F6K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O15 | C8 | sing | 1.43Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| O20 | C19 | doub | 1.21Å | 1.23Å | |
| C3 | C19 | sing | 1.51Å | 1.40Å | |
| C3 | C4 | sing | 1.55Å | 1.54Å | |
| C19 | N18 | sing | 1.34Å | 1.33Å | |
| C14 | C13 | sing | 1.53Å | 1.52Å | |
| C14 | C9 | sing | 1.53Å | 1.49Å | |
| C8 | C9 | sing | 1.53Å | 1.55Å | |
| C8 | C7 | sing | 1.53Å | 1.58Å | |
| C6 | C4 | sing | 1.53Å | 1.53Å | |
| C21 | C1 | sing | 1.53Å | 1.50Å | |
| C21 | CL | sing | 1.80Å | 1.80Å | |
| C4 | C7 | sing | 1.54Å | 1.52Å | |
| C4 | O5 | sing | 1.43Å | 1.45Å | |
| N18 | C7 | sing | 1.47Å | 1.49Å | |
| C13 | C12 | sing | 1.53Å | 1.48Å | |
| C9 | C10 | sing | 1.50Å | 1.41Å | |
| C12 | C11 | sing | 1.50Å | 1.38Å | |
| C7 | C16 | sing | 1.51Å | 1.42Å | |
| C10 | C11 | doub | 1.29Å | 1.37Å | |
| C16 | O17 | doub | 1.21Å | 1.24Å | |
| C6 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | H13 | sing | 1.09Å | 1.10Å | |
| C3 | H14 | sing | 1.09Å | 1.10Å | |
| O5 | H15 | sing | 0.97Å | 0.95Å | |
| N18 | H16 | sing | 0.97Å | 1.00Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| O15 | H18 | sing | 0.97Å | 0.95Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O15 | C8 | C9 | 109.9° | 109.5° |
| O15 | C8 | C7 | 111.8° | 109.5° |
| O15 | C8 | H4 | 108.4° | 109.5° |
| C8 | O15 | H18 | 109.5° | 114.0° |
| C3 | C2 | C1 | 111.7° | 109.4° |
| C2 | C3 | C19 | 114.4° | 110.5° |
| C2 | C3 | C4 | 112.2° | 110.5° |
| C3 | C2 | H12 | 108.9° | 109.5° |
| C3 | C2 | H13 | 108.9° | 109.5° |
| C2 | C3 | H14 | 108.4° | 110.5° |
| C2 | C1 | C21 | 113.6° | 109.4° |
| C2 | C1 | H10 | 108.4° | 109.5° |
| C2 | C1 | H11 | 108.4° | 109.5° |
| C1 | C2 | H12 | 108.9° | 109.5° |
| C1 | C2 | H13 | 108.9° | 109.5° |
| O20 | C19 | C3 | 125.1° | 124.9° |
| O20 | C19 | N18 | 123.1° | 125.0° |
| C19 | C3 | C4 | 102.8° | 104.2° |
| C3 | C19 | N18 | 111.8° | 110.1° |
| C19 | C3 | H14 | 110.4° | 110.5° |
| C3 | C4 | C6 | 110.9° | 111.0° |
| C3 | C4 | C7 | 102.3° | 101.8° |
| C3 | C4 | O5 | 113.6° | 111.0° |
| C4 | C3 | H14 | 108.5° | 110.7° |
| C19 | N18 | C7 | 110.8° | 111.3° |
| C19 | N18 | H16 | 124.6° | 124.3° |
| C13 | C14 | C9 | 105.9° | 108.5° |
| C14 | C13 | C12 | 111.5° | 108.6° |
| C14 | C13 | H6 | 109.0° | 109.3° |
| C14 | C13 | H7 | 109.0° | 110.1° |
| C13 | C14 | H20 | 110.3° | 109.6° |
| C13 | C14 | H21 | 110.4° | 109.6° |
| C14 | C9 | C8 | 107.4° | 109.4° |
| C14 | C9 | C10 | 113.7° | 110.1° |
| C14 | C9 | H19 | 106.1° | 109.3° |
| C9 | C14 | H20 | 110.4° | 109.6° |
| C9 | C14 | H21 | 110.3° | 109.6° |
| C9 | C8 | C7 | 112.8° | 109.5° |
| C8 | C9 | C10 | 116.7° | 109.4° |
| C9 | C8 | H4 | 107.0° | 109.5° |
| C8 | C9 | H19 | 105.3° | 109.3° |
| C8 | C7 | C4 | 115.5° | 110.3° |
| C8 | C7 | N18 | 108.2° | 110.3° |
| C8 | C7 | C16 | 113.9° | 110.2° |
| C7 | C8 | H4 | 106.7° | 109.5° |
| C6 | C4 | C7 | 117.1° | 110.9° |
| C6 | C4 | O5 | 106.2° | 110.9° |
| C4 | C6 | H1 | 109.5° | 109.4° |
| C4 | C6 | H2 | 109.5° | 109.4° |
| C4 | C6 | H3 | 109.5° | 109.5° |
| C1 | C21 | CL | 104.8° | 109.5° |
| C1 | C21 | H8 | 110.6° | 109.5° |
| C1 | C21 | H9 | 110.6° | 109.5° |
| C21 | C1 | H10 | 108.4° | 109.5° |
| C21 | C1 | H11 | 108.4° | 109.4° |
| CL | C21 | H8 | 110.6° | 109.5° |
| CL | C21 | H9 | 110.6° | 109.4° |
| C7 | C4 | O5 | 106.9° | 111.0° |
| C4 | C7 | N18 | 99.6° | 105.5° |
| C4 | C7 | C16 | 108.4° | 110.2° |
| C4 | O5 | H15 | 109.5° | 114.0° |
| N18 | C7 | C16 | 110.2° | 110.2° |
| C7 | N18 | H16 | 124.6° | 124.4° |
| C13 | C12 | C11 | 113.2° | 110.3° |
| C12 | C13 | H6 | 108.9° | 109.6° |
| C12 | C13 | H7 | 109.0° | 109.7° |
| C13 | C12 | H22 | 108.6° | 109.3° |
| C13 | C12 | H23 | 108.5° | 109.3° |
| C9 | C10 | C11 | 123.3° | 124.1° |
| C9 | C10 | H5 | 118.3° | 118.0° |
| C10 | C9 | H19 | 106.9° | 109.3° |
| C12 | C11 | C10 | 120.8° | 124.1° |
| C11 | C12 | H22 | 108.5° | 109.3° |
| C11 | C12 | H23 | 108.6° | 109.4° |
| C12 | C11 | H24 | 119.6° | 118.0° |
| C7 | C16 | O17 | 121.2° | 120.0° |
| C7 | C16 | H17 | 119.4° | 120.0° |
| C11 | C10 | H5 | 118.3° | 118.0° |
| C10 | C11 | H24 | 119.6° | 117.9° |
| O17 | C16 | H17 | 119.4° | 120.0° |
| H1 | C6 | H2 | 109.5° | 109.5° |
| H1 | C6 | H3 | 109.4° | 109.5° |
| H2 | C6 | H3 | 109.5° | 109.5° |
| H6 | C13 | H7 | 109.5° | 109.6° |
| H8 | C21 | H9 | 109.5° | 109.5° |
| H10 | C1 | H11 | 109.5° | 109.5° |
| H12 | C2 | H13 | 109.5° | 109.5° |
| H20 | C14 | H21 | 109.5° | 109.8° |
| H22 | C12 | H23 | 109.4° | 109.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O15 | C8 | C9 | C14 | 55.9° | 72.5° |
| O15 | C8 | C9 | C7 | 125.5° | 120.0° |
| O15 | C8 | C9 | H4 | 117.4° | 120.0° |
| O15 | C8 | C7 | H4 | 118.3° | 120.0° |
| O15 | C8 | C7 | C4 | 74.2° | 55.0° |
| O15 | C8 | C7 | N18 | 36.5° | 61.1° |
| O15 | C8 | C9 | C10 | 73.0° | 48.2° |
| O15 | C8 | C7 | C16 | 159.4° | 176.9° |
| O15 | C8 | C9 | H19 | 168.7° | 167.9° |
| C3 | C2 | C1 | H12 | 120.4° | 120.0° |
| C3 | C2 | C1 | H13 | 120.3° | 120.0° |
| C2 | C3 | C19 | O20 | 38.0° | 45.0° |
| C2 | C3 | C19 | C4 | 121.9° | 118.6° |
| C2 | C3 | C19 | H14 | 122.6° | 122.5° |
| C2 | C3 | C4 | H14 | 119.7° | 122.6° |
| C2 | C3 | C19 | N18 | 143.1° | 134.9° |
| C2 | C3 | C4 | C6 | 77.3° | 98.5° |
| C3 | C2 | C1 | C21 | 169.6° | 180.0° |
| C2 | C3 | C4 | C7 | 157.1° | 143.5° |
| C2 | C3 | C4 | O5 | 42.3° | 25.3° |
| C3 | C2 | C1 | H10 | 49.0° | 60.0° |
| C3 | C2 | C1 | H11 | 69.8° | 60.1° |
| C3 | C2 | H12 | H13 | 119.0° | 120.0° |
| C1 | C2 | C3 | C19 | 46.4° | 66.5° |
| C1 | C2 | C3 | C4 | 70.2° | 178.8° |
| C2 | C1 | C21 | H10 | 120.6° | 120.0° |
| C2 | C1 | C21 | H11 | 120.6° | 120.0° |
| C2 | C1 | C21 | CL | 166.4° | 180.0° |
| C2 | C1 | C21 | H8 | 74.4° | 60.0° |
| C2 | C1 | C21 | H9 | 47.1° | 60.1° |
| C2 | C1 | H10 | H11 | 118.1° | 120.1° |
| C1 | C2 | H12 | H13 | 119.0° | 120.0° |
| C1 | C2 | C3 | H14 | 170.0° | 56.0° |
| O20 | C19 | C3 | N18 | 178.9° | 179.9° |
| O20 | C19 | C3 | C4 | 159.9° | 163.7° |
| O20 | C19 | N18 | C7 | 178.4° | 179.7° |
| O20 | C19 | C3 | H14 | 84.6° | 77.5° |
| O20 | C19 | N18 | H16 | 1.6° | 0.3° |
| C19 | C3 | C4 | H14 | 116.9° | 118.7° |
| C19 | C3 | C4 | C6 | 159.3° | 142.9° |
| C19 | C3 | C4 | C7 | 33.7° | 24.8° |
| C19 | C3 | C4 | O5 | 81.1° | 93.3° |
| C3 | C19 | N18 | C7 | 0.6° | 0.4° |
| C19 | C3 | C2 | H12 | 74.0° | 53.5° |
| C19 | C3 | C2 | H13 | 166.7° | 173.6° |
| C3 | C19 | N18 | H16 | 179.4° | 179.6° |
| C4 | C3 | C19 | N18 | 21.2° | 16.3° |
| C3 | C4 | C7 | C8 | 83.0° | 93.6° |
| C3 | C4 | C6 | C7 | 116.9° | 112.3° |
| C3 | C4 | C6 | O5 | 123.9° | 123.8° |
| C3 | C4 | C7 | O5 | 119.7° | 118.1° |
| C3 | C4 | C7 | N18 | 32.6° | 25.5° |
| C3 | C4 | C7 | C16 | 147.8° | 144.4° |
| C3 | C4 | C6 | H1 | 180.0° | 172.4° |
| C3 | C4 | C6 | H2 | 60.0° | 67.7° |
| C3 | C4 | C6 | H3 | 60.0° | 52.4° |
| C4 | C3 | C2 | H12 | 169.4° | 61.2° |
| C4 | C3 | C2 | H13 | 50.1° | 58.8° |
| C3 | C4 | O5 | H15 | 180.0° | 67.6° |
| C19 | N18 | C7 | C8 | 99.1° | 102.0° |
| C19 | N18 | C7 | C4 | 22.0° | 17.0° |
| C19 | N18 | C7 | H16 | 180.0° | 180.0° |
| C19 | N18 | C7 | C16 | 135.8° | 136.0° |
| N18 | C19 | C3 | H14 | 94.4° | 102.6° |
| C13 | C14 | C9 | H20 | 119.4° | 119.7° |
| C13 | C14 | C9 | H21 | 119.4° | 119.7° |
| C13 | C14 | C9 | C8 | 178.8° | 169.6° |
| C14 | C13 | C12 | H6 | 120.3° | 119.3° |
| C14 | C13 | C12 | H7 | 120.3° | 120.3° |
| C13 | C14 | C9 | C10 | 48.2° | 49.4° |
| C14 | C13 | C12 | C11 | 49.6° | 49.1° |
| C14 | C13 | H6 | H7 | 119.1° | 120.7° |
| C13 | C14 | C9 | H19 | 69.0° | 70.7° |
| C13 | C14 | H20 | H21 | 121.7° | 120.5° |
| C14 | C13 | C12 | H22 | 170.1° | 169.3° |
| C14 | C13 | C12 | H23 | 71.0° | 71.2° |
| C14 | C9 | C8 | C10 | 128.9° | 120.7° |
| C14 | C9 | C8 | H19 | 112.7° | 119.6° |
| C14 | C9 | C8 | C7 | 178.5° | 167.5° |
| C9 | C14 | C13 | C12 | 62.4° | 67.2° |
| C14 | C9 | C10 | H19 | 116.7° | 120.1° |
| C14 | C9 | C10 | C11 | 23.6° | 17.1° |
| C14 | C9 | C8 | H4 | 61.5° | 47.5° |
| C14 | C9 | C10 | H5 | 156.4° | 162.6° |
| C9 | C14 | C13 | H6 | 57.9° | 52.3° |
| C9 | C14 | C13 | H7 | 177.3° | 172.7° |
| C9 | C14 | H20 | H21 | 121.6° | 120.5° |
| C9 | C8 | C7 | H4 | 117.2° | 120.0° |
| C9 | C8 | C7 | C4 | 161.3° | 175.0° |
| C9 | C8 | C7 | N18 | 88.0° | 58.9° |
| C8 | C9 | C10 | H19 | 117.5° | 119.7° |
| C9 | C8 | C7 | C16 | 34.9° | 63.1° |
| C8 | C9 | C10 | C11 | 149.4° | 137.3° |
| C8 | C9 | C10 | H5 | 30.6° | 42.3° |
| C9 | C8 | O15 | H18 | 180.0° | 60.0° |
| C8 | C9 | C14 | H20 | 59.3° | 50.0° |
| C8 | C9 | C14 | H21 | 61.8° | 70.7° |
| C8 | C7 | C4 | C6 | 38.5° | 24.5° |
| C8 | C7 | C4 | N18 | 115.6° | 119.1° |
| C8 | C7 | C4 | C16 | 129.2° | 121.9° |
| C8 | C7 | C4 | O5 | 157.4° | 148.2° |
| C8 | C7 | N18 | C16 | 125.1° | 121.9° |
| C7 | C8 | C9 | C10 | 52.6° | 71.8° |
| C8 | C7 | C16 | O17 | 109.4° | 2.0° |
| C8 | C7 | N18 | H16 | 80.9° | 78.0° |
| C8 | C7 | C16 | H17 | 70.6° | 178.1° |
| C7 | C8 | O15 | H18 | 53.9° | 60.0° |
| C7 | C8 | C9 | H19 | 65.8° | 47.9° |
| C6 | C4 | C7 | O5 | 118.9° | 123.8° |
| C6 | C4 | C7 | N18 | 154.1° | 143.5° |
| C6 | C4 | C7 | C16 | 90.7° | 97.5° |
| C4 | C6 | H1 | H2 | 120.0° | 119.9° |
| C4 | C6 | H1 | H3 | 120.0° | 120.0° |
| C4 | C6 | H2 | H3 | 120.0° | 120.0° |
| C6 | C4 | C3 | H14 | 42.4° | 24.2° |
| C6 | C4 | O5 | H15 | 57.8° | 56.2° |
| C1 | C21 | CL | H8 | 119.2° | 120.0° |
| C1 | C21 | CL | H9 | 119.2° | 120.0° |
| C1 | C21 | H8 | H9 | 122.1° | 120.0° |
| C21 | C1 | H10 | H11 | 118.1° | 120.0° |
| C21 | C1 | C2 | H12 | 70.1° | 60.0° |
| C21 | C1 | C2 | H13 | 49.3° | 60.0° |
| CL | C21 | H8 | H9 | 122.2° | 120.0° |
| CL | C21 | C1 | H10 | 45.7° | 60.0° |
| CL | C21 | C1 | H11 | 73.0° | 60.0° |
| C4 | C7 | N18 | C16 | 113.8° | 119.0° |
| C4 | C7 | C16 | O17 | 120.5° | 120.0° |
| C7 | C4 | C6 | H1 | 63.1° | 60.0° |
| C7 | C4 | C6 | H2 | 176.9° | 180.0° |
| C7 | C4 | C6 | H3 | 56.9° | 60.0° |
| C4 | C7 | C8 | H4 | 44.2° | 65.0° |
| C7 | C4 | C3 | H14 | 83.2° | 93.9° |
| C7 | C4 | O5 | H15 | 68.0° | 180.0° |
| C4 | C7 | N18 | H16 | 158.0° | 163.0° |
| C4 | C7 | C16 | H17 | 59.5° | 60.0° |
| O5 | C4 | C7 | N18 | 87.0° | 92.7° |
| O5 | C4 | C7 | C16 | 28.2° | 26.3° |
| O5 | C4 | C6 | H1 | 56.1° | 63.8° |
| O5 | C4 | C6 | H2 | 63.9° | 56.2° |
| O5 | C4 | C6 | H3 | 176.1° | 176.2° |
| O5 | C4 | C3 | H14 | 162.0° | 148.0° |
| N18 | C7 | C16 | O17 | 12.4° | 124.0° |
| N18 | C7 | C8 | H4 | 154.8° | 178.9° |
| N18 | C7 | C16 | H17 | 167.6° | 56.1° |
| C13 | C12 | C11 | H22 | 120.6° | 120.2° |
| C13 | C12 | C11 | H23 | 120.6° | 120.2° |
| C13 | C12 | C11 | C10 | 21.4° | 16.6° |
| C12 | C13 | H6 | H7 | 119.1° | 120.4° |
| C12 | C13 | C14 | H20 | 57.1° | 52.4° |
| C12 | C13 | C14 | H21 | 178.2° | 173.1° |
| C13 | C12 | H22 | H23 | 118.3° | 119.6° |
| C13 | C12 | C11 | H24 | 158.6° | 163.4° |
| C9 | C10 | C11 | C12 | 8.5° | 0.1° |
| C9 | C10 | C11 | H5 | 180.0° | 179.7° |
| C10 | C9 | C8 | H4 | 169.6° | 168.3° |
| C10 | C9 | C14 | H20 | 71.3° | 70.3° |
| C10 | C9 | C14 | H21 | 167.6° | 169.1° |
| C9 | C10 | C11 | H24 | 171.5° | 179.9° |
| C12 | C11 | C10 | H24 | 180.0° | 180.0° |
| C12 | C11 | C10 | H5 | 171.5° | 179.5° |
| C11 | C12 | C13 | H6 | 70.7° | 70.3° |
| C11 | C12 | C13 | H7 | 169.9° | 169.4° |
| C11 | C12 | H22 | H23 | 118.3° | 119.6° |
| C7 | C16 | O17 | H17 | 180.0° | 180.0° |
| C16 | C7 | C8 | H4 | 82.3° | 56.9° |
| C16 | C7 | N18 | H16 | 44.2° | 44.0° |
| C11 | C10 | C9 | H19 | 93.1° | 103.0° |
| C10 | C11 | C12 | H22 | 141.9° | 136.9° |
| C10 | C11 | C12 | H23 | 99.2° | 103.6° |
| H1 | C6 | H2 | H3 | 119.9° | 120.1° |
| H4 | C8 | O15 | H18 | 63.4° | 180.0° |
| H4 | C8 | C9 | H19 | 51.2° | 72.0° |
| H5 | C10 | C9 | H19 | 86.9° | 77.3° |
| H5 | C10 | C11 | H24 | 8.5° | 0.5° |
| H6 | C13 | C14 | H20 | 177.3° | 172.0° |
| H6 | C13 | C14 | H21 | 61.5° | 67.4° |
| H6 | C13 | C12 | H22 | 49.8° | 50.0° |
| H6 | C13 | C12 | H23 | 168.7° | 169.5° |
| H7 | C13 | C14 | H20 | 63.2° | 67.6° |
| H7 | C13 | C14 | H21 | 57.9° | 53.0° |
| H7 | C13 | C12 | H22 | 69.6° | 70.4° |
| H7 | C13 | C12 | H23 | 49.3° | 49.1° |
| H8 | C21 | C1 | H10 | 165.0° | 180.0° |
| H8 | C21 | C1 | H11 | 46.2° | 60.0° |
| H9 | C21 | C1 | H10 | 73.5° | 60.0° |
| H9 | C21 | C1 | H11 | 167.7° | 180.0° |
| H10 | C1 | C2 | H12 | 169.3° | 180.0° |
| H10 | C1 | C2 | H13 | 71.4° | 60.0° |
| H11 | C1 | C2 | H12 | 50.6° | 59.9° |
| H11 | C1 | C2 | H13 | 169.9° | 180.0° |
| H12 | C2 | C3 | H14 | 49.7° | 176.0° |
| H13 | C2 | C3 | H14 | 69.7° | 63.9° |
| H19 | C9 | C14 | H20 | 171.6° | 169.6° |
| H19 | C9 | C14 | H21 | 50.4° | 49.0° |
| H22 | C12 | C11 | H24 | 38.0° | 43.1° |
| H23 | C12 | C11 | H24 | 80.8° | 76.4° |
