L7A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.40Å | 1.48Å | Aromatic |
| C1 | C6 | sing | 1.40Å | 1.51Å | Aromatic |
| C1 | C7 | sing | 1.48Å | 1.51Å | |
| N1 | C13 | doub | 1.32Å | 1.45Å | Aromatic |
| N1 | C14 | sing | 1.32Å | 1.43Å | Aromatic |
| O1 | C12 | doub | 1.22Å | 1.21Å | |
| C2 | C3 | sing | 1.38Å | 1.48Å | Aromatic |
| N2 | C7 | sing | 1.35Å | 1.38Å | |
| N2 | C11 | sing | 1.40Å | 1.36Å | |
| O2 | C7 | doub | 1.22Å | 1.23Å | |
| C3 | C4 | doub | 1.38Å | 1.49Å | Aromatic |
| N3 | C8 | sing | 1.36Å | 1.43Å | |
| N3 | C12 | sing | 1.35Å | 1.44Å | |
| C4 | C5 | sing | 1.38Å | 1.48Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.47Å | Aromatic |
| C8 | C9 | doub | 1.37Å | 1.47Å | |
| C9 | C10 | sing | 1.41Å | 1.48Å | |
| C9 | C16 | sing | 1.48Å | 1.56Å | |
| C10 | C11 | doub | 1.37Å | 1.39Å | |
| C11 | C12 | sing | 1.41Å | 1.49Å | |
| C13 | C17 | sing | 1.38Å | 1.45Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.45Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.54Å | Aromatic |
| C16 | C17 | doub | 1.40Å | 1.50Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | 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 | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 121.7° | 119.7° |
| C2 | C1 | C7 | 113.8° | 120.1° |
| C1 | C2 | C3 | 118.6° | 119.8° |
| C1 | C2 | H2 | 120.7° | 120.1° |
| C6 | C1 | C7 | 124.5° | 120.1° |
| C1 | C6 | C5 | 118.9° | 119.9° |
| C1 | C6 | H6 | 120.5° | 120.1° |
| C1 | C7 | N2 | 111.4° | 120.0° |
| C1 | C7 | O2 | 119.1° | 120.0° |
| C13 | N1 | C14 | 127.8° | 122.0° |
| N1 | C13 | C17 | 118.1° | 120.9° |
| N1 | C13 | H13 | 120.9° | 119.5° |
| N1 | C14 | C15 | 115.9° | 120.9° |
| N1 | C14 | H14 | 122.1° | 119.6° |
| O1 | C12 | N3 | 121.2° | 119.9° |
| O1 | C12 | C11 | 117.9° | 119.9° |
| C2 | C3 | C4 | 120.0° | 120.2° |
| C3 | C2 | H2 | 120.7° | 120.1° |
| C2 | C3 | H3 | 120.0° | 119.8° |
| C7 | N2 | C11 | 120.7° | 120.0° |
| N2 | C7 | O2 | 129.5° | 120.0° |
| C7 | N2 | HN2 | 119.7° | 120.0° |
| N2 | C11 | C10 | 123.9° | 120.3° |
| N2 | C11 | C12 | 117.7° | 120.4° |
| C11 | N2 | HN2 | 119.6° | 120.0° |
| C3 | C4 | C5 | 121.4° | 120.3° |
| C4 | C3 | H3 | 120.0° | 120.0° |
| C3 | C4 | H4 | 119.3° | 119.9° |
| C8 | N3 | C12 | 122.9° | 120.9° |
| N3 | C8 | C9 | 114.4° | 120.7° |
| N3 | C8 | H8 | 122.8° | 119.7° |
| C8 | N3 | HN3 | 118.6° | 119.6° |
| N3 | C12 | C11 | 120.9° | 120.2° |
| C12 | N3 | HN3 | 118.6° | 119.5° |
| C4 | C5 | C6 | 119.4° | 120.1° |
| C5 | C4 | H4 | 119.3° | 119.8° |
| C4 | C5 | H5 | 120.3° | 120.0° |
| C6 | C5 | H5 | 120.3° | 119.9° |
| C5 | C6 | H6 | 120.6° | 120.1° |
| C8 | C9 | C10 | 124.0° | 119.8° |
| C8 | C9 | C16 | 118.4° | 120.1° |
| C9 | C8 | H8 | 122.8° | 119.6° |
| C10 | C9 | C16 | 117.6° | 120.1° |
| C9 | C10 | C11 | 119.5° | 119.1° |
| C9 | C10 | H10 | 120.3° | 120.5° |
| C9 | C16 | C15 | 118.8° | 120.9° |
| C9 | C16 | C17 | 120.3° | 120.9° |
| C10 | C11 | C12 | 118.4° | 119.3° |
| C11 | C10 | H10 | 120.3° | 120.4° |
| C13 | C17 | C16 | 117.7° | 119.1° |
| C17 | C13 | H13 | 121.0° | 119.6° |
| C13 | C17 | H17 | 121.1° | 120.5° |
| C14 | C15 | C16 | 119.6° | 119.0° |
| C15 | C14 | H14 | 122.0° | 119.5° |
| C14 | C15 | H15 | 120.2° | 120.5° |
| C15 | C16 | C17 | 120.8° | 118.2° |
| C16 | C15 | H15 | 120.2° | 120.5° |
| C16 | C17 | H17 | 121.2° | 120.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | C7 | 179.4° | 179.9° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C2 | C1 | C7 | N2 | 177.7° | 180.0° |
| C2 | C1 | C7 | O2 | 1.8° | 0.1° |
| C1 | C2 | C3 | C4 | 1.1° | 0.0° |
| C2 | C1 | C6 | C5 | 0.0° | 0.1° |
| C1 | C2 | C3 | H3 | 178.9° | 180.0° |
| C2 | C1 | C6 | H6 | 180.0° | 180.0° |
| C6 | C1 | C2 | C3 | 1.1° | 0.1° |
| C6 | C1 | C7 | N2 | 2.9° | 0.1° |
| C6 | C1 | C7 | O2 | 177.7° | 179.7° |
| C1 | C6 | C5 | C4 | 1.1° | 0.1° |
| C1 | C6 | C5 | H6 | 180.0° | 179.9° |
| C6 | C1 | C2 | H2 | 178.8° | 179.9° |
| C1 | C6 | C5 | H5 | 178.9° | 179.9° |
| C7 | C1 | C2 | C3 | 179.4° | 179.8° |
| C1 | C7 | N2 | O2 | 179.4° | 179.9° |
| C1 | C7 | N2 | C11 | 179.6° | 175.0° |
| C7 | C1 | C6 | C5 | 179.4° | 179.8° |
| C7 | C1 | C2 | H2 | 0.6° | 0.2° |
| C7 | C1 | C6 | H6 | 0.6° | 0.2° |
| C1 | C7 | N2 | HN2 | 0.3° | 5.0° |
| N1 | C13 | C17 | H13 | 180.0° | 180.0° |
| C13 | N1 | C14 | C15 | 0.0° | 0.0° |
| N1 | C13 | C17 | C16 | 0.1° | 0.0° |
| C13 | N1 | C14 | H14 | 180.0° | 180.0° |
| N1 | C13 | C17 | H17 | 179.9° | 180.0° |
| C14 | N1 | C13 | C17 | 0.1° | 0.0° |
| N1 | C14 | C15 | H14 | 180.0° | 180.0° |
| N1 | C14 | C15 | C16 | 0.0° | 0.0° |
| C14 | N1 | C13 | H13 | 179.9° | 180.0° |
| N1 | C14 | C15 | H15 | 180.0° | 180.0° |
| O1 | C12 | C11 | N2 | 2.2° | 0.0° |
| O1 | C12 | N3 | C8 | 176.2° | 180.0° |
| O1 | C12 | N3 | C11 | 178.5° | 179.9° |
| O1 | C12 | C11 | C10 | 177.3° | 180.0° |
| O1 | C12 | N3 | HN3 | 3.8° | 0.3° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C2 | C3 | C4 | H4 | 179.9° | 179.9° |
| C7 | N2 | C11 | HN2 | 180.0° | 180.0° |
| C7 | N2 | C11 | C10 | 2.3° | 121.4° |
| C7 | N2 | C11 | C12 | 177.2° | 58.6° |
| C11 | N2 | C7 | O2 | 0.9° | 4.9° |
| N2 | C11 | C12 | N3 | 179.3° | 179.9° |
| N2 | C11 | C10 | C9 | 180.0° | 180.0° |
| N2 | C11 | C10 | C12 | 179.4° | 180.0° |
| N2 | C11 | C10 | H10 | 0.0° | 0.0° |
| O2 | C7 | N2 | HN2 | 179.1° | 175.1° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 1.2° | 0.0° |
| C4 | C3 | C2 | H2 | 178.9° | 180.0° |
| C3 | C4 | C5 | H5 | 178.8° | 180.0° |
| C8 | N3 | C12 | HN3 | 180.0° | 179.7° |
| N3 | C8 | C9 | H8 | 180.0° | 179.9° |
| N3 | C8 | C9 | C10 | 1.7° | 0.0° |
| N3 | C8 | C9 | C16 | 179.0° | 180.0° |
| C8 | N3 | C12 | C11 | 2.3° | 0.1° |
| C12 | N3 | C8 | C9 | 2.4° | 0.1° |
| N3 | C12 | C11 | C10 | 1.3° | 0.1° |
| C12 | N3 | C8 | H8 | 177.6° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C5 | C4 | C3 | H3 | 179.9° | 179.9° |
| C4 | C5 | C6 | H6 | 178.8° | 180.0° |
| C6 | C5 | C4 | H4 | 178.8° | 179.9° |
| C8 | C9 | C10 | C16 | 177.3° | 180.0° |
| C8 | C9 | C10 | C11 | 0.9° | 0.0° |
| C8 | C9 | C16 | C15 | 22.8° | 65.0° |
| C8 | C9 | C16 | C17 | 159.8° | 115.0° |
| C8 | C9 | C10 | H10 | 179.1° | 180.0° |
| C9 | C8 | N3 | HN3 | 177.6° | 179.7° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 0.6° | 0.0° |
| C10 | C9 | C16 | C15 | 159.8° | 115.1° |
| C10 | C9 | C16 | C17 | 17.7° | 65.0° |
| C10 | C9 | C8 | H8 | 178.3° | 179.9° |
| C16 | C9 | C10 | C11 | 178.2° | 180.0° |
| C9 | C16 | C17 | C13 | 177.5° | 180.0° |
| C9 | C16 | C15 | C14 | 177.4° | 180.0° |
| C9 | C16 | C15 | C17 | 177.4° | 180.0° |
| C16 | C9 | C8 | H8 | 1.0° | 0.0° |
| C16 | C9 | C10 | H10 | 1.8° | 0.0° |
| C9 | C16 | C15 | H15 | 2.6° | 0.0° |
| C9 | C16 | C17 | H17 | 2.5° | 0.0° |
| C10 | C11 | N2 | HN2 | 177.8° | 58.6° |
| C12 | C11 | C10 | H10 | 179.4° | 180.0° |
| C12 | C11 | N2 | HN2 | 2.8° | 121.4° |
| C11 | C12 | N3 | HN3 | 177.7° | 179.8° |
| C13 | C17 | C16 | C15 | 0.1° | 0.0° |
| C13 | C17 | C16 | H17 | 180.0° | 180.0° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C14 | C15 | C16 | C17 | 0.0° | 0.0° |
| C16 | C15 | C14 | H14 | 180.0° | 180.0° |
| C15 | C16 | C17 | H17 | 179.9° | 180.0° |
| C16 | C17 | C13 | H13 | 179.9° | 180.0° |
| C17 | C16 | C15 | H15 | 180.0° | 180.0° |
| H2 | C2 | C3 | H3 | 1.1° | 0.1° |
| H3 | C3 | C4 | H4 | 0.1° | 0.0° |
| H4 | C4 | C5 | H5 | 1.2° | 0.1° |
| H5 | C5 | C6 | H6 | 1.2° | 0.0° |
| H8 | C8 | N3 | HN3 | 2.4° | 0.4° |
| H13 | C13 | C17 | H17 | 0.1° | 0.0° |
| H14 | C14 | C15 | H15 | 0.0° | 0.0° |
