DC6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C17 | sing | 1.53Å | 1.51Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C19 | sing | 1.53Å | 1.51Å | |
| C17 | O3 | sing | 1.45Å | 1.40Å | |
| O3 | C16 | sing | 1.34Å | 1.43Å | |
| C16 | O2 | doub | 1.21Å | 1.19Å | |
| C16 | C2 | sing | 1.51Å | 1.49Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.51Å | 1.48Å | |
| C15 | O | sing | 1.45Å | 1.41Å | |
| O1 | C14 | doub | 1.21Å | 1.19Å | |
| C14 | O | sing | 1.34Å | 1.43Å | |
| C14 | C4 | sing | 1.51Å | 1.45Å | |
| C4 | C7 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.51Å | |
| C1 | O4 | doub | 1.21Å | 1.19Å | |
| C1 | C6 | sing | 1.51Å | 1.47Å | |
| C5 | C6 | sing | 1.53Å | 1.49Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C18 | H5 | sing | 1.09Å | 1.10Å | |
| C18 | H6 | sing | 1.09Å | 1.10Å | |
| C19 | H7 | sing | 1.09Å | 1.10Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C6 | H13 | sing | 1.09Å | 1.10Å | |
| C6 | H14 | sing | 1.09Å | 1.10Å | |
| C5 | H15 | sing | 1.09Å | 1.10Å | |
| C5 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C7 | H20 | sing | 1.09Å | 1.10Å | |
| C7 | H21 | sing | 1.09Å | 1.10Å | |
| C7 | H22 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C17 | C18 | 111.5° | 109.5° |
| C20 | C17 | C19 | 110.6° | 109.5° |
| C20 | C17 | O3 | 105.8° | 109.5° |
| C17 | C20 | H10 | 109.5° | 109.5° |
| C17 | C20 | H11 | 109.4° | 109.4° |
| C17 | C20 | H12 | 109.5° | 109.5° |
| C18 | C17 | C19 | 110.3° | 109.5° |
| C18 | C17 | O3 | 110.5° | 109.5° |
| C17 | C18 | H4 | 109.5° | 109.5° |
| C17 | C18 | H5 | 109.5° | 109.4° |
| C17 | C18 | H6 | 109.4° | 109.5° |
| C19 | C17 | O3 | 108.1° | 109.4° |
| C17 | C19 | H7 | 109.5° | 109.5° |
| C17 | C19 | H8 | 109.4° | 109.4° |
| C17 | C19 | H9 | 109.5° | 109.5° |
| C17 | O3 | C16 | 121.3° | 117.0° |
| O3 | C16 | O2 | 118.6° | 120.0° |
| O3 | C16 | C2 | 119.6° | 120.0° |
| O2 | C16 | C2 | 121.7° | 120.0° |
| C16 | C2 | C3 | 117.3° | 109.6° |
| C16 | C2 | C1 | 113.3° | 109.6° |
| C16 | C2 | H3 | 102.1° | 109.8° |
| C2 | C3 | C4 | 110.4° | 109.4° |
| C3 | C2 | C1 | 116.9° | 108.6° |
| C2 | C3 | H1 | 109.2° | 109.5° |
| C2 | C3 | H2 | 109.2° | 109.5° |
| C3 | C2 | H3 | 101.7° | 109.6° |
| C3 | C4 | C14 | 99.4° | 109.4° |
| C3 | C4 | C7 | 113.7° | 109.4° |
| C3 | C4 | C5 | 116.6° | 109.8° |
| C4 | C3 | H1 | 109.3° | 109.5° |
| C4 | C3 | H2 | 109.3° | 109.5° |
| C2 | C1 | O4 | 121.7° | 120.8° |
| C2 | C1 | C6 | 120.0° | 118.3° |
| C1 | C2 | H3 | 102.1° | 109.6° |
| C15 | O | C14 | 115.5° | 117.0° |
| O | C15 | H17 | 109.5° | 109.5° |
| O | C15 | H18 | 109.5° | 109.5° |
| O | C15 | H19 | 109.4° | 109.5° |
| O1 | C14 | O | 125.1° | 120.1° |
| O1 | C14 | C4 | 116.8° | 120.0° |
| O | C14 | C4 | 117.9° | 120.0° |
| C14 | C4 | C7 | 109.1° | 109.4° |
| C14 | C4 | C5 | 109.6° | 109.4° |
| C7 | C4 | C5 | 108.0° | 109.4° |
| C4 | C7 | H20 | 109.5° | 109.4° |
| C4 | C7 | H21 | 109.4° | 109.5° |
| C4 | C7 | H22 | 109.5° | 109.5° |
| C4 | C5 | C6 | 108.9° | 109.4° |
| C4 | C5 | H15 | 109.6° | 109.5° |
| C4 | C5 | H16 | 109.6° | 109.5° |
| O4 | C1 | C6 | 118.1° | 120.9° |
| C1 | C6 | C5 | 102.8° | 108.5° |
| C1 | C6 | H13 | 111.1° | 109.6° |
| C1 | C6 | H14 | 111.1° | 109.6° |
| C5 | C6 | H13 | 111.1° | 109.6° |
| C5 | C6 | H14 | 111.1° | 109.8° |
| C6 | C5 | H15 | 109.6° | 109.5° |
| C6 | C5 | H16 | 109.6° | 109.5° |
| H1 | C3 | H2 | 109.5° | 109.5° |
| H4 | C18 | H5 | 109.5° | 109.5° |
| H4 | C18 | H6 | 109.5° | 109.5° |
| H5 | C18 | H6 | 109.5° | 109.4° |
| H7 | C19 | H8 | 109.5° | 109.5° |
| H7 | C19 | H9 | 109.5° | 109.5° |
| H8 | C19 | H9 | 109.5° | 109.5° |
| H10 | C20 | H11 | 109.4° | 109.5° |
| H10 | C20 | H12 | 109.4° | 109.5° |
| H11 | C20 | H12 | 109.5° | 109.4° |
| H13 | C6 | H14 | 109.5° | 109.7° |
| H15 | C5 | H16 | 109.5° | 109.5° |
| H17 | C15 | H18 | 109.5° | 109.4° |
| H17 | C15 | H19 | 109.5° | 109.5° |
| H18 | C15 | H19 | 109.5° | 109.5° |
| H20 | C7 | H21 | 109.4° | 109.5° |
| H20 | C7 | H22 | 109.5° | 109.4° |
| H21 | C7 | H22 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C17 | C18 | C19 | 123.3° | 120.0° |
| C20 | C17 | C18 | O3 | 117.3° | 120.0° |
| C20 | C17 | C19 | O3 | 115.3° | 120.0° |
| C20 | C17 | O3 | C16 | 179.2° | 60.0° |
| C20 | C17 | C18 | H4 | 180.0° | 180.0° |
| C20 | C17 | C18 | H5 | 60.0° | 60.0° |
| C20 | C17 | C18 | H6 | 60.0° | 59.9° |
| C20 | C17 | C19 | H7 | 180.0° | 180.0° |
| C20 | C17 | C19 | H8 | 60.0° | 60.0° |
| C20 | C17 | C19 | H9 | 60.0° | 60.0° |
| C17 | C20 | H10 | H11 | 120.0° | 120.0° |
| C17 | C20 | H10 | H12 | 120.0° | 120.0° |
| C17 | C20 | H11 | H12 | 120.0° | 120.0° |
| C18 | C17 | C19 | O3 | 120.9° | 120.0° |
| C18 | C17 | O3 | C16 | 58.5° | 180.0° |
| C17 | C18 | H4 | H5 | 120.0° | 120.0° |
| C17 | C18 | H4 | H6 | 120.0° | 120.0° |
| C17 | C18 | H5 | H6 | 120.0° | 120.0° |
| C18 | C17 | C19 | H7 | 56.2° | 60.0° |
| C18 | C17 | C19 | H8 | 176.2° | 60.0° |
| C18 | C17 | C19 | H9 | 63.8° | 180.0° |
| C18 | C17 | C20 | H10 | 180.0° | 60.0° |
| C18 | C17 | C20 | H11 | 60.0° | 60.1° |
| C18 | C17 | C20 | H12 | 60.0° | 180.0° |
| C19 | C17 | O3 | C16 | 62.3° | 60.0° |
| C19 | C17 | C18 | H4 | 56.8° | 60.0° |
| C19 | C17 | C18 | H5 | 63.3° | 180.0° |
| C19 | C17 | C18 | H6 | 176.7° | 60.1° |
| C17 | C19 | H7 | H8 | 120.0° | 119.9° |
| C17 | C19 | H7 | H9 | 120.0° | 120.0° |
| C17 | C19 | H8 | H9 | 120.0° | 120.0° |
| C19 | C17 | C20 | H10 | 56.9° | 60.0° |
| C19 | C17 | C20 | H11 | 176.9° | 179.9° |
| C19 | C17 | C20 | H12 | 63.1° | 60.0° |
| C17 | O3 | C16 | O2 | 7.9° | 0.0° |
| C17 | O3 | C16 | C2 | 169.3° | 180.0° |
| O3 | C17 | C18 | H4 | 62.7° | 60.0° |
| O3 | C17 | C18 | H5 | 177.3° | 60.0° |
| O3 | C17 | C18 | H6 | 57.3° | 180.0° |
| O3 | C17 | C19 | H7 | 64.7° | 60.0° |
| O3 | C17 | C19 | H8 | 55.3° | 180.0° |
| O3 | C17 | C19 | H9 | 175.3° | 60.0° |
| O3 | C17 | C20 | H10 | 59.9° | 180.0° |
| O3 | C17 | C20 | H11 | 60.1° | 60.0° |
| O3 | C17 | C20 | H12 | 179.9° | 60.0° |
| O3 | C16 | O2 | C2 | 177.1° | 180.0° |
| O3 | C16 | C2 | C3 | 33.2° | 51.6° |
| O3 | C16 | C2 | C1 | 174.1° | 170.7° |
| O3 | C16 | C2 | H3 | 76.9° | 68.8° |
| O2 | C16 | C2 | C3 | 149.7° | 128.4° |
| O2 | C16 | C2 | C1 | 8.8° | 9.3° |
| O2 | C16 | C2 | H3 | 100.2° | 111.2° |
| C16 | C2 | C3 | C1 | 139.5° | 119.7° |
| C16 | C2 | C3 | H3 | 110.3° | 120.6° |
| C16 | C2 | C3 | C4 | 173.1° | 65.1° |
| C16 | C2 | C1 | H3 | 109.0° | 120.6° |
| C16 | C2 | C1 | O4 | 33.4° | 111.6° |
| C16 | C2 | C1 | C6 | 151.0° | 68.4° |
| C16 | C2 | C3 | H1 | 66.8° | 174.9° |
| C16 | C2 | C3 | H2 | 52.9° | 54.9° |
| C2 | C3 | C4 | H1 | 120.1° | 120.0° |
| C2 | C3 | C4 | H2 | 120.1° | 120.0° |
| C3 | C2 | C1 | H3 | 110.0° | 119.7° |
| C2 | C3 | C4 | C14 | 113.8° | 176.4° |
| C2 | C3 | C4 | C7 | 130.4° | 56.5° |
| C2 | C3 | C4 | C5 | 3.7° | 63.6° |
| C3 | C2 | C1 | O4 | 174.4° | 128.6° |
| C3 | C2 | C1 | C6 | 10.0° | 51.4° |
| C2 | C3 | H1 | H2 | 119.6° | 120.0° |
| C4 | C3 | C2 | C1 | 33.6° | 54.6° |
| C3 | C4 | C14 | O1 | 77.9° | 0.0° |
| C3 | C4 | C14 | O | 97.7° | 180.0° |
| C3 | C4 | C14 | C7 | 119.2° | 119.9° |
| C3 | C4 | C14 | C5 | 122.7° | 120.3° |
| C3 | C4 | C7 | C5 | 131.1° | 120.4° |
| C3 | C4 | C5 | C6 | 50.3° | 63.6° |
| C4 | C3 | H1 | H2 | 119.6° | 120.0° |
| C4 | C3 | C2 | H3 | 76.6° | 174.3° |
| C3 | C4 | C5 | H15 | 69.6° | 176.4° |
| C3 | C4 | C5 | H16 | 170.3° | 56.4° |
| C3 | C4 | C7 | H20 | 180.0° | 75.1° |
| C3 | C4 | C7 | H21 | 60.0° | 164.8° |
| C3 | C4 | C7 | H22 | 60.0° | 44.8° |
| C2 | C1 | O4 | C6 | 175.7° | 180.0° |
| C2 | C1 | C6 | C5 | 42.2° | 51.3° |
| C1 | C2 | C3 | H1 | 153.8° | 65.3° |
| C1 | C2 | C3 | H2 | 86.5° | 174.6° |
| C2 | C1 | C6 | H13 | 76.7° | 68.3° |
| C2 | C1 | C6 | H14 | 161.2° | 171.2° |
| C15 | O | C14 | O1 | 97.4° | 0.0° |
| C15 | O | C14 | C4 | 77.7° | 180.0° |
| O | C15 | H17 | H18 | 120.0° | 120.0° |
| O | C15 | H17 | H19 | 120.0° | 120.0° |
| O | C15 | H18 | H19 | 120.0° | 120.0° |
| O1 | C14 | O | C4 | 175.2° | 180.0° |
| O1 | C14 | C4 | C7 | 41.3° | 119.9° |
| O1 | C14 | C4 | C5 | 159.4° | 120.3° |
| O | C14 | C4 | C7 | 143.1° | 60.2° |
| O | C14 | C4 | C5 | 25.1° | 59.6° |
| C14 | O | C15 | H17 | 180.0° | 60.0° |
| C14 | O | C15 | H18 | 60.0° | 179.9° |
| C14 | O | C15 | H19 | 60.0° | 60.0° |
| C14 | C4 | C7 | C5 | 119.0° | 119.8° |
| C14 | C4 | C5 | C6 | 162.2° | 176.3° |
| C14 | C4 | C3 | H1 | 6.3° | 63.7° |
| C14 | C4 | C3 | H2 | 126.0° | 56.4° |
| C14 | C4 | C5 | H15 | 42.3° | 56.3° |
| C14 | C4 | C5 | H16 | 77.9° | 63.7° |
| C14 | C4 | C7 | H20 | 70.0° | 165.0° |
| C14 | C4 | C7 | H21 | 49.9° | 45.0° |
| C14 | C4 | C7 | H22 | 170.0° | 75.1° |
| C7 | C4 | C5 | C6 | 79.1° | 56.5° |
| C7 | C4 | C3 | H1 | 109.5° | 176.5° |
| C7 | C4 | C3 | H2 | 10.2° | 63.5° |
| C7 | C4 | C5 | H15 | 161.0° | 63.4° |
| C7 | C4 | C5 | H16 | 40.9° | 176.5° |
| C4 | C7 | H20 | H21 | 120.0° | 120.0° |
| C4 | C7 | H20 | H22 | 120.0° | 119.9° |
| C4 | C7 | H21 | H22 | 120.0° | 120.0° |
| C4 | C5 | C6 | C1 | 71.3° | 54.6° |
| C4 | C5 | C6 | H15 | 119.9° | 120.0° |
| C4 | C5 | C6 | H16 | 119.9° | 120.0° |
| C5 | C4 | C3 | H1 | 123.8° | 56.4° |
| C5 | C4 | C3 | H2 | 116.4° | 176.4° |
| C4 | C5 | C6 | H13 | 47.6° | 65.1° |
| C4 | C5 | C6 | H14 | 169.7° | 174.4° |
| C4 | C5 | H15 | H16 | 120.2° | 120.0° |
| C5 | C4 | C7 | H20 | 49.0° | 45.2° |
| C5 | C4 | C7 | H21 | 168.9° | 74.8° |
| C5 | C4 | C7 | H22 | 71.0° | 165.2° |
| O4 | C1 | C6 | C5 | 133.5° | 128.7° |
| O4 | C1 | C2 | H3 | 75.6° | 8.9° |
| O4 | C1 | C6 | H13 | 107.5° | 111.6° |
| O4 | C1 | C6 | H14 | 14.6° | 8.8° |
| C1 | C6 | C5 | H13 | 118.9° | 119.7° |
| C1 | C6 | C5 | H14 | 119.0° | 119.8° |
| C6 | C1 | C2 | H3 | 100.0° | 171.1° |
| C1 | C6 | H13 | H14 | 123.1° | 120.4° |
| C1 | C6 | C5 | H15 | 48.6° | 174.6° |
| C1 | C6 | C5 | H16 | 168.8° | 65.4° |
| C5 | C6 | H13 | H14 | 123.1° | 120.6° |
| C6 | C5 | H15 | H16 | 120.3° | 120.0° |
| H1 | C3 | C2 | H3 | 43.6° | 54.4° |
| H2 | C3 | C2 | H3 | 163.3° | 65.7° |
| H4 | C18 | H5 | H6 | 120.0° | 120.0° |
| H7 | C19 | H8 | H9 | 120.0° | 120.0° |
| H10 | C20 | H11 | H12 | 120.0° | 120.0° |
| H13 | C6 | C5 | H15 | 167.5° | 54.9° |
| H13 | C6 | C5 | H16 | 72.3° | 174.9° |
| H14 | C6 | C5 | H15 | 70.4° | 65.6° |
| H14 | C6 | C5 | H16 | 49.8° | 54.4° |
| H17 | C15 | H18 | H19 | 120.0° | 120.0° |
| H20 | C7 | H21 | H22 | 120.0° | 120.0° |
