U6L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C07 | C08 | doub | 1.38Å | 1.38Å | Aromatic |
| C07 | C06 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| C06 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C09 | C11 | sing | 1.51Å | 1.53Å | |
| C09 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C05 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C05 | C03 | sing | 1.51Å | 1.53Å | |
| O04 | C03 | sing | 1.43Å | 1.40Å | |
| C03 | C01 | sing | 1.53Å | 1.53Å | |
| C01 | O02 | sing | 1.43Å | 1.40Å | |
| C06 | H1 | sing | 1.08Å | 1.08Å | |
| C07 | H2 | sing | 1.08Å | 1.08Å | |
| C08 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| O02 | H12 | sing | 0.97Å | 0.95Å | |
| C03 | H13 | sing | 1.09Å | 1.10Å | |
| O04 | H14 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C08 | C07 | C06 | 120.0° | 120.0° |
| C07 | C08 | C09 | 120.0° | 120.0° |
| C08 | C07 | H2 | 120.0° | 120.0° |
| C07 | C08 | H3 | 120.0° | 120.0° |
| C07 | C06 | C05 | 120.0° | 120.0° |
| C07 | C06 | H1 | 120.0° | 120.0° |
| C06 | C07 | H2 | 120.0° | 120.0° |
| C08 | C09 | C11 | 120.0° | 120.0° |
| C08 | C09 | C10 | 120.0° | 120.0° |
| C09 | C08 | H3 | 120.0° | 120.0° |
| C06 | C05 | C10 | 119.9° | 120.0° |
| C06 | C05 | C03 | 120.0° | 120.0° |
| C05 | C06 | H1 | 120.0° | 120.0° |
| C11 | C09 | C10 | 120.0° | 120.0° |
| C09 | C11 | C12 | 112.5° | 109.5° |
| C09 | C11 | H5 | 108.7° | 109.5° |
| C09 | C11 | H6 | 108.7° | 109.5° |
| C09 | C10 | C05 | 120.0° | 120.0° |
| C09 | C10 | H4 | 120.0° | 120.0° |
| C12 | C11 | H5 | 108.7° | 109.5° |
| C12 | C11 | H6 | 108.7° | 109.4° |
| C11 | C12 | H7 | 109.5° | 109.5° |
| C11 | C12 | H8 | 109.5° | 109.5° |
| C11 | C12 | H9 | 109.5° | 109.4° |
| C10 | C05 | C03 | 120.1° | 120.0° |
| C05 | C10 | H4 | 120.0° | 120.0° |
| C05 | C03 | O04 | 109.6° | 109.5° |
| C05 | C03 | C01 | 109.6° | 109.5° |
| C05 | C03 | H13 | 108.8° | 109.4° |
| O04 | C03 | C01 | 109.3° | 109.4° |
| O04 | C03 | H13 | 110.6° | 109.5° |
| C03 | O04 | H14 | 109.5° | 114.0° |
| C03 | C01 | O02 | 108.2° | 109.5° |
| C03 | C01 | H10 | 109.8° | 109.4° |
| C03 | C01 | H11 | 109.8° | 109.5° |
| C01 | C03 | H13 | 108.9° | 109.4° |
| O02 | C01 | H10 | 109.8° | 109.5° |
| O02 | C01 | H11 | 109.8° | 109.5° |
| C01 | O02 | H12 | 109.5° | 114.0° |
| H5 | C11 | H6 | 109.5° | 109.5° |
| H7 | C12 | H8 | 109.5° | 109.6° |
| H7 | C12 | H9 | 109.5° | 109.4° |
| H8 | C12 | H9 | 109.5° | 109.4° |
| H10 | C01 | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C08 | C07 | C06 | H2 | 180.0° | 179.9° |
| C07 | C08 | C09 | H3 | 180.0° | 180.0° |
| C08 | C07 | C06 | C05 | 0.1° | 0.0° |
| C07 | C08 | C09 | C11 | 180.0° | 180.0° |
| C07 | C08 | C09 | C10 | 0.1° | 0.1° |
| C08 | C07 | C06 | H1 | 179.9° | 179.9° |
| C06 | C07 | C08 | C09 | 0.0° | 0.0° |
| C07 | C06 | C05 | H1 | 180.0° | 179.9° |
| C07 | C06 | C05 | C10 | 0.1° | 0.0° |
| C07 | C06 | C05 | C03 | 180.0° | 179.8° |
| C06 | C07 | C08 | H3 | 180.0° | 180.0° |
| C08 | C09 | C11 | C10 | 179.9° | 179.9° |
| C08 | C09 | C11 | C12 | 96.6° | 90.0° |
| C08 | C09 | C10 | C05 | 0.1° | 0.1° |
| C09 | C08 | C07 | H2 | 180.0° | 180.0° |
| C08 | C09 | C10 | H4 | 179.9° | 179.7° |
| C08 | C09 | C11 | H5 | 23.8° | 150.0° |
| C08 | C09 | C11 | H6 | 143.0° | 30.0° |
| C06 | C05 | C10 | C09 | 0.0° | 0.0° |
| C06 | C05 | C10 | C03 | 180.0° | 179.7° |
| C06 | C05 | C03 | O04 | 61.4° | 34.7° |
| C06 | C05 | C03 | C01 | 58.5° | 85.3° |
| C05 | C06 | C07 | H2 | 179.9° | 179.9° |
| C06 | C05 | C10 | H4 | 180.0° | 179.7° |
| C06 | C05 | C03 | H13 | 177.5° | 154.7° |
| C09 | C11 | C12 | H5 | 120.5° | 120.0° |
| C09 | C11 | C12 | H6 | 120.4° | 120.0° |
| C11 | C09 | C10 | C05 | 180.0° | 180.0° |
| C11 | C09 | C08 | H3 | 0.0° | 0.0° |
| C11 | C09 | C10 | H4 | 0.0° | 0.3° |
| C09 | C11 | H5 | H6 | 118.6° | 120.0° |
| C09 | C11 | C12 | H7 | 180.0° | 179.9° |
| C09 | C11 | C12 | H8 | 60.0° | 59.9° |
| C09 | C11 | C12 | H9 | 60.0° | 60.0° |
| C10 | C09 | C11 | C12 | 83.5° | 90.1° |
| C09 | C10 | C05 | H4 | 180.0° | 179.6° |
| C09 | C10 | C05 | C03 | 180.0° | 179.7° |
| C10 | C09 | C08 | H3 | 179.9° | 179.9° |
| C10 | C09 | C11 | H5 | 156.1° | 29.9° |
| C10 | C09 | C11 | H6 | 36.9° | 150.0° |
| C12 | C11 | H5 | H6 | 118.6° | 120.0° |
| C11 | C12 | H7 | H8 | 120.0° | 120.1° |
| C11 | C12 | H7 | H9 | 120.0° | 119.9° |
| C11 | C12 | H8 | H9 | 120.0° | 119.9° |
| C10 | C05 | C03 | O04 | 118.6° | 145.0° |
| C10 | C05 | C03 | C01 | 121.4° | 95.0° |
| C10 | C05 | C06 | H1 | 179.9° | 179.9° |
| C10 | C05 | C03 | H13 | 2.5° | 25.0° |
| C05 | C03 | O04 | C01 | 120.1° | 120.0° |
| C05 | C03 | O04 | H13 | 120.0° | 120.0° |
| C05 | C03 | C01 | H13 | 118.9° | 120.0° |
| C05 | C03 | C01 | O02 | 138.3° | 175.0° |
| C03 | C05 | C06 | H1 | 0.0° | 0.3° |
| C03 | C05 | C10 | H4 | 0.0° | 0.1° |
| C05 | C03 | C01 | H10 | 18.5° | 55.0° |
| C05 | C03 | C01 | H11 | 101.9° | 65.0° |
| C05 | C03 | O04 | H14 | 180.0° | 60.0° |
| O04 | C03 | C01 | H13 | 121.0° | 120.0° |
| O04 | C03 | C01 | O02 | 18.2° | 65.0° |
| O04 | C03 | C01 | H10 | 101.6° | 175.0° |
| O04 | C03 | C01 | H11 | 138.0° | 55.0° |
| C03 | C01 | O02 | H10 | 119.8° | 120.0° |
| C03 | C01 | O02 | H11 | 119.8° | 120.0° |
| C03 | C01 | H10 | H11 | 120.6° | 120.0° |
| C03 | C01 | O02 | H12 | 180.0° | 180.0° |
| C01 | C03 | O04 | H14 | 59.9° | 60.0° |
| O02 | C01 | H10 | H11 | 120.6° | 120.0° |
| O02 | C01 | C03 | H13 | 102.8° | 55.0° |
| H1 | C06 | C07 | H2 | 0.1° | 0.0° |
| H2 | C07 | C08 | H3 | 0.0° | 0.1° |
| H5 | C11 | C12 | H7 | 59.5° | 59.9° |
| H5 | C11 | C12 | H8 | 179.5° | 179.9° |
| H5 | C11 | C12 | H9 | 60.5° | 60.0° |
| H6 | C11 | C12 | H7 | 59.6° | 60.1° |
| H6 | C11 | C12 | H8 | 60.4° | 60.0° |
| H6 | C11 | C12 | H9 | 179.6° | 180.0° |
| H7 | C12 | H8 | H9 | 120.0° | 120.0° |
| H10 | C01 | O02 | H12 | 60.1° | 60.0° |
| H10 | C01 | C03 | H13 | 137.4° | 65.0° |
| H11 | C01 | O02 | H12 | 60.2° | 60.0° |
| H11 | C01 | C03 | H13 | 17.0° | 175.0° |
| H13 | C03 | O04 | H14 | 60.0° | 180.0° |
