| C10 | C9 | C11 | 116.1° | 109.3° |
| C10 | C9 | F1 | 104.9° | 109.2° |
| C9 | C10 | C19 | 113.9° | 106.2° |
| C11 | C9 | F1 | 101.3° | 108.4° |
| C9 | C11 | C12 | 115.8° | 111.7° |
| C9 | C11 | O2 | 109.8° | 109.1° |
| C9 | C11 | H11 | 110.5° | 109.1° |
| C10 | C19 | H911 | 110.5° | 109.5° |
| C10 | C19 | H921 | 113.1° | 109.5° |
| C10 | C19 | H931 | 113.2° | 109.4° |
| C12 | C11 | O2 | 106.3° | 109.0° |
| C12 | C11 | H11 | 108.7° | 109.0° |
| C11 | C12 | C13 | 112.4° | 108.3° |
| C11 | C12 | H211 | 109.9° | 110.0° |
| C11 | C12 | H221 | 105.8° | 109.9° |
| O2 | C11 | H11 | 105.1° | 109.0° |
| C11 | O2 | HO2 | 108.1° | 106.8° |
| C13 | C12 | H211 | 112.0° | 111.1° |
| C13 | C12 | H221 | 111.7° | 107.5° |
| C12 | C13 | C14 | 108.4° | 108.0° |
| C12 | C13 | C17 | 114.9° | 117.6° |
| C12 | C13 | C18 | 110.1° | 109.8° |
| H211 | C12 | H221 | 104.5° | 110.0° |
| C14 | C13 | C17 | 98.5° | 103.4° |
| C14 | C13 | C18 | 114.1° | 107.2° |
| C13 | C14 | C15 | 105.9° | 101.7° |
| C13 | C14 | H14 | 109.0° | 110.4° |
| C17 | C13 | C18 | 110.4° | 110.2° |
| C13 | C17 | C16 | 106.2° | 105.2° |
| C13 | C17 | C20 | 114.1° | 110.4° |
| C13 | C17 | O3 | 109.8° | 110.3° |
| C13 | C18 | H811 | 111.6° | 109.5° |
| C13 | C18 | H821 | 112.8° | 109.4° |
| C13 | C18 | H831 | 113.5° | 109.5° |
| C15 | C14 | H14 | 105.5° | 110.3° |
| C14 | C15 | C16 | 103.7° | 102.9° |
| C14 | C15 | H511 | 110.3° | 110.8° |
| C14 | C15 | H521 | 107.9° | 110.7° |
| C16 | C15 | H511 | 115.2° | 110.7° |
| C16 | C15 | H521 | 113.0° | 110.7° |
| C15 | C16 | C17 | 106.2° | 106.4° |
| C15 | C16 | C22 | 111.0° | 110.0° |
| C15 | C16 | H16 | 105.2° | 110.1° |
| H511 | C15 | H521 | 106.6° | 110.8° |
| C17 | C16 | C22 | 116.2° | 110.2° |
| C17 | C16 | H16 | 108.6° | 110.1° |
| C16 | C17 | C20 | 113.1° | 108.9° |
| C16 | C17 | O3 | 106.9° | 111.7° |
| C22 | C16 | H16 | 109.0° | 110.0° |
| C16 | C22 | H212 | 109.3° | 109.5° |
| C16 | C22 | H222 | 110.8° | 109.4° |
| C16 | C22 | H232 | 109.6° | 109.4° |
| C20 | C17 | O3 | 106.7° | 110.3° |
| C17 | C20 | C21 | 122.6° | 120.1° |
| C17 | C20 | O4 | 120.4° | 120.0° |
| C17 | O3 | H3 | 107.2° | 106.8° |
| H811 | C18 | H821 | 107.4° | 109.4° |
| H811 | C18 | H831 | 103.5° | 109.5° |
| H821 | C18 | H831 | 107.4° | 109.4° |
| H911 | C19 | H921 | 104.5° | 109.5° |
| H911 | C19 | H931 | 105.7° | 109.4° |
| H921 | C19 | H931 | 109.2° | 109.5° |
| C21 | C20 | O4 | 117.0° | 120.0° |
| C20 | C21 | O5 | 110.0° | 109.5° |
| C20 | C21 | H112 | 109.4° | 109.5° |
| C20 | C21 | H122 | 109.4° | 109.4° |
| O5 | C21 | H112 | 109.6° | 109.5° |
| O5 | C21 | H122 | 111.3° | 109.4° |
| C21 | O5 | H5 | 105.1° | 106.9° |
| H112 | C21 | H122 | 107.1° | 109.5° |
| H212 | C22 | H222 | 109.9° | 109.5° |
| H212 | C22 | H232 | 108.3° | 109.5° |
| H222 | C22 | H232 | 108.9° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C10 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 5.3° | 2.6° |
| C1 | C2 | C3 | O1 | 174.6° | 177.4° |
| C2 | C1 | C10 | C5 | 4.6° | 3.4° |
| C2 | C1 | C10 | C9 | 125.2° | 128.0° |
| C2 | C1 | C10 | C19 | 112.0° | 116.2° |
| C10 | C1 | C2 | C3 | 0.2° | 0.4° |
| C10 | C1 | C2 | H2 | 179.8° | 179.6° |
| C1 | C10 | C5 | C4 | 4.8° | 3.7° |
| C1 | C10 | C5 | C6 | 174.8° | 176.4° |
| C1 | C10 | C5 | C9 | 121.0° | 125.0° |
| C1 | C10 | C5 | C19 | 115.3° | 119.6° |
| C1 | C10 | C9 | C8 | 172.1° | 179.9° |
| C1 | C10 | C9 | C19 | 117.5° | 116.8° |
| C1 | C10 | C9 | C11 | 51.5° | 56.8° |
| C1 | C10 | C9 | F1 | 59.4° | 61.7° |
| C1 | C10 | C19 | H911 | 165.3° | 82.0° |
| C1 | C10 | C19 | H921 | 48.6° | 157.9° |
| C1 | C10 | C19 | H931 | 76.2° | 37.9° |
| H1 | C1 | C2 | C3 | 179.7° | 179.6° |
| H1 | C1 | C2 | H2 | 0.2° | 0.5° |
| H1 | C1 | C10 | C5 | 175.4° | 176.6° |
| H1 | C1 | C10 | C9 | 54.8° | 52.0° |
| H1 | C1 | C10 | C19 | 68.0° | 63.8° |
| C2 | C3 | C4 | O1 | 179.9° | 180.0° |
| C2 | C3 | C4 | C5 | 5.1° | 2.3° |
| C2 | C3 | C4 | H4 | 174.5° | 177.8° |
| H2 | C2 | C3 | C4 | 174.8° | 177.5° |
| H2 | C2 | C3 | O1 | 5.3° | 2.5° |
| C3 | C4 | C5 | H4 | 179.6° | 179.9° |
| C3 | C4 | C5 | C6 | 179.5° | 179.1° |
| C3 | C4 | C5 | C10 | 0.2° | 1.0° |
| O1 | C3 | C4 | C5 | 174.8° | 177.7° |
| O1 | C3 | C4 | H4 | 5.6° | 2.2° |
| C4 | C5 | C6 | C10 | 179.6° | 179.9° |
| C4 | C5 | C6 | C7 | 126.6° | 128.3° |
| C4 | C5 | C6 | H61 | 5.1° | 8.7° |
| C4 | C5 | C6 | H62 | 114.5° | 112.0° |
| C4 | C5 | C10 | C9 | 125.8° | 128.7° |
| C4 | C5 | C10 | C19 | 110.6° | 115.9° |
| H4 | C4 | C5 | C6 | 0.1° | 1.0° |
| H4 | C4 | C5 | C10 | 179.7° | 178.9° |
| C5 | C6 | C7 | H61 | 125.0° | 119.7° |
| C5 | C6 | C7 | H62 | 120.2° | 119.6° |
| C5 | C6 | H61 | H62 | 121.7° | 120.7° |
| C5 | C6 | C7 | C8 | 47.6° | 55.2° |
| C5 | C6 | C7 | H71 | 70.7° | 64.9° |
| C5 | C6 | C7 | H72 | 172.2° | 175.2° |
| C6 | C5 | C10 | C9 | 53.8° | 51.4° |
| C6 | C5 | C10 | C19 | 69.8° | 64.0° |
| C10 | C5 | C6 | C7 | 53.1° | 51.8° |
| C10 | C5 | C6 | H61 | 174.6° | 171.4° |
| C10 | C5 | C6 | H62 | 65.9° | 67.9° |
| C5 | C10 | C9 | C8 | 49.3° | 53.3° |
| C5 | C10 | C9 | C19 | 119.7° | 116.4° |
| C5 | C10 | C9 | C11 | 174.3° | 176.5° |
| C5 | C10 | C9 | F1 | 63.4° | 65.1° |
| C5 | C10 | C19 | H911 | 74.8° | 41.3° |
| C5 | C10 | C19 | H921 | 168.5° | 78.7° |
| C5 | C10 | C19 | H931 | 43.6° | 161.2° |
| C7 | C6 | H61 | H62 | 116.1° | 120.7° |
| C6 | C7 | C8 | H71 | 120.7° | 120.1° |
| C6 | C7 | C8 | H72 | 124.8° | 120.0° |
| C6 | C7 | H71 | H72 | 120.0° | 119.9° |
| C6 | C7 | C8 | C9 | 48.9° | 63.4° |
| C6 | C7 | C8 | C14 | 179.2° | 178.4° |
| C6 | C7 | C8 | H8 | 66.6° | 57.6° |
| H61 | C6 | C7 | C8 | 172.6° | 174.9° |
| H61 | C6 | C7 | H71 | 54.3° | 54.8° |
| H61 | C6 | C7 | H72 | 62.8° | 65.1° |
| H62 | C6 | C7 | C8 | 72.6° | 64.4° |
| H62 | C6 | C7 | H71 | 169.2° | 175.5° |
| H62 | C6 | C7 | H72 | 52.0° | 55.6° |
| C8 | C7 | H71 | H72 | 117.3° | 119.9° |
| C7 | C8 | C9 | C14 | 131.5° | 119.8° |
| C7 | C8 | C9 | H8 | 114.6° | 121.0° |
| C7 | C8 | C14 | H8 | 113.8° | 120.7° |
| C7 | C8 | C9 | C10 | 50.0° | 61.6° |
| C7 | C8 | C9 | C11 | 173.2° | 177.1° |
| C7 | C8 | C9 | F1 | 63.2° | 57.2° |
| C7 | C8 | C14 | C13 | 173.9° | 176.2° |
| C7 | C8 | C14 | C15 | 46.9° | 63.0° |
| C7 | C8 | C14 | H14 | 69.5° | 63.2° |
| H71 | C7 | C8 | C9 | 71.9° | 56.7° |
| H71 | C7 | C8 | C14 | 58.5° | 61.5° |
| H71 | C7 | C8 | H8 | 172.6° | 177.7° |
| H72 | C7 | C8 | C9 | 173.7° | 176.6° |
| H72 | C7 | C8 | C14 | 56.0° | 58.4° |
| H72 | C7 | C8 | H8 | 58.2° | 62.4° |
| C9 | C8 | C14 | H8 | 114.6° | 119.2° |
| C8 | C9 | C10 | C11 | 136.4° | 123.2° |
| C8 | C9 | C10 | F1 | 112.7° | 118.4° |
| C8 | C9 | C11 | F1 | 111.5° | 120.0° |
| C8 | C9 | C10 | C19 | 70.4° | 63.1° |
| C8 | C9 | C11 | C12 | 38.6° | 53.7° |
| C8 | C9 | C11 | O2 | 81.8° | 66.9° |
| C8 | C9 | C11 | H11 | 162.8° | 174.2° |
| C9 | C8 | C14 | C13 | 54.4° | 63.8° |
| C9 | C8 | C14 | C15 | 178.5° | 176.9° |
| C9 | C8 | C14 | H14 | 62.2° | 56.9° |
| C14 | C8 | C9 | C10 | 178.5° | 178.7° |
| C14 | C8 | C9 | C11 | 41.7° | 57.4° |
| C14 | C8 | C9 | F1 | 68.3° | 62.5° |
| C8 | C14 | C13 | C12 | 61.5° | 68.1° |
| C8 | C14 | C13 | C15 | 134.8° | 122.3° |
| C8 | C14 | C13 | H14 | 112.2° | 120.6° |
| C8 | C14 | C13 | C17 | 178.5° | 166.6° |
| C8 | C14 | C13 | C18 | 61.6° | 50.1° |
| C8 | C14 | C15 | H14 | 114.4° | 126.2° |
| C8 | C14 | C15 | C16 | 161.9° | 158.1° |
| C8 | C14 | C15 | H511 | 74.3° | 83.5° |
| C8 | C14 | C15 | H521 | 41.8° | 39.8° |
| H8 | C8 | C9 | C10 | 64.6° | 59.4° |
| H8 | C8 | C9 | C11 | 72.2° | 61.9° |
| H8 | C8 | C9 | F1 | 177.8° | 178.2° |
| H8 | C8 | C14 | C13 | 60.2° | 55.4° |
| H8 | C8 | C14 | C15 | 66.9° | 57.7° |
| H8 | C8 | C14 | H14 | 176.8° | 176.1° |
| C10 | C9 | C11 | F1 | 113.0° | 118.9° |
| C10 | C9 | C11 | C12 | 174.0° | 174.8° |
| C10 | C9 | C11 | O2 | 53.7° | 54.3° |
| C10 | C9 | C11 | H11 | 61.8° | 64.7° |
| C9 | C10 | C19 | H911 | 45.5° | 159.2° |
| C9 | C10 | C19 | H921 | 71.2° | 39.2° |
| C9 | C10 | C19 | H931 | 164.0° | 80.9° |
| C11 | C9 | C10 | C19 | 66.0° | 60.1° |
| C9 | C11 | C12 | O2 | 122.3° | 120.6° |
| C9 | C11 | C12 | H11 | 125.1° | 120.6° |
| C9 | C11 | O2 | H11 | 118.9° | 119.0° |
| C9 | C11 | C12 | C13 | 46.0° | 55.2° |
| C9 | C11 | C12 | H211 | 171.6° | 176.8° |
| C9 | C11 | C12 | H221 | 76.2° | 62.0° |
| C9 | C11 | O2 | HO2 | 147.7° | 179.9° |
| F1 | C9 | C10 | C19 | 176.9° | 178.5° |
| F1 | C9 | C11 | C12 | 73.0° | 66.3° |
| F1 | C9 | C11 | O2 | 166.7° | 173.2° |
| F1 | C9 | C11 | H11 | 51.2° | 54.2° |
| C10 | C19 | H911 | H921 | 121.9° | 120.1° |
| C10 | C19 | H911 | H931 | 122.9° | 119.9° |
| C10 | C19 | H921 | H931 | 127.0° | 120.0° |
| C12 | C11 | O2 | H11 | 115.1° | 118.8° |
| C11 | C12 | C13 | H211 | 124.4° | 120.9° |
| C11 | C12 | C13 | H221 | 118.7° | 118.7° |
| C11 | C12 | H211 | H221 | 113.1° | 121.2° |
| C11 | C12 | C13 | C14 | 55.9° | 62.0° |
| C11 | C12 | C13 | C17 | 165.1° | 178.4° |
| C11 | C12 | C13 | C18 | 69.6° | 54.5° |
| C12 | C11 | O2 | HO2 | 21.7° | 57.9° |
| O2 | C11 | C12 | C13 | 76.3° | 65.4° |
| O2 | C11 | C12 | H211 | 49.3° | 56.3° |
| O2 | C11 | C12 | H221 | 161.6° | 177.5° |
| H11 | C11 | C12 | C13 | 171.1° | 175.8° |
| H11 | C11 | C12 | H211 | 63.3° | 62.6° |
| H11 | C11 | C12 | H221 | 48.9° | 58.6° |
| H11 | C11 | O2 | HO2 | 93.5° | 60.9° |
| C13 | C12 | H211 | H221 | 121.1° | 118.9° |
| C12 | C13 | C14 | C17 | 120.0° | 125.3° |
| C12 | C13 | C14 | C18 | 123.1° | 118.2° |
| C12 | C13 | C17 | C18 | 125.2° | 126.8° |
| C12 | C13 | C14 | C15 | 163.7° | 169.6° |
| C12 | C13 | C14 | H14 | 50.6° | 52.4° |
| C12 | C13 | C17 | C16 | 154.2° | 147.9° |
| C12 | C13 | C17 | C20 | 80.6° | 94.8° |
| C12 | C13 | C17 | O3 | 39.1° | 27.4° |
| C12 | C13 | C18 | H811 | 175.2° | 65.6° |
| C12 | C13 | C18 | H821 | 54.2° | 174.5° |
| C12 | C13 | C18 | H831 | 68.3° | 54.5° |
| H211 | C12 | C13 | C14 | 179.6° | 177.0° |
| H211 | C12 | C13 | C17 | 70.5° | 60.7° |
| H211 | C12 | C13 | C18 | 54.9° | 66.4° |
| H221 | C12 | C13 | C14 | 62.8° | 56.7° |
| H221 | C12 | C13 | C17 | 46.3° | 59.7° |
| H221 | C12 | C13 | C18 | 171.7° | 173.2° |
| C14 | C13 | C17 | C18 | 119.8° | 114.3° |
| C13 | C14 | C15 | H14 | 115.5° | 117.2° |
| C13 | C14 | C15 | C16 | 31.8° | 41.5° |
| C13 | C14 | C15 | H511 | 155.6° | 159.9° |
| C13 | C14 | C15 | H521 | 88.3° | 76.8° |
| C14 | C13 | C17 | C16 | 39.3° | 29.1° |
| C14 | C13 | C17 | C20 | 164.4° | 146.4° |
| C14 | C13 | C17 | O3 | 75.9° | 91.5° |
| C14 | C13 | C18 | H811 | 62.6° | 51.5° |
| C14 | C13 | C18 | H821 | 176.4° | 68.5° |
| C14 | C13 | C18 | H831 | 53.9° | 171.6° |
| C17 | C13 | C14 | C15 | 43.7° | 44.3° |
| C17 | C13 | C14 | H14 | 69.3° | 72.9° |
| C13 | C17 | C16 | C15 | 21.3° | 3.3° |
| C13 | C17 | C16 | C20 | 125.8° | 118.3° |
| C13 | C17 | C16 | O3 | 117.1° | 119.7° |
| C13 | C17 | C16 | C22 | 145.2° | 122.6° |
| C13 | C17 | C16 | H16 | 91.5° | 115.9° |
| C13 | C17 | C20 | O3 | 121.4° | 122.1° |
| C17 | C13 | C18 | H811 | 47.2° | 163.3° |
| C17 | C13 | C18 | H821 | 73.7° | 43.4° |
| C17 | C13 | C18 | H831 | 163.8° | 76.6° |
| C13 | C17 | C20 | C21 | 103.8° | 86.3° |
| C13 | C17 | C20 | O4 | 75.4° | 93.6° |
| C13 | C17 | O3 | H3 | 154.3° | 180.0° |
| C18 | C13 | C14 | C15 | 73.2° | 72.2° |
| C18 | C13 | C14 | H14 | 173.8° | 170.7° |
| C18 | C13 | C17 | C16 | 80.5° | 85.2° |
| C18 | C13 | C17 | C20 | 44.7° | 32.1° |
| C18 | C13 | C17 | O3 | 164.3° | 154.2° |
| C13 | C18 | H811 | H821 | 124.1° | 119.9° |
| C13 | C18 | H811 | H831 | 122.4° | 120.1° |
| C13 | C18 | H821 | H831 | 125.8° | 120.0° |
| C14 | C15 | C16 | H511 | 120.6° | 118.4° |
| C14 | C15 | C16 | H521 | 116.6° | 118.3° |
| C14 | C15 | H511 | H521 | 116.9° | 123.2° |
| C14 | C15 | C16 | C17 | 6.2° | 24.0° |
| C14 | C15 | C16 | C22 | 120.9° | 95.4° |
| C14 | C15 | C16 | H16 | 121.3° | 143.2° |
| H14 | C14 | C15 | C16 | 83.7° | 75.7° |
| H14 | C14 | C15 | H511 | 40.2° | 42.7° |
| H14 | C14 | C15 | H521 | 156.2° | 166.0° |
| C16 | C15 | H511 | H521 | 126.2° | 123.2° |
| C15 | C16 | C17 | C22 | 123.9° | 119.3° |
| C15 | C16 | C17 | H16 | 112.7° | 119.3° |
| C15 | C16 | C22 | H16 | 115.5° | 121.4° |
| C15 | C16 | C17 | C20 | 147.1° | 121.6° |
| C15 | C16 | C17 | O3 | 95.8° | 116.4° |
| C15 | C16 | C22 | H212 | 175.2° | 62.2° |
| C15 | C16 | C22 | H222 | 63.6° | 57.9° |
| C15 | C16 | C22 | H232 | 56.6° | 177.8° |
| H511 | C15 | C16 | C17 | 126.8° | 142.4° |
| H511 | C15 | C16 | C22 | 0.3° | 23.1° |
| H511 | C15 | C16 | H16 | 118.1° | 98.4° |
| H521 | C15 | C16 | C17 | 110.4° | 94.3° |
| H521 | C15 | C16 | C22 | 122.5° | 146.3° |
| H521 | C15 | C16 | H16 | 4.7° | 24.9° |
| C17 | C16 | C22 | H16 | 123.1° | 121.5° |
| C16 | C17 | C20 | O3 | 117.2° | 122.8° |
| C16 | C17 | C20 | C21 | 134.8° | 158.6° |
| C16 | C17 | C20 | O4 | 46.0° | 21.5° |
| C17 | C16 | C22 | H212 | 53.8° | 179.2° |
| C17 | C16 | C22 | H222 | 175.0° | 59.2° |
| C17 | C16 | C22 | H232 | 64.8° | 60.7° |
| C16 | C17 | O3 | H3 | 39.6° | 63.3° |
| C22 | C16 | C17 | C20 | 89.0° | 119.1° |
| C22 | C16 | C17 | O3 | 28.1° | 2.9° |
| C16 | C22 | H212 | H222 | 121.8° | 120.0° |
| C16 | C22 | H212 | H232 | 119.3° | 120.0° |
| C16 | C22 | H222 | H232 | 120.6° | 119.9° |
| H16 | C16 | C17 | C20 | 34.3° | 2.4° |
| H16 | C16 | C17 | O3 | 151.4° | 124.4° |
| H16 | C16 | C22 | H212 | 69.4° | 59.3° |
| H16 | C16 | C22 | H222 | 51.9° | 179.3° |
| H16 | C16 | C22 | H232 | 172.1° | 60.8° |
| C17 | C20 | C21 | O4 | 179.3° | 179.9° |
| C17 | C20 | C21 | O5 | 125.3° | 180.0° |
| C17 | C20 | C21 | H112 | 4.9° | 59.9° |
| C17 | C20 | C21 | H122 | 112.2° | 60.1° |
| C20 | C17 | O3 | H3 | 81.7° | 57.9° |
| O3 | C17 | C20 | C21 | 17.6° | 35.8° |
| O3 | C17 | C20 | O4 | 163.2° | 144.3° |
| H811 | C18 | H821 | H831 | 110.8° | 120.0° |
| H911 | C19 | H921 | H931 | 112.7° | 120.0° |
| C20 | C21 | O5 | H112 | 120.3° | 120.1° |
| C20 | C21 | O5 | H122 | 121.4° | 119.9° |
| C20 | C21 | H112 | H122 | 118.5° | 119.9° |
| C20 | C21 | O5 | H5 | 175.8° | 180.0° |
| O4 | C20 | C21 | O5 | 54.0° | 0.1° |
| O4 | C20 | C21 | H112 | 174.3° | 120.0° |
| O4 | C20 | C21 | H122 | 68.6° | 120.0° |
| O5 | C21 | H112 | H122 | 120.9° | 120.0° |
| H112 | C21 | O5 | H5 | 55.5° | 59.9° |
| H122 | C21 | O5 | H5 | 62.9° | 60.1° |
| H212 | C22 | H222 | H232 | 118.5° | 120.0° |
