G1H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F29 | C7 | sing | 1.40Å | 1.32Å | |
| F28 | C7 | sing | 1.40Å | 1.31Å | |
| O15 | C14 | doub | 1.22Å | 1.25Å | |
| C7 | F27 | sing | 1.40Å | 1.32Å | |
| C7 | C6 | sing | 1.51Å | 1.50Å | |
| C5 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | C4 | sing | 1.48Å | 1.49Å | |
| C14 | N13 | sing | 1.34Å | 1.37Å | |
| C6 | C1 | sing | 1.39Å | 1.40Å | Aromatic |
| C4 | C3 | doub | 1.40Å | 1.39Å | Aromatic |
| N13 | C12 | doub | 1.31Å | 1.36Å | |
| C1 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | O11 | sing | 1.35Å | 1.37Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C12 | O11 | sing | 1.34Å | 1.38Å | |
| C12 | N16 | sing | 1.36Å | 1.40Å | |
| C2 | N8 | sing | 1.48Å | 1.42Å | |
| C21 | N16 | sing | 1.47Å | 1.46Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| N16 | C17 | sing | 1.47Å | 1.49Å | |
| N8 | O9 | doub | 1.22Å | 1.41Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C23 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| N8 | OXT | sing | 1.22Å | 1.73Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F29 | C7 | F28 | 107.0° | 109.5° |
| F29 | C7 | F27 | 108.9° | 109.5° |
| F29 | C7 | C6 | 107.9° | 109.5° |
| F28 | C7 | F27 | 111.8° | 109.5° |
| F28 | C7 | C6 | 110.7° | 109.4° |
| O15 | C14 | C4 | 118.1° | 121.2° |
| O15 | C14 | N13 | 121.9° | 121.1° |
| F27 | C7 | C6 | 110.5° | 109.5° |
| C7 | C6 | C5 | 119.5° | 119.8° |
| C7 | C6 | C1 | 120.3° | 119.8° |
| C6 | C5 | C4 | 119.0° | 119.4° |
| C5 | C6 | C1 | 120.1° | 120.4° |
| C6 | C5 | H2 | 120.5° | 120.3° |
| C5 | C4 | C14 | 122.0° | 121.9° |
| C5 | C4 | C3 | 120.7° | 120.2° |
| C4 | C5 | H2 | 120.5° | 120.3° |
| C4 | C14 | N13 | 120.0° | 117.8° |
| C14 | C4 | C3 | 117.3° | 117.9° |
| C14 | N13 | C12 | 119.8° | 121.1° |
| C6 | C1 | C2 | 120.3° | 120.7° |
| C6 | C1 | H1 | 119.8° | 119.7° |
| C4 | C3 | C2 | 120.8° | 119.6° |
| C4 | C3 | O11 | 119.7° | 118.7° |
| N13 | C12 | O11 | 120.9° | 123.4° |
| N13 | C12 | N16 | 123.6° | 118.3° |
| C1 | C2 | C3 | 119.0° | 119.8° |
| C1 | C2 | N8 | 121.4° | 120.1° |
| C2 | C1 | H1 | 119.9° | 119.7° |
| C2 | C3 | O11 | 119.5° | 121.7° |
| C3 | C2 | N8 | 119.6° | 120.1° |
| C3 | O11 | C12 | 122.2° | 121.0° |
| C22 | C21 | N16 | 109.2° | 109.6° |
| C22 | C21 | C20 | 110.2° | 109.6° |
| C22 | C21 | H5 | 109.7° | 109.8° |
| C21 | C22 | H6 | 109.5° | 109.5° |
| C21 | C22 | H7 | 109.4° | 109.5° |
| C21 | C22 | H8 | 109.5° | 109.4° |
| O11 | C12 | N16 | 115.4° | 118.3° |
| C12 | N16 | C21 | 121.4° | 120.6° |
| C12 | N16 | C17 | 114.2° | 120.6° |
| C2 | N8 | O9 | 123.2° | 120.0° |
| C2 | N8 | OXT | 122.0° | 120.0° |
| N16 | C21 | C20 | 107.4° | 108.8° |
| C21 | N16 | C17 | 124.3° | 118.7° |
| N16 | C21 | H5 | 110.6° | 109.6° |
| C21 | C20 | C19 | 111.1° | 109.3° |
| C20 | C21 | H5 | 109.7° | 109.6° |
| C21 | C20 | H9 | 109.1° | 109.5° |
| C21 | C20 | H10 | 109.1° | 109.5° |
| N16 | C17 | C23 | 112.8° | 109.6° |
| N16 | C17 | C18 | 112.0° | 109.0° |
| N16 | C17 | H15 | 107.4° | 109.6° |
| O9 | N8 | OXT | 106.2° | 120.0° |
| C20 | C19 | C18 | 111.4° | 109.6° |
| C19 | C20 | H9 | 109.1° | 109.5° |
| C19 | C20 | H10 | 109.1° | 109.5° |
| C20 | C19 | H11 | 109.0° | 109.5° |
| C20 | C19 | H12 | 109.0° | 109.5° |
| C23 | C17 | C18 | 110.5° | 109.5° |
| C23 | C17 | H15 | 106.9° | 109.7° |
| C17 | C23 | H16 | 109.5° | 109.4° |
| C17 | C23 | H17 | 109.4° | 109.5° |
| C17 | C23 | H18 | 109.5° | 109.4° |
| C17 | C18 | C19 | 111.3° | 109.4° |
| C17 | C18 | H13 | 109.0° | 109.6° |
| C17 | C18 | H14 | 109.0° | 109.3° |
| C18 | C17 | H15 | 106.9° | 109.4° |
| C18 | C19 | H11 | 109.0° | 109.4° |
| C18 | C19 | H12 | 109.0° | 109.4° |
| C19 | C18 | H13 | 109.0° | 109.5° |
| C19 | C18 | H14 | 109.0° | 109.5° |
| H6 | C22 | H7 | 109.4° | 109.5° |
| H6 | C22 | H8 | 109.5° | 109.5° |
| H7 | C22 | H8 | 109.5° | 109.4° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H11 | C19 | H12 | 109.5° | 109.4° |
| H13 | C18 | H14 | 109.5° | 109.4° |
| H16 | C23 | H17 | 109.5° | 109.5° |
| H16 | C23 | H18 | 109.4° | 109.5° |
| H17 | C23 | H18 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F29 | C7 | F28 | F27 | 119.1° | 120.0° |
| F29 | C7 | F28 | C6 | 117.3° | 120.0° |
| F29 | C7 | F27 | C6 | 118.3° | 120.0° |
| F29 | C7 | C6 | C5 | 63.6° | 150.0° |
| F29 | C7 | C6 | C1 | 114.8° | 29.5° |
| F28 | C7 | F27 | C6 | 123.8° | 120.0° |
| F28 | C7 | C6 | C5 | 53.2° | 30.0° |
| F28 | C7 | C6 | C1 | 128.4° | 149.5° |
| O15 | C14 | C4 | C5 | 0.2° | 0.1° |
| O15 | C14 | C4 | N13 | 179.4° | 179.8° |
| O15 | C14 | C4 | C3 | 180.0° | 179.7° |
| O15 | C14 | N13 | C12 | 179.4° | 179.7° |
| F27 | C7 | C6 | C5 | 177.5° | 90.0° |
| F27 | C7 | C6 | C1 | 4.1° | 90.5° |
| C7 | C6 | C5 | C1 | 178.4° | 179.5° |
| C7 | C6 | C5 | C4 | 179.4° | 180.0° |
| C7 | C6 | C1 | C2 | 179.5° | 180.0° |
| C7 | C6 | C1 | H1 | 0.6° | 0.3° |
| C7 | C6 | C5 | H2 | 0.5° | 0.6° |
| C6 | C5 | C4 | H2 | 180.0° | 179.4° |
| C6 | C5 | C4 | C14 | 179.4° | 180.0° |
| C6 | C5 | C4 | C3 | 0.8° | 0.3° |
| C5 | C6 | C1 | C2 | 1.1° | 0.5° |
| C5 | C6 | C1 | H1 | 179.0° | 179.8° |
| C5 | C4 | C14 | C3 | 179.8° | 179.6° |
| C5 | C4 | C14 | N13 | 179.3° | 179.8° |
| C4 | C5 | C6 | C1 | 1.0° | 0.6° |
| C5 | C4 | C3 | C2 | 0.5° | 0.1° |
| C5 | C4 | C3 | O11 | 179.6° | 179.9° |
| C4 | C14 | N13 | C12 | 1.3° | 0.5° |
| C14 | C4 | C3 | C2 | 179.7° | 179.7° |
| C14 | C4 | C3 | O11 | 0.2° | 0.3° |
| C14 | C4 | C5 | H2 | 0.6° | 0.7° |
| N13 | C14 | C4 | C3 | 0.6° | 0.6° |
| C14 | N13 | C12 | O11 | 1.6° | 0.3° |
| C14 | N13 | C12 | N16 | 177.5° | 179.7° |
| C6 | C1 | C2 | H1 | 180.0° | 179.7° |
| C6 | C1 | C2 | C3 | 0.8° | 0.3° |
| C6 | C1 | C2 | N8 | 179.5° | 179.8° |
| C1 | C6 | C5 | H2 | 178.9° | 179.9° |
| C4 | C3 | C2 | C1 | 0.5° | 0.1° |
| C4 | C3 | C2 | O11 | 179.8° | 180.0° |
| C4 | C3 | O11 | C12 | 0.5° | 0.0° |
| C4 | C3 | C2 | N8 | 179.2° | 180.0° |
| C3 | C4 | C5 | H2 | 179.2° | 179.7° |
| N13 | C12 | O11 | C3 | 1.2° | 0.0° |
| N13 | C12 | O11 | N16 | 176.3° | 180.0° |
| N13 | C12 | N16 | C21 | 24.4° | 139.2° |
| N13 | C12 | N16 | C17 | 151.7° | 40.5° |
| C1 | C2 | C3 | N8 | 178.7° | 179.9° |
| C1 | C2 | C3 | O11 | 179.6° | 180.0° |
| C1 | C2 | N8 | O9 | 146.2° | 2.6° |
| C1 | C2 | N8 | OXT | 2.9° | 177.4° |
| C2 | C3 | O11 | C12 | 179.3° | 180.0° |
| C3 | C2 | N8 | O9 | 35.2° | 177.3° |
| C3 | C2 | C1 | H1 | 179.2° | 180.0° |
| C3 | C2 | N8 | OXT | 178.5° | 2.7° |
| C3 | O11 | C12 | N16 | 177.5° | 180.0° |
| O11 | C3 | C2 | N8 | 1.0° | 0.1° |
| C22 | C21 | N16 | C12 | 76.4° | 6.6° |
| C22 | C21 | N16 | C20 | 119.5° | 119.8° |
| C22 | C21 | N16 | H5 | 120.9° | 120.5° |
| C22 | C21 | C20 | H5 | 120.9° | 120.5° |
| C22 | C21 | N16 | C17 | 99.4° | 173.1° |
| C22 | C21 | C20 | C19 | 156.1° | 174.4° |
| C21 | C22 | H6 | H7 | 120.0° | 120.0° |
| C21 | C22 | H6 | H8 | 120.0° | 120.0° |
| C21 | C22 | H7 | H8 | 120.0° | 119.9° |
| C22 | C21 | C20 | H9 | 83.7° | 65.7° |
| C22 | C21 | C20 | H10 | 35.8° | 54.4° |
| O11 | C12 | N16 | C21 | 159.4° | 40.8° |
| O11 | C12 | N16 | C17 | 24.4° | 139.5° |
| C12 | N16 | C21 | C17 | 175.8° | 179.7° |
| C12 | N16 | C21 | C20 | 164.2° | 126.4° |
| C12 | N16 | C17 | C23 | 98.7° | 6.6° |
| C12 | N16 | C17 | C18 | 135.9° | 126.5° |
| C12 | N16 | C21 | H5 | 44.5° | 113.9° |
| C12 | N16 | C17 | H15 | 18.8° | 113.9° |
| C2 | N8 | O9 | OXT | 148.1° | 180.0° |
| N8 | C2 | C1 | H1 | 0.6° | 0.1° |
| N16 | C21 | C20 | H5 | 120.3° | 119.8° |
| N16 | C21 | C20 | C19 | 37.2° | 54.6° |
| C21 | N16 | C17 | C23 | 77.4° | 173.1° |
| C21 | N16 | C17 | C18 | 48.1° | 53.2° |
| N16 | C21 | C22 | H6 | 180.0° | 50.6° |
| N16 | C21 | C22 | H7 | 60.0° | 170.6° |
| N16 | C21 | C22 | H8 | 60.0° | 69.4° |
| N16 | C21 | C20 | H9 | 157.5° | 174.6° |
| N16 | C21 | C20 | H10 | 83.0° | 65.3° |
| C21 | N16 | C17 | H15 | 165.1° | 66.5° |
| C20 | C21 | N16 | C17 | 20.1° | 53.3° |
| C21 | C20 | C19 | H9 | 120.3° | 119.9° |
| C21 | C20 | C19 | H10 | 120.2° | 120.0° |
| C21 | C20 | C19 | C18 | 69.2° | 61.4° |
| C20 | C21 | C22 | H6 | 62.3° | 68.7° |
| C20 | C21 | C22 | H7 | 177.7° | 51.3° |
| C20 | C21 | C22 | H8 | 57.7° | 171.3° |
| C21 | C20 | H9 | H10 | 119.2° | 120.1° |
| C21 | C20 | C19 | H11 | 51.1° | 58.6° |
| C21 | C20 | C19 | H12 | 170.5° | 178.6° |
| N16 | C17 | C23 | C18 | 126.3° | 119.6° |
| N16 | C17 | C23 | H15 | 117.8° | 120.4° |
| N16 | C17 | C18 | H15 | 117.4° | 119.8° |
| N16 | C17 | C18 | C19 | 13.6° | 54.3° |
| C17 | N16 | C21 | H5 | 139.7° | 66.5° |
| N16 | C17 | C18 | H13 | 133.9° | 174.5° |
| N16 | C17 | C18 | H14 | 106.7° | 65.6° |
| N16 | C17 | C23 | H16 | 180.0° | 53.5° |
| N16 | C17 | C23 | H17 | 60.0° | 173.5° |
| N16 | C17 | C23 | H18 | 60.0° | 66.5° |
| C20 | C19 | C18 | C17 | 39.0° | 61.2° |
| C20 | C19 | C18 | H11 | 120.3° | 120.0° |
| C20 | C19 | C18 | H12 | 120.3° | 120.1° |
| C19 | C20 | C21 | H5 | 83.1° | 65.1° |
| C19 | C20 | H9 | H10 | 119.2° | 120.1° |
| C20 | C19 | H11 | H12 | 119.1° | 120.0° |
| C20 | C19 | C18 | H13 | 81.2° | 178.7° |
| C20 | C19 | C18 | H14 | 159.3° | 58.6° |
| C23 | C17 | C18 | H15 | 115.9° | 120.2° |
| C23 | C17 | C18 | C19 | 113.1° | 174.3° |
| C23 | C17 | C18 | H13 | 7.2° | 65.6° |
| C23 | C17 | C18 | H14 | 126.6° | 54.3° |
| C17 | C23 | H16 | H17 | 120.0° | 120.0° |
| C17 | C23 | H16 | H18 | 120.0° | 120.0° |
| C17 | C23 | H17 | H18 | 120.0° | 120.0° |
| C17 | C18 | C19 | H13 | 120.3° | 120.1° |
| C17 | C18 | C19 | H14 | 120.3° | 119.8° |
| C17 | C18 | C19 | H11 | 81.3° | 58.8° |
| C17 | C18 | C19 | H12 | 159.3° | 178.7° |
| C17 | C18 | H13 | H14 | 119.2° | 119.9° |
| C18 | C17 | C23 | H16 | 53.7° | 173.1° |
| C18 | C17 | C23 | H17 | 66.3° | 66.9° |
| C18 | C17 | C23 | H18 | 173.7° | 53.1° |
| C18 | C19 | C20 | H9 | 170.5° | 178.7° |
| C18 | C19 | C20 | H10 | 51.0° | 58.6° |
| C18 | C19 | H11 | H12 | 119.2° | 119.9° |
| C19 | C18 | H13 | H14 | 119.2° | 120.1° |
| C19 | C18 | C17 | H15 | 131.0° | 65.5° |
| H5 | C21 | C22 | H6 | 58.6° | 170.9° |
| H5 | C21 | C22 | H7 | 61.4° | 69.0° |
| H5 | C21 | C22 | H8 | 178.6° | 50.9° |
| H5 | C21 | C20 | H9 | 37.2° | 54.8° |
| H5 | C21 | C20 | H10 | 156.7° | 174.9° |
| H6 | C22 | H7 | H8 | 120.0° | 120.0° |
| H9 | C20 | C19 | H11 | 69.2° | 61.3° |
| H9 | C20 | C19 | H12 | 50.2° | 58.7° |
| H10 | C20 | C19 | H11 | 171.3° | 178.6° |
| H10 | C20 | C19 | H12 | 69.3° | 61.4° |
| H11 | C19 | C18 | H13 | 158.5° | 61.3° |
| H11 | C19 | C18 | H14 | 39.0° | 178.7° |
| H12 | C19 | C18 | H13 | 39.1° | 58.6° |
| H12 | C19 | C18 | H14 | 80.4° | 61.4° |
| H13 | C18 | C17 | H15 | 108.7° | 54.6° |
| H14 | C18 | C17 | H15 | 10.7° | 174.6° |
| H15 | C17 | C23 | H16 | 62.2° | 66.9° |
| H15 | C17 | C23 | H17 | 177.8° | 53.1° |
| H15 | C17 | C23 | H18 | 57.8° | 173.1° |
| H16 | C23 | H17 | H18 | 120.0° | 120.1° |
