GB7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C8 | sing | 1.51Å | 1.52Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | N7 | sing | 1.47Å | 1.47Å | |
| C9 | O9 | sing | 1.43Å | 1.42Å | |
| N7 | C6 | sing | 1.47Å | 1.49Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | N1 | sing | 1.47Å | 1.48Å | |
| C5 | C4 | sing | 1.55Å | 1.53Å | |
| N1 | C1 | sing | 1.46Å | 1.48Å | |
| N1 | C2 | sing | 1.34Å | 1.33Å | |
| C2 | O2 | doub | 1.21Å | 1.23Å | |
| C2 | C3 | sing | 1.51Å | 1.52Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.55Å | 1.53Å | |
| C4 | O4 | sing | 1.43Å | 1.41Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O9 | HO9 | sing | 0.97Å | 0.95Å | |
| N7 | HN7 | sing | 1.01Å | 1.00Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C11 | C10 | 118.3° | 120.0° |
| C11 | C12 | C13 | 124.8° | 120.0° |
| C12 | C11 | H11 | 120.8° | 120.0° |
| C11 | C12 | H12 | 117.6° | 120.1° |
| C11 | C10 | C15 | 119.0° | 120.0° |
| C11 | C10 | C8 | 116.8° | 120.0° |
| C10 | C11 | H11 | 120.8° | 120.0° |
| C12 | C13 | C14 | 114.5° | 120.0° |
| C13 | C12 | H12 | 117.6° | 119.9° |
| C12 | C13 | H13 | 122.8° | 120.0° |
| C13 | C14 | C15 | 122.5° | 120.0° |
| C14 | C13 | H13 | 122.7° | 120.0° |
| C13 | C14 | H14 | 118.8° | 120.0° |
| C14 | C15 | C10 | 120.5° | 120.0° |
| C15 | C14 | H14 | 118.8° | 120.0° |
| C14 | C15 | H15 | 119.8° | 120.1° |
| C15 | C10 | C8 | 124.1° | 120.0° |
| C10 | C15 | H15 | 119.8° | 119.9° |
| C10 | C8 | C9 | 103.5° | 109.4° |
| C10 | C8 | N7 | 111.7° | 109.5° |
| C10 | C8 | H8 | 112.4° | 109.5° |
| C9 | C8 | N7 | 110.7° | 109.5° |
| C8 | C9 | O9 | 111.9° | 109.5° |
| C9 | C8 | H8 | 113.3° | 109.5° |
| C8 | C9 | H9 | 108.7° | 109.5° |
| C8 | C9 | H9A | 108.1° | 109.4° |
| C8 | N7 | C6 | 112.3° | 111.0° |
| N7 | C8 | H8 | 105.4° | 109.5° |
| C8 | N7 | HN7 | 108.5° | 111.0° |
| O9 | C9 | H9 | 108.7° | 109.5° |
| O9 | C9 | H9A | 108.1° | 109.5° |
| C9 | O9 | HO9 | 109.5° | 114.0° |
| N7 | C6 | C5 | 115.0° | 109.4° |
| C6 | N7 | HN7 | 108.6° | 111.1° |
| N7 | C6 | H6 | 107.7° | 109.5° |
| N7 | C6 | H6A | 106.4° | 109.5° |
| C6 | C5 | N1 | 107.7° | 110.3° |
| C6 | C5 | C4 | 117.2° | 110.2° |
| C5 | C6 | H6 | 107.7° | 109.5° |
| C5 | C6 | H6A | 106.4° | 109.5° |
| C6 | C5 | H5 | 103.7° | 110.2° |
| N1 | C5 | C4 | 103.1° | 105.5° |
| C5 | N1 | C1 | 120.7° | 124.3° |
| C5 | N1 | C2 | 114.9° | 111.3° |
| N1 | C5 | H5 | 117.7° | 110.2° |
| C5 | C4 | C3 | 106.1° | 101.7° |
| C5 | C4 | O4 | 115.5° | 110.9° |
| C4 | C5 | H5 | 108.2° | 110.3° |
| C5 | C4 | H4 | 109.6° | 111.0° |
| C1 | N1 | C2 | 124.1° | 124.4° |
| N1 | C1 | H1 | 109.5° | 109.5° |
| N1 | C1 | H1A | 109.5° | 109.4° |
| N1 | C1 | H1B | 109.5° | 109.5° |
| N1 | C2 | O2 | 126.3° | 124.9° |
| N1 | C2 | C3 | 108.7° | 110.1° |
| O2 | C2 | C3 | 124.9° | 125.0° |
| C2 | C3 | O3 | 110.2° | 110.5° |
| C2 | C3 | C4 | 104.2° | 104.2° |
| C2 | C3 | H3 | 116.9° | 110.5° |
| O3 | C3 | C4 | 119.9° | 110.4° |
| O3 | C3 | H3 | 99.9° | 110.4° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C3 | C4 | O4 | 114.3° | 111.0° |
| C4 | C3 | H3 | 106.4° | 110.6° |
| C3 | C4 | H4 | 110.9° | 111.0° |
| O4 | C4 | H4 | 100.5° | 111.0° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| H9 | C9 | H9A | 111.4° | 109.5° |
| H6 | C6 | H6A | 113.9° | 109.5° |
| H1 | C1 | H1A | 109.5° | 109.4° |
| H1 | C1 | H1B | 109.4° | 109.5° |
| H1A | C1 | H1B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C11 | C10 | H11 | 180.0° | 179.6° |
| C11 | C12 | C13 | H12 | 180.0° | 179.9° |
| C11 | C12 | C13 | C14 | 6.8° | 0.0° |
| C12 | C11 | C10 | C15 | 4.3° | 0.0° |
| C12 | C11 | C10 | C8 | 177.8° | 180.0° |
| C11 | C12 | C13 | H13 | 173.2° | 179.9° |
| C10 | C11 | C12 | C13 | 6.6° | 0.0° |
| C11 | C10 | C15 | C14 | 2.9° | 0.1° |
| C11 | C10 | C15 | C8 | 177.8° | 180.0° |
| C11 | C10 | C8 | C9 | 62.4° | 100.0° |
| C11 | C10 | C8 | N7 | 56.7° | 140.0° |
| C10 | C11 | C12 | H12 | 173.4° | 180.0° |
| C11 | C10 | C15 | H15 | 177.1° | 179.9° |
| C11 | C10 | C8 | H8 | 174.9° | 19.9° |
| C12 | C13 | C14 | H13 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 5.0° | 0.1° |
| C13 | C12 | C11 | H11 | 173.4° | 179.7° |
| C12 | C13 | C14 | H14 | 175.0° | 180.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C10 | 3.4° | 0.1° |
| C14 | C13 | C12 | H12 | 173.2° | 180.0° |
| C13 | C14 | C15 | H15 | 176.6° | 180.0° |
| C14 | C15 | C10 | H15 | 180.0° | 179.8° |
| C14 | C15 | C10 | C8 | 179.3° | 179.9° |
| C15 | C14 | C13 | H13 | 175.0° | 180.0° |
| C15 | C10 | C8 | C9 | 119.7° | 79.9° |
| C15 | C10 | C8 | N7 | 121.1° | 40.1° |
| C15 | C10 | C11 | H11 | 175.7° | 179.6° |
| C10 | C15 | C14 | H14 | 176.6° | 179.9° |
| C15 | C10 | C8 | H8 | 2.9° | 160.1° |
| C10 | C8 | C9 | N7 | 119.9° | 120.0° |
| C10 | C8 | C9 | H8 | 122.0° | 120.0° |
| C10 | C8 | N7 | H8 | 122.3° | 120.0° |
| C10 | C8 | C9 | O9 | 177.1° | 55.0° |
| C10 | C8 | N7 | C6 | 59.7° | 155.0° |
| C8 | C10 | C11 | H11 | 2.2° | 0.3° |
| C8 | C10 | C15 | H15 | 0.6° | 0.1° |
| C10 | C8 | C9 | H9 | 62.9° | 65.0° |
| C10 | C8 | C9 | H9A | 58.2° | 175.0° |
| C10 | C8 | N7 | HN7 | 60.3° | 31.0° |
| C9 | C8 | N7 | H8 | 122.9° | 120.1° |
| C8 | C9 | O9 | H9 | 120.0° | 120.0° |
| C8 | C9 | O9 | H9A | 118.9° | 119.9° |
| C9 | C8 | N7 | C6 | 174.5° | 85.0° |
| C8 | C9 | H9 | H9A | 119.0° | 119.9° |
| C8 | C9 | O9 | HO9 | 3.8° | 180.0° |
| C9 | C8 | N7 | HN7 | 54.5° | 151.0° |
| N7 | C8 | C9 | O9 | 63.0° | 65.0° |
| C8 | N7 | C6 | HN7 | 120.0° | 124.0° |
| C8 | N7 | C6 | C5 | 167.6° | 180.0° |
| N7 | C8 | C9 | H9 | 57.0° | 175.0° |
| N7 | C8 | C9 | H9A | 178.0° | 55.0° |
| C8 | N7 | C6 | H6 | 47.6° | 60.0° |
| C8 | N7 | C6 | H6A | 74.9° | 60.0° |
| O9 | C9 | C8 | H8 | 55.1° | 175.0° |
| O9 | C9 | H9 | H9A | 119.0° | 120.0° |
| N7 | C6 | C5 | H6 | 120.0° | 120.0° |
| N7 | C6 | C5 | H6A | 117.5° | 120.0° |
| N7 | C6 | C5 | N1 | 174.7° | 56.5° |
| N7 | C6 | C5 | C4 | 69.8° | 172.5° |
| C6 | N7 | C8 | H8 | 62.6° | 35.0° |
| N7 | C6 | H6 | H6A | 117.8° | 120.0° |
| N7 | C6 | C5 | H5 | 49.3° | 65.4° |
| C6 | C5 | N1 | C4 | 124.5° | 119.0° |
| C6 | C5 | N1 | H5 | 116.5° | 121.9° |
| C6 | C5 | C4 | H5 | 116.6° | 121.9° |
| C6 | C5 | N1 | C1 | 53.2° | 78.0° |
| C6 | C5 | N1 | C2 | 133.7° | 102.0° |
| C6 | C5 | C4 | C3 | 134.2° | 93.6° |
| C6 | C5 | C4 | O4 | 98.1° | 148.3° |
| C5 | C6 | N7 | HN7 | 72.4° | 56.1° |
| C5 | C6 | H6 | H6A | 117.7° | 120.0° |
| C6 | C5 | C4 | H4 | 14.4° | 24.5° |
| N1 | C5 | C4 | H5 | 125.3° | 119.0° |
| C5 | N1 | C1 | C2 | 172.4° | 179.9° |
| C5 | N1 | C2 | O2 | 178.1° | 179.6° |
| C5 | N1 | C2 | C3 | 1.9° | 0.4° |
| N1 | C5 | C4 | C3 | 16.1° | 25.4° |
| N1 | C5 | C4 | O4 | 143.8° | 92.7° |
| N1 | C5 | C6 | H6 | 54.6° | 63.6° |
| N1 | C5 | C6 | H6A | 67.8° | 176.5° |
| C5 | N1 | C1 | H1 | 36.2° | 90.0° |
| C5 | N1 | C1 | H1A | 156.2° | 150.0° |
| C5 | N1 | C1 | H1B | 83.8° | 30.0° |
| N1 | C5 | C4 | H4 | 103.7° | 143.5° |
| C4 | C5 | N1 | C1 | 177.7° | 163.0° |
| C4 | C5 | N1 | C2 | 9.2° | 17.0° |
| C5 | C4 | C3 | C2 | 17.4° | 24.8° |
| C5 | C4 | C3 | O3 | 106.4° | 143.5° |
| C5 | C4 | C3 | O4 | 128.4° | 118.1° |
| C5 | C4 | C3 | H4 | 118.9° | 118.1° |
| C5 | C4 | O4 | H4 | 117.8° | 123.8° |
| C4 | C5 | C6 | H6 | 170.2° | 52.5° |
| C4 | C5 | C6 | H6A | 47.8° | 67.5° |
| C5 | C4 | C3 | H3 | 141.5° | 94.0° |
| C5 | C4 | O4 | HO4 | 68.7° | 180.0° |
| C1 | N1 | C2 | O2 | 5.3° | 0.4° |
| C1 | N1 | C2 | C3 | 170.9° | 179.6° |
| C1 | N1 | C5 | H5 | 63.3° | 43.9° |
| N1 | C1 | H1 | H1A | 120.0° | 120.0° |
| N1 | C1 | H1 | H1B | 120.0° | 120.0° |
| N1 | C1 | H1A | H1B | 120.0° | 120.0° |
| N1 | C2 | O2 | C3 | 175.5° | 180.0° |
| N1 | C2 | C3 | O3 | 117.7° | 134.9° |
| N1 | C2 | C3 | C4 | 12.2° | 16.3° |
| C2 | N1 | C5 | H5 | 109.7° | 136.1° |
| C2 | N1 | C1 | H1 | 151.4° | 89.9° |
| C2 | N1 | C1 | H1A | 31.4° | 30.0° |
| C2 | N1 | C1 | H1B | 88.6° | 150.0° |
| N1 | C2 | C3 | H3 | 129.3° | 102.6° |
| O2 | C2 | C3 | O3 | 58.5° | 45.1° |
| O2 | C2 | C3 | C4 | 171.5° | 163.7° |
| O2 | C2 | C3 | H3 | 54.5° | 77.4° |
| C2 | C3 | O3 | C4 | 120.9° | 114.8° |
| C2 | C3 | O3 | H3 | 123.6° | 122.6° |
| C2 | C3 | C4 | H3 | 124.1° | 118.8° |
| C2 | C3 | C4 | O4 | 145.8° | 93.3° |
| C2 | C3 | O3 | HO3 | 1.0° | 61.4° |
| C2 | C3 | C4 | H4 | 101.5° | 142.9° |
| O3 | C3 | C4 | H3 | 112.1° | 122.5° |
| O3 | C3 | C4 | O4 | 22.0° | 25.4° |
| O3 | C3 | C4 | H4 | 134.7° | 98.4° |
| C3 | C4 | O4 | H4 | 118.8° | 123.9° |
| C3 | C4 | C5 | H5 | 109.2° | 144.5° |
| C4 | C3 | O3 | HO3 | 121.9° | 176.2° |
| C3 | C4 | O4 | HO4 | 54.7° | 67.7° |
| O4 | C4 | C5 | H5 | 18.5° | 26.4° |
| O4 | C4 | C3 | H3 | 90.1° | 147.9° |
| H11 | C11 | C12 | H12 | 6.6° | 0.4° |
| H12 | C12 | C13 | H13 | 6.8° | 0.0° |
| H13 | C13 | C14 | H14 | 5.0° | 0.0° |
| H14 | C14 | C15 | H15 | 3.4° | 0.1° |
| H8 | C8 | C9 | H9 | 175.1° | 54.9° |
| H8 | C8 | C9 | H9A | 63.8° | 65.1° |
| H8 | C8 | N7 | HN7 | 177.4° | 89.0° |
| H9 | C9 | O9 | HO9 | 116.1° | 60.0° |
| H9A | C9 | O9 | HO9 | 122.8° | 60.0° |
| HN7 | N7 | C6 | H6 | 167.6° | 176.1° |
| HN7 | N7 | C6 | H6A | 45.1° | 63.9° |
| H6 | C6 | C5 | H5 | 70.7° | 174.5° |
| H6A | C6 | C5 | H5 | 166.8° | 54.6° |
| H5 | C5 | C4 | H4 | 131.0° | 97.5° |
| H1 | C1 | H1A | H1B | 120.0° | 120.0° |
| H3 | C3 | O3 | HO3 | 122.6° | 61.2° |
| H3 | C3 | C4 | H4 | 22.5° | 24.1° |
| H4 | C4 | O4 | HO4 | 173.5° | 56.1° |
