G6O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C4 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C2 | sing | 1.39Å | 1.38Å | Aromatic |
| C12 | N | sing | 1.47Å | 1.48Å | |
| O1 | C2 | sing | 1.36Å | 1.38Å | |
| O1 | C8 | sing | 1.43Å | 1.43Å | |
| C6 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | N | sing | 1.47Å | 1.50Å | |
| C9 | C7 | sing | 1.53Å | 1.54Å | |
| C5 | O3 | sing | 1.36Å | 1.36Å | |
| C5 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| N | C11 | sing | 1.47Å | 1.49Å | |
| C1 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C7 | sing | 1.50Å | 1.51Å | |
| C7 | O2 | sing | 1.42Å | 1.43Å | |
| O2 | C10 | sing | 1.43Å | 1.44Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| O3 | H19 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C13 | C12 | 110.2° | 109.5° |
| C14 | C13 | H14 | 109.3° | 109.4° |
| C14 | C13 | H15 | 109.3° | 109.5° |
| C13 | C14 | H16 | 109.5° | 109.4° |
| C13 | C14 | H17 | 109.4° | 109.5° |
| C13 | C14 | H18 | 109.5° | 109.5° |
| C13 | C12 | N | 115.3° | 109.5° |
| C13 | C12 | H12 | 108.0° | 109.5° |
| C13 | C12 | H13 | 108.0° | 109.4° |
| C12 | C13 | H14 | 109.3° | 109.5° |
| C12 | C13 | H15 | 109.3° | 109.5° |
| C6 | C4 | C2 | 119.8° | 120.4° |
| C4 | C6 | C5 | 120.2° | 120.0° |
| C6 | C4 | H2 | 120.1° | 119.8° |
| C4 | C6 | H3 | 119.9° | 120.0° |
| C4 | C2 | O1 | 120.1° | 118.3° |
| C4 | C2 | C1 | 120.0° | 119.5° |
| C2 | C4 | H2 | 120.1° | 119.8° |
| C12 | N | C9 | 107.1° | 111.0° |
| C12 | N | C11 | 111.7° | 111.0° |
| N | C12 | H12 | 108.0° | 109.5° |
| N | C12 | H13 | 108.0° | 109.4° |
| C2 | O1 | C8 | 123.7° | 119.0° |
| O1 | C2 | C1 | 119.9° | 122.2° |
| O1 | C8 | C9 | 109.3° | 107.9° |
| O1 | C8 | H5 | 109.5° | 109.8° |
| O1 | C8 | H6 | 109.5° | 109.8° |
| C6 | C5 | O3 | 120.3° | 120.1° |
| C6 | C5 | C3 | 120.1° | 119.7° |
| C5 | C6 | H3 | 119.9° | 120.0° |
| C2 | C1 | C3 | 120.2° | 120.1° |
| C2 | C1 | C7 | 118.9° | 120.3° |
| C8 | C9 | N | 113.8° | 112.2° |
| C8 | C9 | C7 | 106.4° | 108.0° |
| C9 | C8 | H5 | 109.5° | 109.8° |
| C9 | C8 | H6 | 109.5° | 109.8° |
| C8 | C9 | H7 | 107.1° | 109.4° |
| N | C9 | C7 | 114.6° | 108.5° |
| C9 | N | C11 | 116.6° | 109.6° |
| N | C9 | H7 | 107.5° | 109.4° |
| C9 | C7 | C1 | 109.0° | 109.1° |
| C9 | C7 | O2 | 108.2° | 108.6° |
| C9 | C7 | H4 | 108.2° | 108.4° |
| C7 | C9 | H7 | 106.9° | 109.2° |
| O3 | C5 | C3 | 119.6° | 120.2° |
| C5 | O3 | H19 | 109.5° | 114.0° |
| C5 | C3 | C1 | 119.7° | 120.3° |
| C5 | C3 | H1 | 120.2° | 119.8° |
| N | C11 | C10 | 112.3° | 110.2° |
| N | C11 | H10 | 108.8° | 109.3° |
| N | C11 | H11 | 108.7° | 109.3° |
| C3 | C1 | C7 | 120.9° | 119.7° |
| C1 | C3 | H1 | 120.2° | 119.8° |
| C1 | C7 | O2 | 112.8° | 112.8° |
| C1 | C7 | H4 | 108.7° | 109.0° |
| C7 | O2 | C10 | 116.6° | 112.5° |
| O2 | C7 | H4 | 109.8° | 108.9° |
| O2 | C10 | C11 | 116.5° | 110.2° |
| O2 | C10 | H8 | 107.7° | 109.4° |
| O2 | C10 | H9 | 107.7° | 109.3° |
| C11 | C10 | H8 | 107.7° | 109.3° |
| C11 | C10 | H9 | 107.7° | 109.3° |
| C10 | C11 | H10 | 108.7° | 109.4° |
| C10 | C11 | H11 | 108.8° | 109.4° |
| H5 | C8 | H6 | 109.5° | 109.7° |
| H8 | C10 | H9 | 109.5° | 109.4° |
| H10 | C11 | H11 | 109.5° | 109.3° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H14 | C13 | H15 | 109.5° | 109.4° |
| H16 | C14 | H17 | 109.5° | 109.4° |
| H16 | C14 | H18 | 109.5° | 109.5° |
| H17 | C14 | H18 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C13 | C12 | H14 | 120.1° | 120.0° |
| C14 | C13 | C12 | H15 | 120.1° | 120.1° |
| C14 | C13 | C12 | N | 174.2° | 180.0° |
| C14 | C13 | C12 | H12 | 53.4° | 59.9° |
| C14 | C13 | C12 | H13 | 65.0° | 60.1° |
| C14 | C13 | H14 | H15 | 119.7° | 120.0° |
| C13 | C14 | H16 | H17 | 120.0° | 120.0° |
| C13 | C14 | H16 | H18 | 120.0° | 120.1° |
| C13 | C14 | H17 | H18 | 120.0° | 120.1° |
| C13 | C12 | N | H12 | 120.8° | 120.1° |
| C13 | C12 | N | H13 | 120.8° | 119.9° |
| C13 | C12 | N | C9 | 90.8° | 170.1° |
| C13 | C12 | N | C11 | 140.4° | 67.8° |
| C13 | C12 | H12 | H13 | 117.4° | 120.0° |
| C12 | C13 | H14 | H15 | 119.7° | 120.0° |
| C12 | C13 | C14 | H16 | 180.0° | 60.0° |
| C12 | C13 | C14 | H17 | 60.0° | 59.9° |
| C12 | C13 | C14 | H18 | 60.0° | 180.0° |
| C6 | C4 | C2 | H2 | 180.0° | 180.0° |
| C6 | C4 | C2 | O1 | 180.0° | 179.0° |
| C4 | C6 | C5 | H3 | 180.0° | 179.9° |
| C6 | C4 | C2 | C1 | 0.0° | 0.4° |
| C4 | C6 | C5 | O3 | 180.0° | 179.8° |
| C4 | C6 | C5 | C3 | 0.1° | 0.2° |
| C4 | C2 | O1 | C1 | 180.0° | 179.4° |
| C4 | C2 | O1 | C8 | 178.4° | 167.2° |
| C2 | C4 | C6 | C5 | 0.1° | 0.1° |
| C4 | C2 | C1 | C3 | 0.2° | 0.5° |
| C4 | C2 | C1 | C7 | 179.8° | 179.2° |
| C2 | C4 | C6 | H3 | 179.9° | 180.0° |
| C12 | N | C9 | C8 | 108.9° | 57.1° |
| C12 | N | C9 | C11 | 125.9° | 123.0° |
| C12 | N | C9 | C7 | 128.3° | 176.4° |
| C12 | N | C11 | C10 | 86.6° | 179.7° |
| C12 | N | C9 | H7 | 9.5° | 64.6° |
| C12 | N | C11 | H10 | 33.8° | 59.4° |
| C12 | N | C11 | H11 | 152.9° | 60.1° |
| N | C12 | H12 | H13 | 117.3° | 120.0° |
| N | C12 | C13 | H14 | 65.7° | 60.0° |
| N | C12 | C13 | H15 | 54.1° | 59.9° |
| C2 | O1 | C8 | C9 | 29.3° | 45.0° |
| O1 | C2 | C1 | C3 | 179.8° | 178.9° |
| O1 | C2 | C1 | C7 | 0.3° | 1.4° |
| O1 | C2 | C4 | H2 | 0.0° | 1.0° |
| C2 | O1 | C8 | H5 | 149.3° | 74.7° |
| C2 | O1 | C8 | H6 | 90.6° | 164.6° |
| C8 | O1 | C2 | C1 | 1.6° | 13.3° |
| O1 | C8 | C9 | H5 | 120.0° | 119.6° |
| O1 | C8 | C9 | H6 | 119.9° | 119.6° |
| O1 | C8 | C9 | N | 173.8° | 175.6° |
| O1 | C8 | C9 | C7 | 59.0° | 64.8° |
| O1 | C8 | H5 | H6 | 120.1° | 120.7° |
| O1 | C8 | C9 | H7 | 55.2° | 54.0° |
| C6 | C5 | O3 | C3 | 179.9° | 179.9° |
| C6 | C5 | C3 | C1 | 0.1° | 0.1° |
| C6 | C5 | C3 | H1 | 180.0° | 179.9° |
| C5 | C6 | C4 | H2 | 179.9° | 179.9° |
| C6 | C5 | O3 | H19 | 180.0° | 90.0° |
| C2 | C1 | C7 | C9 | 32.3° | 22.8° |
| C2 | C1 | C3 | C5 | 0.2° | 0.3° |
| C2 | C1 | C3 | C7 | 179.5° | 179.7° |
| C2 | C1 | C7 | O2 | 152.6° | 143.5° |
| C2 | C1 | C3 | H1 | 179.8° | 179.8° |
| C1 | C2 | C4 | H2 | 180.0° | 179.6° |
| C2 | C1 | C7 | H4 | 85.5° | 95.4° |
| C8 | C9 | N | C7 | 122.8° | 119.2° |
| C8 | C9 | N | H7 | 118.5° | 121.7° |
| C8 | C9 | C7 | H7 | 114.3° | 118.9° |
| C8 | C9 | N | C11 | 125.2° | 179.9° |
| C8 | C9 | C7 | C1 | 60.7° | 53.2° |
| C8 | C9 | C7 | O2 | 176.3° | 176.5° |
| C8 | C9 | C7 | H4 | 57.4° | 65.4° |
| C9 | C8 | H5 | H6 | 120.1° | 120.7° |
| N | C9 | C7 | H7 | 119.0° | 119.2° |
| N | C9 | C7 | C1 | 172.6° | 175.1° |
| N | C9 | C7 | O2 | 49.6° | 61.6° |
| C9 | N | C11 | C10 | 37.0° | 57.4° |
| N | C9 | C7 | H4 | 69.3° | 56.5° |
| N | C9 | C8 | H5 | 53.9° | 64.7° |
| N | C9 | C8 | H6 | 66.2° | 56.0° |
| C9 | N | C11 | H10 | 157.4° | 177.7° |
| C9 | N | C11 | H11 | 83.5° | 62.8° |
| C9 | N | C12 | H12 | 30.0° | 50.0° |
| C9 | N | C12 | H13 | 148.4° | 70.0° |
| C7 | C9 | N | C11 | 2.4° | 60.7° |
| C9 | C7 | C1 | C3 | 148.1° | 157.5° |
| C9 | C7 | C1 | O2 | 120.2° | 120.7° |
| C9 | C7 | C1 | H4 | 117.8° | 118.2° |
| C9 | C7 | O2 | H4 | 117.9° | 117.8° |
| C9 | C7 | O2 | C10 | 57.7° | 60.8° |
| C7 | C9 | C8 | H5 | 178.9° | 54.8° |
| C7 | C9 | C8 | H6 | 61.0° | 175.5° |
| O3 | C5 | C3 | C1 | 179.8° | 179.9° |
| O3 | C5 | C3 | H1 | 0.1° | 0.2° |
| O3 | C5 | C6 | H3 | 0.0° | 0.3° |
| C5 | C3 | C1 | H1 | 180.0° | 180.0° |
| C5 | C3 | C1 | C7 | 179.8° | 179.4° |
| C3 | C5 | C6 | H3 | 179.9° | 179.8° |
| C3 | C5 | O3 | H19 | 0.1° | 90.0° |
| N | C11 | C10 | O2 | 30.9° | 54.6° |
| N | C11 | C10 | H10 | 120.4° | 120.2° |
| N | C11 | C10 | H11 | 120.4° | 120.1° |
| C11 | N | C9 | H7 | 116.4° | 58.4° |
| N | C11 | C10 | H8 | 151.9° | 174.8° |
| N | C11 | C10 | H9 | 90.1° | 65.6° |
| N | C11 | H10 | H11 | 118.7° | 119.5° |
| C11 | N | C12 | H12 | 98.8° | 172.1° |
| C11 | N | C12 | H13 | 19.6° | 52.1° |
| C3 | C1 | C7 | O2 | 27.9° | 36.8° |
| C3 | C1 | C7 | H4 | 94.1° | 84.3° |
| C1 | C7 | O2 | H4 | 121.4° | 121.1° |
| C1 | C7 | O2 | C10 | 178.4° | 178.1° |
| C7 | C1 | C3 | H1 | 0.3° | 0.5° |
| C1 | C7 | C9 | H7 | 53.6° | 65.7° |
| C7 | O2 | C10 | C11 | 17.9° | 57.5° |
| O2 | C7 | C9 | H7 | 69.5° | 57.6° |
| C7 | O2 | C10 | H8 | 103.1° | 177.6° |
| C7 | O2 | C10 | H9 | 139.0° | 62.7° |
| O2 | C10 | C11 | H8 | 121.0° | 120.2° |
| O2 | C10 | C11 | H9 | 121.0° | 120.1° |
| C10 | O2 | C7 | H4 | 60.2° | 57.0° |
| O2 | C10 | H8 | H9 | 116.8° | 119.6° |
| O2 | C10 | C11 | H10 | 151.3° | 174.8° |
| O2 | C10 | C11 | H11 | 89.5° | 65.6° |
| C11 | C10 | H8 | H9 | 116.8° | 119.6° |
| C10 | C11 | H10 | H11 | 118.7° | 119.7° |
| H2 | C4 | C6 | H3 | 0.1° | 0.0° |
| H4 | C7 | C9 | H7 | 171.7° | 175.7° |
| H5 | C8 | C9 | H7 | 64.8° | 173.6° |
| H6 | C8 | C9 | H7 | 175.1° | 65.7° |
| H8 | C10 | C11 | H10 | 87.6° | 65.0° |
| H8 | C10 | C11 | H11 | 31.5° | 54.6° |
| H9 | C10 | C11 | H10 | 30.3° | 54.7° |
| H9 | C10 | C11 | H11 | 149.5° | 174.3° |
| H12 | C12 | C13 | H14 | 173.5° | 60.0° |
| H12 | C12 | C13 | H15 | 66.8° | 180.0° |
| H13 | C12 | C13 | H14 | 55.1° | 179.9° |
| H13 | C12 | C13 | H15 | 174.9° | 60.0° |
| H14 | C13 | C14 | H16 | 59.9° | 180.0° |
| H14 | C13 | C14 | H17 | 60.1° | 60.1° |
| H14 | C13 | C14 | H18 | 179.9° | 60.0° |
| H15 | C13 | C14 | H16 | 59.9° | 60.1° |
| H15 | C13 | C14 | H17 | 179.9° | NaN° |
| H15 | C13 | C14 | H18 | 60.1° | 59.9° |
| H16 | C14 | H17 | H18 | 120.0° | 120.0° |
