LC5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | doub | 1.36Å | 1.38Å | Aromatic |
| C20 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
| C21 | C19 | sing | 1.41Å | 1.40Å | Aromatic |
| C18 | C16 | doub | 1.36Å | 1.40Å | Aromatic |
| C19 | C22 | doub | 1.41Å | 1.38Å | Aromatic |
| C19 | C17 | sing | 1.42Å | 1.39Å | Aromatic |
| C22 | C24 | sing | 1.36Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.41Å | 1.42Å | Aromatic |
| C16 | C15 | sing | 1.51Å | 1.54Å | |
| C17 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| C15 | C14 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | doub | 1.39Å | 1.38Å | Aromatic |
| O10 | N9 | sing | 1.42Å | 1.39Å | |
| C23 | C25 | sing | 1.36Å | 1.39Å | Aromatic |
| C11 | N9 | sing | 1.47Å | 1.47Å | |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C13 | C2 | sing | 1.53Å | 1.57Å | |
| N9 | C4 | sing | 1.35Å | 1.36Å | |
| O8 | P5 | doub | 1.48Å | 1.50Å | |
| C4 | O12 | doub | 1.21Å | 1.21Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.55Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C1 | P5 | sing | 1.82Å | 1.82Å | |
| P5 | O6 | sing | 1.61Å | 1.52Å | |
| P5 | O7 | sing | 1.61Å | 1.52Å | |
| O10 | H1 | sing | 0.97Å | 0.95Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| O6 | H10 | sing | 0.97Å | 0.95Å | |
| O7 | H11 | sing | 0.97Å | 0.95Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.08Å | 1.08Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C24 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H22 | sing | 1.08Å | 1.08Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C18 | 120.3° | 121.0° |
| C20 | C21 | C19 | 120.3° | 119.7° |
| C20 | C21 | H22 | 119.9° | 120.1° |
| C21 | C20 | H23 | 119.9° | 119.5° |
| C20 | C18 | C16 | 120.3° | 121.0° |
| C18 | C20 | H23 | 119.8° | 119.5° |
| C20 | C18 | H24 | 119.8° | 119.5° |
| C21 | C19 | C22 | 119.8° | 121.3° |
| C21 | C19 | C17 | 120.3° | 119.3° |
| C19 | C21 | H22 | 119.9° | 120.2° |
| C18 | C16 | C17 | 119.4° | 119.7° |
| C18 | C16 | C15 | 119.2° | 120.1° |
| C16 | C18 | H24 | 119.9° | 119.6° |
| C22 | C19 | C17 | 119.9° | 119.3° |
| C19 | C22 | C24 | 120.2° | 119.6° |
| C19 | C22 | H21 | 119.9° | 120.2° |
| C19 | C17 | C16 | 119.4° | 119.3° |
| C19 | C17 | C23 | 119.5° | 119.4° |
| C22 | C24 | C25 | 120.4° | 121.0° |
| C22 | C24 | H20 | 119.8° | 119.4° |
| C24 | C22 | H21 | 119.9° | 120.2° |
| C17 | C16 | C15 | 121.3° | 120.1° |
| C16 | C17 | C23 | 121.1° | 121.3° |
| C16 | C15 | C14 | 111.5° | 109.5° |
| C16 | C15 | H16 | 108.9° | 109.5° |
| C16 | C15 | H17 | 109.0° | 109.5° |
| C17 | C23 | C25 | 119.9° | 119.7° |
| C17 | C23 | H18 | 120.1° | 120.2° |
| C15 | C14 | C13 | 110.5° | 109.5° |
| C15 | C14 | H14 | 109.2° | 109.5° |
| C15 | C14 | H15 | 109.2° | 109.5° |
| C14 | C15 | H16 | 109.0° | 109.4° |
| C14 | C15 | H17 | 109.0° | 109.5° |
| C24 | C25 | C23 | 120.0° | 121.0° |
| C24 | C25 | H19 | 120.0° | 119.5° |
| C25 | C24 | H20 | 119.8° | 119.5° |
| O10 | N9 | C11 | 118.7° | 120.0° |
| O10 | N9 | C4 | 119.2° | 120.0° |
| N9 | O10 | H1 | 109.5° | 114.0° |
| C25 | C23 | H18 | 120.0° | 120.2° |
| C23 | C25 | H19 | 120.0° | 119.5° |
| C11 | N9 | C4 | 122.2° | 119.9° |
| N9 | C11 | H2 | 109.5° | 109.5° |
| N9 | C11 | H3 | 109.5° | 109.5° |
| N9 | C11 | H4 | 109.4° | 109.5° |
| C14 | C13 | C2 | 112.8° | 109.5° |
| C14 | C13 | H12 | 108.6° | 109.4° |
| C14 | C13 | H13 | 108.6° | 109.4° |
| C13 | C14 | H14 | 109.2° | 109.5° |
| C13 | C14 | H15 | 109.2° | 109.5° |
| C13 | C2 | C3 | 111.8° | 109.5° |
| C13 | C2 | C1 | 111.8° | 109.5° |
| C13 | C2 | H7 | 107.2° | 109.5° |
| C2 | C13 | H12 | 108.6° | 109.5° |
| C2 | C13 | H13 | 108.7° | 109.5° |
| N9 | C4 | O12 | 120.6° | 120.0° |
| N9 | C4 | C3 | 121.4° | 119.9° |
| O8 | P5 | C1 | 109.9° | 109.5° |
| O8 | P5 | O6 | 109.6° | 109.5° |
| O8 | P5 | O7 | 110.6° | 109.5° |
| O12 | C4 | C3 | 117.8° | 120.0° |
| C4 | C3 | C2 | 108.5° | 109.5° |
| C4 | C3 | H5 | 109.7° | 109.5° |
| C4 | C3 | H6 | 109.7° | 109.5° |
| C3 | C2 | C1 | 110.9° | 109.5° |
| C2 | C3 | H5 | 109.7° | 109.4° |
| C2 | C3 | H6 | 109.7° | 109.4° |
| C3 | C2 | H7 | 107.4° | 109.4° |
| C2 | C1 | P5 | 110.2° | 109.5° |
| C1 | C2 | H7 | 107.6° | 109.5° |
| C2 | C1 | H8 | 109.3° | 109.5° |
| C2 | C1 | H9 | 109.3° | 109.5° |
| C1 | P5 | O6 | 107.6° | 109.5° |
| C1 | P5 | O7 | 109.9° | 109.5° |
| P5 | C1 | H8 | 109.3° | 109.5° |
| P5 | C1 | H9 | 109.3° | 109.5° |
| O6 | P5 | O7 | 109.3° | 109.5° |
| P5 | O6 | H10 | 109.5° | 114.0° |
| P5 | O7 | H11 | 109.5° | 114.0° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H2 | C11 | H4 | 109.5° | 109.5° |
| H3 | C11 | H4 | 109.4° | 109.4° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H8 | C1 | H9 | 109.5° | 109.5° |
| H12 | C13 | H13 | 109.5° | 109.5° |
| H14 | C14 | H15 | 109.5° | 109.4° |
| H16 | C15 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C18 | H23 | 180.0° | 179.8° |
| C20 | C21 | C19 | H22 | 180.0° | 179.9° |
| C21 | C20 | C18 | C16 | 1.2° | 0.4° |
| C20 | C21 | C19 | C22 | 179.7° | 179.9° |
| C20 | C21 | C19 | C17 | 1.1° | 0.1° |
| C21 | C20 | C18 | H24 | 178.8° | 180.0° |
| C18 | C20 | C21 | C19 | 0.4° | 0.2° |
| C20 | C18 | C16 | H24 | 180.0° | 179.5° |
| C20 | C18 | C16 | C17 | 2.1° | 0.4° |
| C20 | C18 | C16 | C15 | 179.6° | 179.8° |
| C18 | C20 | C21 | H22 | 179.6° | 179.7° |
| C21 | C19 | C22 | C17 | 179.2° | 180.0° |
| C21 | C19 | C22 | C24 | 178.8° | 179.9° |
| C21 | C19 | C17 | C16 | 0.1° | 0.1° |
| C21 | C19 | C17 | C23 | 178.9° | 180.0° |
| C21 | C19 | C22 | H21 | 1.2° | 0.0° |
| C19 | C21 | C20 | H23 | 179.6° | 180.0° |
| C18 | C16 | C17 | C19 | 1.4° | 0.2° |
| C18 | C16 | C17 | C15 | 178.3° | 179.8° |
| C18 | C16 | C17 | C23 | 179.6° | 179.7° |
| C18 | C16 | C15 | C14 | 107.6° | 95.3° |
| C18 | C16 | C15 | H16 | 12.6° | 144.8° |
| C18 | C16 | C15 | H17 | 132.1° | 24.7° |
| C16 | C18 | C20 | H23 | 178.8° | 179.8° |
| C19 | C22 | C24 | H21 | 180.0° | 180.0° |
| C22 | C19 | C17 | C16 | 179.4° | 180.0° |
| C22 | C19 | C17 | C23 | 0.3° | 0.0° |
| C19 | C22 | C24 | C25 | 1.1° | 0.1° |
| C19 | C22 | C24 | H20 | 178.9° | 179.9° |
| C22 | C19 | C21 | H22 | 0.3° | 0.0° |
| C17 | C19 | C22 | C24 | 0.4° | 0.1° |
| C19 | C17 | C16 | C23 | 179.0° | 179.9° |
| C19 | C17 | C16 | C15 | 179.7° | 180.0° |
| C19 | C17 | C23 | C25 | 1.0° | 0.0° |
| C19 | C17 | C23 | H18 | 179.0° | 180.0° |
| C17 | C19 | C22 | H21 | 179.6° | 179.9° |
| C17 | C19 | C21 | H22 | 179.0° | 180.0° |
| C22 | C24 | C25 | H20 | 180.0° | 179.9° |
| C22 | C24 | C25 | C23 | 1.7° | 0.0° |
| C22 | C24 | C25 | H19 | 178.3° | 179.9° |
| C17 | C16 | C15 | C14 | 74.1° | 85.0° |
| C16 | C17 | C23 | C25 | 180.0° | 179.9° |
| C17 | C16 | C15 | H16 | 165.6° | 35.0° |
| C17 | C16 | C15 | H17 | 46.2° | 155.0° |
| C16 | C17 | C23 | H18 | 0.0° | 0.0° |
| C17 | C16 | C18 | H24 | 177.9° | 180.0° |
| C15 | C16 | C17 | C23 | 1.3° | 0.1° |
| C16 | C15 | C14 | H16 | 120.3° | 120.0° |
| C16 | C15 | C14 | H17 | 120.3° | 120.0° |
| C16 | C15 | C14 | C13 | 76.8° | 180.0° |
| C16 | C15 | C14 | H14 | 163.1° | 60.0° |
| C16 | C15 | C14 | H15 | 43.4° | 60.0° |
| C16 | C15 | H16 | H17 | 119.1° | 120.0° |
| C15 | C16 | C18 | H24 | 0.4° | 0.2° |
| C17 | C23 | C25 | C24 | 1.7° | 0.0° |
| C17 | C23 | C25 | H18 | 180.0° | 180.0° |
| C17 | C23 | C25 | H19 | 178.3° | 180.0° |
| C15 | C14 | C13 | H14 | 120.2° | 120.0° |
| C15 | C14 | C13 | H15 | 120.2° | 120.0° |
| C15 | C14 | C13 | C2 | 174.4° | 180.0° |
| C15 | C14 | C13 | H12 | 53.9° | 60.0° |
| C15 | C14 | C13 | H13 | 65.1° | 60.0° |
| C15 | C14 | H14 | H15 | 119.6° | 120.0° |
| C14 | C15 | H16 | H17 | 119.1° | 120.0° |
| C24 | C25 | C23 | H19 | 180.0° | 180.0° |
| C24 | C25 | C23 | H18 | 178.3° | 180.0° |
| C25 | C24 | C22 | H21 | 178.9° | 179.9° |
| O10 | N9 | C11 | C4 | 179.7° | 180.0° |
| O10 | N9 | C4 | O12 | 0.1° | 180.0° |
| O10 | N9 | C4 | C3 | 174.9° | 0.2° |
| O10 | N9 | C11 | H2 | 180.0° | 90.0° |
| O10 | N9 | C11 | H3 | 60.0° | 30.0° |
| O10 | N9 | C11 | H4 | 60.0° | 150.0° |
| C23 | C25 | C24 | H20 | 178.2° | 179.9° |
| C11 | N9 | C4 | O12 | 179.8° | 0.0° |
| C11 | N9 | C4 | C3 | 5.4° | 179.7° |
| C11 | N9 | O10 | H1 | 179.8° | 0.0° |
| N9 | C11 | H2 | H3 | 120.0° | 120.0° |
| N9 | C11 | H2 | H4 | 120.0° | 120.0° |
| N9 | C11 | H3 | H4 | 119.9° | 120.0° |
| C14 | C13 | C2 | H12 | 120.5° | 120.0° |
| C14 | C13 | C2 | H13 | 120.5° | 120.0° |
| C14 | C13 | C2 | C3 | 64.7° | 175.0° |
| C14 | C13 | C2 | C1 | 60.2° | 65.0° |
| C14 | C13 | C2 | H7 | 177.9° | 55.1° |
| C14 | C13 | H12 | H13 | 118.5° | 119.9° |
| C13 | C14 | H14 | H15 | 119.5° | 120.0° |
| C13 | C14 | C15 | H16 | 43.5° | 60.0° |
| C13 | C14 | C15 | H17 | 162.9° | 60.0° |
| C13 | C2 | C3 | C4 | 88.5° | 66.7° |
| C13 | C2 | C3 | C1 | 125.4° | 120.0° |
| C13 | C2 | C3 | H7 | 117.3° | 120.0° |
| C13 | C2 | C1 | H7 | 117.4° | 120.1° |
| C13 | C2 | C1 | P5 | 97.5° | 164.3° |
| C13 | C2 | C3 | H5 | 31.4° | 53.4° |
| C13 | C2 | C3 | H6 | 151.7° | 173.3° |
| C13 | C2 | C1 | H8 | 22.6° | 44.3° |
| C13 | C2 | C1 | H9 | 142.4° | 75.7° |
| C2 | C13 | H12 | H13 | 118.5° | 120.1° |
| C2 | C13 | C14 | H14 | 65.5° | 60.0° |
| C2 | C13 | C14 | H15 | 54.2° | 60.0° |
| N9 | C4 | O12 | C3 | 175.0° | 179.8° |
| N9 | C4 | C3 | C2 | 97.6° | 175.7° |
| C4 | N9 | O10 | H1 | 0.1° | 180.0° |
| C4 | N9 | C11 | H2 | 0.3° | 90.0° |
| C4 | N9 | C11 | H3 | 120.3° | 150.0° |
| C4 | N9 | C11 | H4 | 119.7° | 30.1° |
| N9 | C4 | C3 | H5 | 22.3° | 64.3° |
| N9 | C4 | C3 | H6 | 142.6° | 55.8° |
| O8 | P5 | C1 | C2 | 38.6° | 56.5° |
| O8 | P5 | C1 | O6 | 119.3° | 120.0° |
| O8 | P5 | C1 | O7 | 121.9° | 120.0° |
| O8 | P5 | O6 | O7 | 121.3° | 120.0° |
| O8 | P5 | C1 | H8 | 81.5° | 63.5° |
| O8 | P5 | C1 | H9 | 158.7° | 176.4° |
| O8 | P5 | O6 | H10 | 0.0° | 60.0° |
| O8 | P5 | O7 | H11 | 0.0° | 180.0° |
| O12 | C4 | C3 | C2 | 77.4° | 4.0° |
| O12 | C4 | C3 | H5 | 162.8° | 115.9° |
| O12 | C4 | C3 | H6 | 42.5° | 124.0° |
| C4 | C3 | C2 | H5 | 119.8° | 120.0° |
| C4 | C3 | C2 | H6 | 119.8° | 120.0° |
| C4 | C3 | C2 | C1 | 146.1° | 173.3° |
| C4 | C3 | H5 | H6 | 120.4° | 120.1° |
| C4 | C3 | C2 | H7 | 28.8° | 53.3° |
| C3 | C2 | C1 | H7 | 117.2° | 119.9° |
| C3 | C2 | C1 | P5 | 137.1° | 75.7° |
| C2 | C3 | H5 | H6 | 120.5° | 119.9° |
| C3 | C2 | C1 | H8 | 102.8° | 164.3° |
| C3 | C2 | C1 | H9 | 17.0° | 44.3° |
| C3 | C2 | C13 | H12 | 55.7° | 55.0° |
| C3 | C2 | C13 | H13 | 174.8° | 65.1° |
| C2 | C1 | P5 | H8 | 120.1° | 120.0° |
| C2 | C1 | P5 | H9 | 120.1° | 120.0° |
| C2 | C1 | P5 | O6 | 157.8° | 176.5° |
| C2 | C1 | P5 | O7 | 83.3° | 63.6° |
| C1 | C2 | C3 | H5 | 94.1° | 66.7° |
| C1 | C2 | C3 | H6 | 26.3° | 53.3° |
| C2 | C1 | H8 | H9 | 119.7° | 120.0° |
| C1 | C2 | C13 | H12 | 179.3° | 175.0° |
| C1 | C2 | C13 | H13 | 60.3° | 55.0° |
| C1 | P5 | O6 | O7 | 119.3° | 120.0° |
| P5 | C1 | C2 | H7 | 19.9° | 44.3° |
| P5 | C1 | H8 | H9 | 119.7° | 120.0° |
| C1 | P5 | O6 | H10 | 119.4° | 180.0° |
| C1 | P5 | O7 | H11 | 121.4° | 60.0° |
| O6 | P5 | C1 | H8 | 37.7° | 56.5° |
| O6 | P5 | C1 | H9 | 82.0° | 63.5° |
| O6 | P5 | O7 | H11 | 120.7° | 60.0° |
| O7 | P5 | C1 | H8 | 156.6° | 176.5° |
| O7 | P5 | C1 | H9 | 36.8° | 56.4° |
| O7 | P5 | O6 | H10 | 121.3° | 60.0° |
| H2 | C11 | H3 | H4 | 120.0° | 120.0° |
| H5 | C3 | C2 | H7 | 148.6° | 173.3° |
| H6 | C3 | C2 | H7 | 91.0° | 66.7° |
| H7 | C2 | C1 | H8 | 140.0° | 75.7° |
| H7 | C2 | C1 | H9 | 100.2° | 164.2° |
| H7 | C2 | C13 | H12 | 61.7° | 64.9° |
| H7 | C2 | C13 | H13 | 57.4° | 175.0° |
| H12 | C13 | C14 | H14 | 174.0° | 179.9° |
| H12 | C13 | C14 | H15 | 66.3° | 60.0° |
| H13 | C13 | C14 | H14 | 55.1° | 60.1° |
| H13 | C13 | C14 | H15 | 174.7° | 180.0° |
| H14 | C14 | C15 | H16 | 76.7° | 180.0° |
| H14 | C14 | C15 | H17 | 42.8° | 60.0° |
| H15 | C14 | C15 | H16 | 163.7° | 60.0° |
| H15 | C14 | C15 | H17 | 76.9° | 180.0° |
| H18 | C23 | C25 | H19 | 1.7° | 0.1° |
| H19 | C25 | C24 | H20 | 1.7° | 0.1° |
| H20 | C24 | C22 | H21 | 1.1° | 0.1° |
| H22 | C21 | C20 | H23 | 0.4° | 0.1° |
| H23 | C20 | C18 | H24 | 1.2° | 0.2° |
