G62
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C04 | C05 | doub | 1.38Å | 1.39Å | Aromatic |
| C04 | C03 | sing | 1.38Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.39Å | 1.40Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C09 | C08 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C03 | C02 | doub | 1.39Å | 1.39Å | Aromatic |
| C08 | C06 | sing | 1.48Å | 1.48Å | |
| C08 | N13 | doub | 1.33Å | 1.35Å | Aromatic |
| C06 | C07 | doub | 1.39Å | 1.40Å | Aromatic |
| N13 | C12 | sing | 1.32Å | 1.35Å | Aromatic |
| C12 | C14 | sing | 1.51Å | 1.53Å | |
| C02 | C07 | sing | 1.39Å | 1.39Å | Aromatic |
| C02 | O01 | sing | 1.36Å | 1.36Å | |
| C15 | C14 | sing | 1.52Å | 1.52Å | |
| C15 | C16 | sing | 1.54Å | 1.49Å | |
| C14 | C20 | sing | 1.52Å | 1.55Å | |
| C14 | C16 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.50Å | |
| C19 | O18 | sing | 1.39Å | 1.42Å | |
| O18 | C17 | sing | 1.43Å | 1.43Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.08Å | 1.08Å | |
| C04 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C03 | H14 | sing | 1.08Å | 1.08Å | |
| C05 | H15 | sing | 1.08Å | 1.08Å | |
| O01 | H16 | sing | 0.97Å | 0.95Å | |
| C07 | H17 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C05 | C04 | C03 | 120.1° | 120.2° |
| C04 | C05 | C06 | 120.8° | 120.0° |
| C05 | C04 | H11 | 119.9° | 119.9° |
| C04 | C05 | H15 | 119.6° | 120.0° |
| C04 | C03 | C02 | 119.6° | 120.1° |
| C03 | C04 | H11 | 120.0° | 119.9° |
| C04 | C03 | H14 | 120.2° | 119.9° |
| C05 | C06 | C08 | 121.2° | 120.1° |
| C05 | C06 | C07 | 118.8° | 119.8° |
| C06 | C05 | H15 | 119.6° | 120.0° |
| C10 | C09 | C08 | 118.6° | 119.0° |
| C09 | C10 | C11 | 119.6° | 118.5° |
| C09 | C10 | H1 | 120.2° | 120.7° |
| C10 | C09 | H10 | 120.7° | 120.5° |
| C09 | C08 | C06 | 122.2° | 119.7° |
| C09 | C08 | N13 | 122.3° | 120.5° |
| C08 | C09 | H10 | 120.7° | 120.5° |
| C10 | C11 | C12 | 118.4° | 119.3° |
| C11 | C10 | H1 | 120.2° | 120.7° |
| C10 | C11 | H8 | 120.8° | 120.3° |
| C11 | C12 | N13 | 122.5° | 120.9° |
| C11 | C12 | C14 | 120.0° | 119.5° |
| C12 | C11 | H8 | 120.8° | 120.3° |
| C03 | C02 | C07 | 120.4° | 120.1° |
| C03 | C02 | O01 | 121.7° | 119.9° |
| C02 | C03 | H14 | 120.2° | 120.0° |
| C06 | C08 | N13 | 115.5° | 119.7° |
| C08 | C06 | C07 | 119.7° | 120.1° |
| C08 | N13 | C12 | 118.3° | 121.6° |
| C06 | C07 | C02 | 120.3° | 119.8° |
| C06 | C07 | H17 | 119.8° | 120.1° |
| N13 | C12 | C14 | 116.9° | 119.6° |
| C12 | C14 | C15 | 118.0° | 116.7° |
| C12 | C14 | C20 | 111.9° | 115.1° |
| C12 | C14 | C16 | 122.2° | 116.6° |
| C07 | C02 | O01 | 117.8° | 120.0° |
| C02 | C07 | H17 | 119.8° | 120.1° |
| C02 | O01 | H16 | 109.5° | 114.0° |
| C14 | C15 | C16 | 60.7° | 59.8° |
| C15 | C14 | C20 | 118.8° | 119.4° |
| C15 | C14 | C16 | 59.0° | 60.5° |
| C14 | C15 | H2 | 119.9° | 117.5° |
| C14 | C15 | H3 | 119.9° | 117.5° |
| C15 | C16 | C14 | 60.3° | 59.7° |
| C15 | C16 | C17 | 118.4° | 116.0° |
| C16 | C15 | H2 | 119.9° | 117.5° |
| C16 | C15 | H3 | 119.9° | 117.5° |
| C15 | C16 | H9 | 116.3° | 117.5° |
| C20 | C14 | C16 | 117.6° | 117.8° |
| C14 | C20 | C19 | 112.9° | 109.8° |
| C14 | C20 | H6 | 108.6° | 109.1° |
| C14 | C20 | H7 | 108.6° | 109.7° |
| C14 | C16 | C17 | 118.4° | 119.3° |
| C14 | C16 | H9 | 115.8° | 117.3° |
| C20 | C19 | O18 | 112.2° | 109.4° |
| C19 | C20 | H6 | 108.6° | 109.4° |
| C19 | C20 | H7 | 108.6° | 109.4° |
| C20 | C19 | H12 | 108.8° | 109.6° |
| C20 | C19 | H13 | 108.8° | 109.6° |
| C16 | C17 | O18 | 109.5° | 109.9° |
| C16 | C17 | H4 | 109.5° | 109.4° |
| C16 | C17 | H5 | 109.5° | 109.4° |
| C17 | C16 | H9 | 116.1° | 115.6° |
| C19 | O18 | C17 | 109.9° | 113.2° |
| O18 | C19 | H12 | 108.8° | 109.3° |
| O18 | C19 | H13 | 108.8° | 109.2° |
| O18 | C17 | H4 | 109.5° | 109.4° |
| O18 | C17 | H5 | 109.4° | 109.3° |
| H2 | C15 | H3 | 109.5° | 115.6° |
| H4 | C17 | H5 | 109.5° | 109.4° |
| H6 | C20 | H7 | 109.5° | 109.4° |
| H12 | C19 | H13 | 109.5° | 109.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C05 | C04 | C03 | H11 | 180.0° | 179.9° |
| C04 | C05 | C06 | H15 | 180.0° | 180.0° |
| C05 | C04 | C03 | C02 | 1.2° | 0.1° |
| C04 | C05 | C06 | C08 | 174.2° | 179.7° |
| C04 | C05 | C06 | C07 | 0.9° | 0.0° |
| C05 | C04 | C03 | H14 | 178.8° | 180.0° |
| C03 | C04 | C05 | C06 | 1.4° | 0.1° |
| C04 | C03 | C02 | H14 | 180.0° | 180.0° |
| C04 | C03 | C02 | C07 | 0.5° | 0.1° |
| C04 | C03 | C02 | O01 | 177.7° | 180.0° |
| C03 | C04 | C05 | H15 | 178.6° | 180.0° |
| C05 | C06 | C08 | C09 | 23.4° | 174.8° |
| C05 | C06 | C08 | C07 | 173.3° | 179.7° |
| C05 | C06 | C08 | N13 | 155.5° | 5.9° |
| C05 | C06 | C07 | C02 | 0.2° | 0.0° |
| C06 | C05 | C04 | H11 | 178.6° | 180.0° |
| C05 | C06 | C07 | H17 | 179.9° | 180.0° |
| C10 | C09 | C08 | H10 | 180.0° | 179.9° |
| C09 | C10 | C11 | H1 | 180.0° | 179.8° |
| C09 | C10 | C11 | C12 | 6.0° | 0.3° |
| C10 | C09 | C08 | C06 | 179.7° | 180.0° |
| C10 | C09 | C08 | N13 | 1.4° | 0.6° |
| C09 | C10 | C11 | H8 | 174.0° | 179.8° |
| C08 | C09 | C10 | C11 | 3.7° | 0.0° |
| C09 | C08 | C06 | N13 | 179.0° | 179.4° |
| C09 | C08 | C06 | C07 | 163.3° | 5.0° |
| C09 | C08 | N13 | C12 | 1.5° | 0.9° |
| C08 | C09 | C10 | H1 | 176.3° | 179.7° |
| C10 | C11 | C12 | H8 | 180.0° | 179.9° |
| C10 | C11 | C12 | N13 | 6.2° | 0.0° |
| C10 | C11 | C12 | C14 | 176.9° | 180.0° |
| C11 | C10 | C09 | H10 | 176.3° | 180.0° |
| C11 | C12 | N13 | C08 | 3.9° | 0.6° |
| C11 | C12 | N13 | C14 | 170.9° | 180.0° |
| C11 | C12 | C14 | C15 | 123.8° | 96.4° |
| C11 | C12 | C14 | C20 | 19.5° | 51.0° |
| C11 | C12 | C14 | C16 | 167.0° | 164.9° |
| C12 | C11 | C10 | H1 | 174.0° | 180.0° |
| C03 | C02 | C07 | C06 | 0.0° | 0.0° |
| C03 | C02 | C07 | O01 | 178.3° | 180.0° |
| C02 | C03 | C04 | H11 | 178.8° | 180.0° |
| C03 | C02 | O01 | H16 | 180.0° | 90.1° |
| C03 | C02 | C07 | H17 | 179.9° | 180.0° |
| C06 | C08 | N13 | C12 | 179.6° | 179.7° |
| C08 | C06 | C07 | C02 | 173.6° | 179.7° |
| C06 | C08 | C09 | H10 | 0.3° | 0.1° |
| C08 | C06 | C05 | H15 | 5.8° | 0.3° |
| C08 | C06 | C07 | H17 | 6.5° | 0.3° |
| N13 | C08 | C06 | C07 | 17.7° | 174.4° |
| C08 | N13 | C12 | C14 | 174.8° | 179.4° |
| N13 | C08 | C09 | H10 | 178.6° | 179.4° |
| C06 | C07 | C02 | H17 | 180.0° | 180.0° |
| C06 | C07 | C02 | O01 | 178.3° | 180.0° |
| C07 | C06 | C05 | H15 | 179.1° | 180.0° |
| N13 | C12 | C14 | C15 | 47.4° | 83.6° |
| N13 | C12 | C14 | C20 | 169.3° | 129.0° |
| N13 | C12 | C14 | C16 | 21.8° | 15.0° |
| N13 | C12 | C11 | H8 | 173.8° | 179.9° |
| C12 | C14 | C15 | C20 | 140.7° | 145.9° |
| C12 | C14 | C15 | C16 | 112.6° | 106.9° |
| C12 | C14 | C20 | C16 | 149.2° | 143.6° |
| C12 | C14 | C20 | C19 | 147.7° | 164.3° |
| C12 | C14 | C16 | C17 | 146.1° | 148.3° |
| C12 | C14 | C15 | H2 | 137.7° | 0.5° |
| C12 | C14 | C15 | H3 | 3.0° | 145.6° |
| C12 | C14 | C20 | H6 | 27.2° | 75.8° |
| C12 | C14 | C20 | H7 | 91.8° | 44.0° |
| C14 | C12 | C11 | H8 | 3.1° | 0.1° |
| C12 | C14 | C16 | H9 | 1.3° | 0.4° |
| C07 | C02 | C03 | H14 | 179.5° | 180.0° |
| C07 | C02 | O01 | H16 | 1.7° | 90.0° |
| O01 | C02 | C03 | H14 | 2.3° | 0.0° |
| O01 | C02 | C07 | H17 | 1.7° | 0.0° |
| C14 | C15 | C16 | H2 | 109.6° | 107.5° |
| C14 | C15 | C16 | H3 | 109.7° | 107.4° |
| C15 | C14 | C20 | C16 | 67.9° | 70.0° |
| C15 | C14 | C20 | C19 | 69.4° | 49.3° |
| C14 | C15 | C16 | C17 | 108.3° | 110.3° |
| C14 | C15 | H2 | H3 | 144.3° | 145.8° |
| C15 | C14 | C20 | H6 | 170.1° | 70.6° |
| C15 | C14 | C20 | H7 | 51.1° | 169.6° |
| C14 | C15 | C16 | H9 | 106.1° | 107.2° |
| C15 | C16 | C17 | H9 | 145.6° | 143.3° |
| C15 | C16 | C17 | O18 | 39.1° | 87.8° |
| C16 | C15 | H2 | H3 | 144.4° | 145.8° |
| C15 | C16 | C17 | H4 | 80.9° | 32.3° |
| C15 | C16 | C17 | H5 | 159.1° | 152.1° |
| C14 | C20 | C19 | H6 | 120.5° | 119.7° |
| C14 | C20 | C19 | H7 | 120.5° | 120.4° |
| C20 | C14 | C16 | C17 | 0.3° | 5.2° |
| C14 | C20 | C19 | O18 | 35.1° | 53.8° |
| C20 | C14 | C15 | H2 | 3.0° | 145.4° |
| C20 | C14 | C15 | H3 | 143.7° | 0.3° |
| C14 | C20 | H6 | H7 | 118.4° | 120.0° |
| C20 | C14 | C16 | H9 | 144.5° | 142.7° |
| C14 | C20 | C19 | H12 | 85.3° | 173.5° |
| C14 | C20 | C19 | H13 | 155.5° | 66.0° |
| C16 | C14 | C20 | C19 | 1.5° | 20.7° |
| C14 | C16 | C17 | H9 | 144.7° | 148.4° |
| C14 | C16 | C17 | O18 | 30.6° | 19.6° |
| C14 | C16 | C17 | H4 | 150.6° | 100.6° |
| C14 | C16 | C17 | H5 | 89.4° | 139.6° |
| C16 | C14 | C20 | H6 | 122.0° | 140.6° |
| C16 | C14 | C20 | H7 | 119.0° | 99.6° |
| C20 | C19 | O18 | H12 | 120.4° | 120.0° |
| C20 | C19 | O18 | H13 | 120.4° | 120.0° |
| C20 | C19 | O18 | C17 | 70.8° | 75.9° |
| C19 | C20 | H6 | H7 | 118.5° | 119.8° |
| C20 | C19 | H12 | H13 | 118.7° | 120.4° |
| C16 | C17 | O18 | C19 | 66.5° | 55.5° |
| C16 | C17 | O18 | H4 | 120.0° | 120.2° |
| C16 | C17 | O18 | H5 | 120.0° | 120.1° |
| C17 | C16 | C15 | H2 | 1.3° | 142.3° |
| C17 | C16 | C15 | H3 | 142.0° | 2.8° |
| C16 | C17 | H4 | H5 | 120.0° | 119.8° |
| C19 | O18 | C17 | H4 | 173.5° | 64.6° |
| C19 | O18 | C17 | H5 | 53.5° | 175.6° |
| O18 | C19 | C20 | H6 | 155.6° | 173.5° |
| O18 | C19 | C20 | H7 | 85.4° | 66.7° |
| O18 | C19 | H12 | H13 | 118.7° | 119.7° |
| O18 | C17 | H4 | H5 | 120.0° | 119.7° |
| O18 | C17 | C16 | H9 | 175.3° | 128.9° |
| C17 | O18 | C19 | H12 | 49.7° | 164.1° |
| C17 | O18 | C19 | H13 | 168.8° | 44.0° |
| H1 | C10 | C11 | H8 | 6.0° | 0.0° |
| H1 | C10 | C09 | H10 | 3.7° | 0.2° |
| H2 | C15 | C16 | H9 | 144.3° | 0.3° |
| H3 | C15 | C16 | H9 | 3.6° | 145.4° |
| H4 | C17 | C16 | H9 | 64.7° | 111.0° |
| H5 | C17 | C16 | H9 | 55.3° | 8.8° |
| H6 | C20 | C19 | H12 | 35.2° | 66.8° |
| H6 | C20 | C19 | H13 | 84.0° | 53.8° |
| H7 | C20 | C19 | H12 | 154.1° | 53.1° |
| H7 | C20 | C19 | H13 | 35.0° | 173.6° |
| H11 | C04 | C03 | H14 | 1.2° | 0.0° |
| H11 | C04 | C05 | H15 | 1.4° | 0.0° |
