LZ6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O37 | C35 | doub | 1.21Å | 1.25Å | |
| C34 | C35 | sing | 1.51Å | 1.52Å | |
| C35 | O36 | sing | 1.34Å | 1.25Å | |
| O36 | HO36 | sing | 0.97Å | 0.95Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C34 | N38 | sing | 1.47Å | 1.46Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| N38 | HN38 | sing | 1.01Å | 1.00Å | |
| N38 | HN3A | sing | 1.01Å | 1.00Å | |
| C32 | C33 | sing | 1.53Å | 1.54Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C30 | C32 | sing | 1.51Å | 1.51Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| N29 | C30 | sing | 1.35Å | 1.32Å | |
| C30 | O31 | doub | 1.21Å | 1.22Å | |
| C21 | N29 | sing | 1.47Å | 1.45Å | |
| N29 | HN29 | sing | 0.97Å | 1.00Å | |
| C22 | C21 | sing | 1.51Å | 1.50Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| N23 | C22 | sing | 1.35Å | 1.33Å | |
| O28 | C22 | doub | 1.21Å | 1.21Å | |
| C24 | N23 | sing | 1.47Å | 1.45Å | |
| N23 | HN23 | sing | 0.97Å | 1.00Å | |
| C25 | C24 | sing | 1.51Å | 1.50Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| O26 | C25 | doub | 1.21Å | 1.25Å | |
| C25 | O27 | sing | 1.34Å | 1.26Å | |
| O27 | HO27 | sing | 0.97Å | 0.95Å | |
| S13 | C20 | sing | 1.81Å | 1.75Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| S13 | C12 | sing | 1.81Å | 1.78Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| N7 | C11 | sing | 1.46Å | 1.47Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C8 | N7 | sing | 1.46Å | 1.47Å | |
| C1 | N7 | sing | 1.40Å | 1.41Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| CL10 | C9 | sing | 1.80Å | 1.79Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C6 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | C4 | sing | 1.51Å | 1.52Å | |
| C4 | C3 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | C17 | sing | 1.51Å | 1.51Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| O18 | C17 | doub | 1.21Å | 1.26Å | |
| C17 | O19 | sing | 1.34Å | 1.25Å | |
| O19 | HO19 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O37 | C35 | C34 | 118.8° | 120.0° |
| O37 | C35 | O36 | 121.5° | 120.0° |
| C34 | C35 | O36 | 119.7° | 120.0° |
| C35 | C34 | C33 | 109.6° | 109.5° |
| C35 | C34 | N38 | 109.8° | 109.4° |
| C35 | C34 | H34 | 109.0° | 109.5° |
| C35 | O36 | HO36 | 109.5° | 117.0° |
| C33 | C34 | N38 | 108.9° | 109.5° |
| C33 | C34 | H34 | 109.9° | 109.5° |
| C34 | C33 | C32 | 114.5° | 109.5° |
| C34 | C33 | H33 | 107.8° | 109.5° |
| C34 | C33 | H33A | 106.7° | 109.5° |
| N38 | C34 | H34 | 109.7° | 109.5° |
| C34 | N38 | HN38 | 109.5° | 111.0° |
| C34 | N38 | HN3A | 109.4° | 111.0° |
| HN38 | N38 | HN3A | 109.5° | 111.0° |
| C32 | C33 | H33 | 107.8° | 109.5° |
| C32 | C33 | H33A | 106.7° | 109.4° |
| C33 | C32 | C30 | 110.0° | 109.5° |
| C33 | C32 | H32 | 109.3° | 109.5° |
| C33 | C32 | H32A | 109.2° | 109.4° |
| H33 | C33 | H33A | 113.5° | 109.5° |
| C30 | C32 | H32 | 109.3° | 109.5° |
| C30 | C32 | H32A | 109.2° | 109.4° |
| C32 | C30 | N29 | 113.9° | 120.0° |
| C32 | C30 | O31 | 120.1° | 120.0° |
| H32 | C32 | H32A | 109.9° | 109.5° |
| N29 | C30 | O31 | 126.0° | 120.0° |
| C30 | N29 | C21 | 117.8° | 120.0° |
| C30 | N29 | HN29 | 121.1° | 120.0° |
| C21 | N29 | HN29 | 121.1° | 120.0° |
| N29 | C21 | C22 | 111.7° | 109.4° |
| N29 | C21 | C20 | 110.3° | 109.5° |
| N29 | C21 | H21 | 108.9° | 109.5° |
| C22 | C21 | C20 | 113.7° | 109.5° |
| C22 | C21 | H21 | 105.2° | 109.5° |
| C21 | C22 | N23 | 113.7° | 120.0° |
| C21 | C22 | O28 | 121.5° | 120.1° |
| C20 | C21 | H21 | 106.7° | 109.5° |
| C21 | C20 | S13 | 112.3° | 109.5° |
| C21 | C20 | H20 | 108.5° | 109.4° |
| C21 | C20 | H20A | 107.9° | 109.4° |
| N23 | C22 | O28 | 124.8° | 120.0° |
| C22 | N23 | C24 | 121.7° | 120.0° |
| C22 | N23 | HN23 | 119.2° | 120.0° |
| C24 | N23 | HN23 | 119.2° | 120.0° |
| N23 | C24 | C25 | 113.1° | 109.5° |
| N23 | C24 | H24 | 108.3° | 109.5° |
| N23 | C24 | H24A | 107.4° | 109.4° |
| C25 | C24 | H24 | 108.3° | 109.5° |
| C25 | C24 | H24A | 107.5° | 109.4° |
| C24 | C25 | O26 | 116.7° | 120.0° |
| C24 | C25 | O27 | 120.5° | 120.0° |
| H24 | C24 | H24A | 112.4° | 109.5° |
| O26 | C25 | O27 | 122.8° | 120.0° |
| C25 | O27 | HO27 | 109.5° | 117.0° |
| S13 | C20 | H20 | 108.5° | 109.5° |
| S13 | C20 | H20A | 107.9° | 109.5° |
| C20 | S13 | C12 | 107.7° | 103.0° |
| H20 | C20 | H20A | 111.7° | 109.5° |
| S13 | C12 | C11 | 112.5° | 109.4° |
| S13 | C12 | H12 | 108.5° | 109.5° |
| S13 | C12 | H12A | 107.8° | 109.5° |
| C11 | C12 | H12 | 108.4° | 109.5° |
| C11 | C12 | H12A | 107.8° | 109.5° |
| C12 | C11 | N7 | 108.9° | 109.5° |
| C12 | C11 | H11 | 109.7° | 109.5° |
| C12 | C11 | H11A | 109.8° | 109.5° |
| H12 | C12 | H12A | 111.9° | 109.5° |
| N7 | C11 | H11 | 109.7° | 109.4° |
| N7 | C11 | H11A | 109.8° | 109.5° |
| C11 | N7 | C8 | 119.4° | 120.0° |
| C11 | N7 | C1 | 121.9° | 120.0° |
| H11 | C11 | H11A | 109.0° | 109.5° |
| C8 | N7 | C1 | 118.8° | 120.0° |
| N7 | C8 | C9 | 109.5° | 109.5° |
| N7 | C8 | H8 | 109.5° | 109.5° |
| N7 | C8 | H8A | 109.4° | 109.5° |
| N7 | C1 | C6 | 120.1° | 120.1° |
| N7 | C1 | C2 | 121.5° | 120.1° |
| C9 | C8 | H8 | 109.5° | 109.5° |
| C9 | C8 | H8A | 109.5° | 109.4° |
| C8 | C9 | CL10 | 108.7° | 109.5° |
| C8 | C9 | H9 | 109.8° | 109.5° |
| C8 | C9 | H9A | 109.9° | 109.4° |
| H8 | C8 | H8A | 109.5° | 109.4° |
| CL10 | C9 | H9 | 109.7° | 109.5° |
| CL10 | C9 | H9A | 109.9° | 109.5° |
| H9 | C9 | H9A | 108.8° | 109.4° |
| C6 | C1 | C2 | 118.4° | 119.8° |
| C1 | C6 | C5 | 121.0° | 120.0° |
| C1 | C6 | H6 | 119.5° | 120.0° |
| C1 | C2 | C3 | 120.5° | 119.9° |
| C1 | C2 | H2 | 119.8° | 120.0° |
| C5 | C6 | H6 | 119.5° | 120.0° |
| C6 | C5 | C4 | 120.5° | 120.0° |
| C6 | C5 | H5 | 119.7° | 120.0° |
| C4 | C5 | H5 | 119.8° | 119.9° |
| C5 | C4 | C14 | 119.5° | 119.9° |
| C5 | C4 | C3 | 118.6° | 120.2° |
| C14 | C4 | C3 | 121.9° | 119.9° |
| C4 | C14 | C15 | 112.4° | 109.5° |
| C4 | C14 | H14 | 108.5° | 109.5° |
| C4 | C14 | H14A | 107.9° | 109.5° |
| C4 | C3 | C2 | 121.0° | 120.1° |
| C4 | C3 | H3 | 119.5° | 120.0° |
| C2 | C3 | H3 | 119.5° | 120.0° |
| C3 | C2 | H2 | 119.8° | 120.0° |
| C15 | C14 | H14 | 108.5° | 109.4° |
| C15 | C14 | H14A | 107.9° | 109.5° |
| C14 | C15 | C16 | 112.3° | 109.5° |
| C14 | C15 | H15 | 108.6° | 109.5° |
| C14 | C15 | H15A | 107.9° | 109.5° |
| H14 | C14 | H14A | 111.7° | 109.5° |
| C16 | C15 | H15 | 108.5° | 109.5° |
| C16 | C15 | H15A | 107.9° | 109.4° |
| C15 | C16 | C17 | 108.9° | 109.5° |
| C15 | C16 | H16 | 109.7° | 109.4° |
| C15 | C16 | H16A | 109.8° | 109.5° |
| H15 | C15 | H15A | 111.7° | 109.5° |
| C17 | C16 | H16 | 109.7° | 109.5° |
| C17 | C16 | H16A | 109.8° | 109.5° |
| C16 | C17 | O18 | 118.6° | 120.0° |
| C16 | C17 | O19 | 118.5° | 120.0° |
| H16 | C16 | H16A | 109.0° | 109.4° |
| O18 | C17 | O19 | 122.9° | 120.0° |
| C17 | O19 | HO19 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O37 | C35 | C34 | O36 | 179.2° | 179.8° |
| O37 | C35 | O36 | HO36 | 0.0° | 0.0° |
| O37 | C35 | C34 | C33 | 86.5° | 99.9° |
| O37 | C35 | C34 | N38 | 153.9° | 20.1° |
| O37 | C35 | C34 | H34 | 33.7° | 140.0° |
| C34 | C35 | O36 | HO36 | 179.1° | 179.7° |
| C35 | C34 | C33 | N38 | 120.1° | 120.0° |
| C35 | C34 | C33 | H34 | 119.7° | 120.0° |
| C35 | C34 | N38 | H34 | 119.7° | 120.0° |
| C35 | C34 | N38 | HN38 | 145.3° | 60.0° |
| C35 | C34 | N38 | HN3A | 25.3° | 176.1° |
| C35 | C34 | C33 | C32 | 64.2° | 175.0° |
| C35 | C34 | C33 | H33 | 175.8° | 65.0° |
| C35 | C34 | C33 | H33A | 53.5° | 55.1° |
| O36 | C35 | C34 | C33 | 92.6° | 80.3° |
| O36 | C35 | C34 | N38 | 26.9° | 159.7° |
| O36 | C35 | C34 | H34 | 147.1° | 39.8° |
| C33 | C34 | N38 | H34 | 120.3° | 120.0° |
| C33 | C34 | N38 | HN38 | 94.7° | 60.0° |
| C33 | C34 | N38 | HN3A | 145.3° | 63.9° |
| C34 | C33 | C32 | H33 | 120.0° | 120.0° |
| C34 | C33 | C32 | H33A | 117.8° | 120.0° |
| C34 | C33 | H33 | H33A | 117.9° | 120.0° |
| C34 | C33 | C32 | C30 | 171.8° | 180.0° |
| C34 | C33 | C32 | H32 | 68.2° | 60.0° |
| C34 | C33 | C32 | H32A | 52.0° | 60.1° |
| C34 | N38 | HN38 | HN3A | 120.0° | 123.9° |
| N38 | C34 | C33 | C32 | 175.6° | 65.0° |
| N38 | C34 | C33 | H33 | 55.7° | 55.0° |
| N38 | C34 | C33 | H33A | 66.6° | 175.0° |
| H34 | C34 | N38 | HN38 | 25.6° | 180.0° |
| H34 | C34 | N38 | HN3A | 94.4° | 56.1° |
| H34 | C34 | C33 | C32 | 55.5° | 55.0° |
| H34 | C34 | C33 | H33 | 64.5° | 175.0° |
| H34 | C34 | C33 | H33A | 173.3° | 65.0° |
| C32 | C33 | H33 | H33A | 118.0° | 119.9° |
| C33 | C32 | C30 | H32 | 120.0° | 120.0° |
| C33 | C32 | C30 | H32A | 119.8° | 119.9° |
| C33 | C32 | H32 | H32A | 119.8° | 120.0° |
| C33 | C32 | C30 | N29 | 173.7° | 180.0° |
| C33 | C32 | C30 | O31 | 5.5° | 0.0° |
| H33 | C33 | C32 | C30 | 51.8° | 60.0° |
| H33 | C33 | C32 | H32 | 171.8° | 180.0° |
| H33 | C33 | C32 | H32A | 68.0° | 60.0° |
| H33A | C33 | C32 | C30 | 70.4° | 60.0° |
| H33A | C33 | C32 | H32 | 49.6° | 60.0° |
| H33A | C33 | C32 | H32A | 169.8° | 179.9° |
| C30 | C32 | H32 | H32A | 119.8° | 120.0° |
| C32 | C30 | N29 | O31 | 179.1° | 180.0° |
| C32 | C30 | N29 | C21 | 167.6° | 180.0° |
| C32 | C30 | N29 | HN29 | 12.4° | 0.0° |
| H32 | C32 | C30 | N29 | 66.3° | 60.0° |
| H32 | C32 | C30 | O31 | 114.5° | 120.0° |
| H32A | C32 | C30 | N29 | 53.9° | 60.1° |
| H32A | C32 | C30 | O31 | 125.3° | 119.9° |
| C30 | N29 | C21 | HN29 | 180.0° | 180.0° |
| C30 | N29 | C21 | C22 | 145.3° | 85.0° |
| C30 | N29 | C21 | C20 | 87.2° | 155.0° |
| C30 | N29 | C21 | H21 | 29.6° | 35.0° |
| O31 | C30 | N29 | C21 | 11.5° | 0.0° |
| O31 | C30 | N29 | HN29 | 168.5° | 180.0° |
| N29 | C21 | C22 | C20 | 125.7° | 120.0° |
| N29 | C21 | C22 | H21 | 118.0° | 120.0° |
| N29 | C21 | C20 | H21 | 118.2° | 120.0° |
| N29 | C21 | C22 | N23 | 162.3° | 180.0° |
| N29 | C21 | C22 | O28 | 16.6° | 0.0° |
| N29 | C21 | C20 | S13 | 76.6° | 60.0° |
| N29 | C21 | C20 | H20 | 163.4° | 60.0° |
| N29 | C21 | C20 | H20A | 42.2° | 180.0° |
| HN29 | N29 | C21 | C22 | 34.7° | 95.0° |
| HN29 | N29 | C21 | C20 | 92.8° | 25.0° |
| HN29 | N29 | C21 | H21 | 150.4° | 145.0° |
| C22 | C21 | C20 | H21 | 115.5° | 120.0° |
| C21 | C22 | N23 | O28 | 178.9° | 180.0° |
| C21 | C22 | N23 | C24 | 175.6° | 180.0° |
| C21 | C22 | N23 | HN23 | 4.4° | 0.0° |
| C22 | C21 | C20 | S13 | 49.8° | 179.9° |
| C22 | C21 | C20 | H20 | 70.2° | 60.0° |
| C22 | C21 | C20 | H20A | 168.6° | 60.0° |
| C20 | C21 | C22 | N23 | 72.0° | 60.0° |
| C20 | C21 | C22 | O28 | 109.0° | 120.0° |
| C21 | C20 | S13 | H20 | 120.0° | 119.9° |
| C21 | C20 | S13 | H20A | 118.8° | 120.0° |
| C21 | C20 | H20 | H20A | 118.9° | 119.9° |
| C21 | C20 | S13 | C12 | 173.7° | 180.0° |
| H21 | C21 | C22 | N23 | 44.3° | 60.0° |
| H21 | C21 | C22 | O28 | 134.6° | 120.0° |
| H21 | C21 | C20 | S13 | 165.2° | 60.0° |
| H21 | C21 | C20 | H20 | 45.2° | 180.0° |
| H21 | C21 | C20 | H20A | 76.0° | 60.0° |
| C22 | N23 | C24 | HN23 | 180.0° | 180.0° |
| C22 | N23 | C24 | C25 | 115.2° | 180.0° |
| C22 | N23 | C24 | H24 | 124.8° | 60.0° |
| C22 | N23 | C24 | H24A | 3.2° | 60.0° |
| O28 | C22 | N23 | C24 | 3.4° | 0.0° |
| O28 | C22 | N23 | HN23 | 176.6° | 180.0° |
| N23 | C24 | C25 | H24 | 120.0° | 120.0° |
| N23 | C24 | C25 | H24A | 118.4° | 119.9° |
| N23 | C24 | H24 | H24A | 118.5° | 120.0° |
| N23 | C24 | C25 | O26 | 168.6° | 0.0° |
| N23 | C24 | C25 | O27 | 11.8° | 180.0° |
| HN23 | N23 | C24 | C25 | 64.8° | 0.0° |
| HN23 | N23 | C24 | H24 | 55.2° | 120.0° |
| HN23 | N23 | C24 | H24A | 176.7° | 120.0° |
| C25 | C24 | H24 | H24A | 118.5° | 120.0° |
| C24 | C25 | O26 | O27 | 179.7° | 180.0° |
| C24 | C25 | O27 | HO27 | 179.7° | 179.9° |
| H24 | C24 | C25 | O26 | 48.6° | 120.0° |
| H24 | C24 | C25 | O27 | 131.7° | 60.0° |
| H24A | C24 | C25 | O26 | 73.0° | 120.0° |
| H24A | C24 | C25 | O27 | 106.7° | 60.1° |
| O26 | C25 | O27 | HO27 | 0.0° | 0.0° |
| S13 | C20 | H20 | H20A | 118.9° | 120.1° |
| C20 | S13 | C12 | C11 | 60.8° | 180.0° |
| C20 | S13 | C12 | H12 | 59.2° | 60.0° |
| C20 | S13 | C12 | H12A | 179.5° | 60.0° |
| H20 | C20 | S13 | C12 | 53.7° | 60.1° |
| H20A | C20 | S13 | C12 | 67.5° | 60.0° |
| S13 | C12 | C11 | H12 | 120.0° | 120.0° |
| S13 | C12 | C11 | H12A | 118.7° | 120.0° |
| S13 | C12 | H12 | H12A | 118.8° | 120.0° |
| S13 | C12 | C11 | N7 | 69.8° | 180.0° |
| S13 | C12 | C11 | H11 | 50.2° | 60.0° |
| S13 | C12 | C11 | H11A | 170.0° | 60.0° |
| C11 | C12 | H12 | H12A | 118.7° | 120.0° |
| C12 | C11 | N7 | H11 | 120.0° | 120.0° |
| C12 | C11 | N7 | H11A | 120.3° | 120.1° |
| C12 | C11 | H11 | H11A | 120.2° | 120.1° |
| C12 | C11 | N7 | C8 | 100.9° | 90.0° |
| C12 | C11 | N7 | C1 | 78.4° | 90.0° |
| H12 | C12 | C11 | N7 | 170.2° | 60.0° |
| H12 | C12 | C11 | H11 | 69.8° | 180.0° |
| H12 | C12 | C11 | H11A | 49.9° | 60.0° |
| H12A | C12 | C11 | N7 | 48.9° | 60.0° |
| H12A | C12 | C11 | H11 | 168.9° | 59.9° |
| H12A | C12 | C11 | H11A | 71.4° | 180.0° |
| N7 | C11 | H11 | H11A | 120.3° | 120.0° |
| C11 | N7 | C8 | C1 | 179.3° | 180.0° |
| C11 | N7 | C8 | C9 | 89.0° | 90.0° |
| C11 | N7 | C8 | H8 | 151.0° | 150.0° |
| C11 | N7 | C8 | H8A | 31.0° | 30.0° |
| C11 | N7 | C1 | C6 | 175.6° | 0.3° |
| C11 | N7 | C1 | C2 | 4.6° | 180.0° |
| H11 | C11 | N7 | C8 | 19.1° | 30.0° |
| H11 | C11 | N7 | C1 | 161.6° | 150.0° |
| H11A | C11 | N7 | C8 | 138.9° | 149.9° |
| H11A | C11 | N7 | C1 | 41.9° | 30.1° |
| N7 | C8 | C9 | H8 | 120.0° | 120.1° |
| N7 | C8 | C9 | H8A | 120.0° | 120.0° |
| N7 | C8 | H8 | H8A | 120.0° | 120.0° |
| N7 | C8 | C9 | CL10 | 147.0° | 180.0° |
| N7 | C8 | C9 | H9 | 93.0° | 59.9° |
| N7 | C8 | C9 | H9A | 26.7° | 60.0° |
| C8 | N7 | C1 | C6 | 5.1° | 179.7° |
| C8 | N7 | C1 | C2 | 174.6° | 0.0° |
| C1 | N7 | C8 | C9 | 91.7° | 90.0° |
| C1 | N7 | C8 | H8 | 28.3° | 30.0° |
| C1 | N7 | C8 | H8A | 148.3° | 150.0° |
| N7 | C1 | C6 | C2 | 179.8° | 179.8° |
| N7 | C1 | C6 | C5 | 180.0° | 180.0° |
| N7 | C1 | C6 | H6 | 0.0° | 0.1° |
| N7 | C1 | C2 | C3 | 179.9° | 179.8° |
| N7 | C1 | C2 | H2 | 0.1° | 0.1° |
| C9 | C8 | H8 | H8A | 120.0° | 119.9° |
| C8 | C9 | CL10 | H9 | 120.0° | 120.1° |
| C8 | C9 | CL10 | H9A | 120.3° | 120.0° |
| C8 | C9 | H9 | H9A | 120.3° | 119.9° |
| H8 | C8 | C9 | CL10 | 27.0° | 59.9° |
| H8 | C8 | C9 | H9 | 147.0° | 180.0° |
| H8 | C8 | C9 | H9A | 93.3° | 60.1° |
| H8A | C8 | C9 | CL10 | 93.0° | 60.0° |
| H8A | C8 | C9 | H9 | 27.0° | 60.1° |
| H8A | C8 | C9 | H9A | 146.7° | NaN° |
| CL10 | C9 | H9 | H9A | 120.3° | 120.0° |
| C1 | C6 | C5 | H6 | 180.0° | 179.9° |
| C1 | C6 | C5 | C4 | 0.2° | 0.0° |
| C1 | C6 | C5 | H5 | 179.8° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.5° |
| C6 | C1 | C2 | H2 | 179.9° | 179.7° |
| C2 | C1 | C6 | C5 | 0.2° | 0.2° |
| C2 | C1 | C6 | H6 | 179.8° | 179.9° |
| C1 | C2 | C3 | C4 | 0.4° | 0.5° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | H3 | 179.6° | 179.7° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C14 | 179.8° | 180.0° |
| C6 | C5 | C4 | C3 | 0.7° | 0.0° |
| H6 | C6 | C5 | C4 | 179.8° | 179.9° |
| H6 | C6 | C5 | H5 | 0.2° | 0.1° |
| C5 | C4 | C14 | C3 | 179.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.8° | 0.2° |
| C5 | C4 | C3 | H3 | 179.2° | 180.0° |
| C5 | C4 | C14 | C15 | 141.7° | 90.0° |
| C5 | C4 | C14 | H14 | 98.2° | 150.0° |
| C5 | C4 | C14 | H14A | 23.0° | 30.0° |
| H5 | C5 | C4 | C14 | 0.2° | 0.0° |
| H5 | C5 | C4 | C3 | 179.3° | 180.0° |
| C14 | C4 | C3 | C2 | 179.8° | 179.8° |
| C14 | C4 | C3 | H3 | 0.1° | 0.0° |
| C4 | C14 | C15 | H14 | 120.0° | 120.0° |
| C4 | C14 | C15 | H14A | 118.8° | 120.0° |
| C4 | C14 | H14 | H14A | 118.8° | 120.0° |
| C4 | C14 | C15 | C16 | 123.4° | 180.0° |
| C4 | C14 | C15 | H15 | 3.4° | 60.0° |
| C4 | C14 | C15 | H15A | 117.8° | 60.0° |
| C4 | C3 | C2 | H3 | 180.0° | 179.8° |
| C4 | C3 | C2 | H2 | 179.6° | 179.7° |
| C3 | C4 | C14 | C15 | 39.2° | 90.0° |
| C3 | C4 | C14 | H14 | 80.8° | 30.0° |
| C3 | C4 | C14 | H14A | 158.0° | 150.0° |
| H3 | C3 | C2 | H2 | 0.4° | 0.1° |
| C15 | C14 | H14 | H14A | 118.8° | 120.0° |
| C14 | C15 | C16 | H15 | 120.0° | 120.0° |
| C14 | C15 | C16 | H15A | 118.8° | 120.0° |
| C14 | C15 | H15 | H15A | 118.9° | 120.0° |
| C14 | C15 | C16 | C17 | 170.0° | 180.0° |
| C14 | C15 | C16 | H16 | 50.0° | 60.0° |
| C14 | C15 | C16 | H16A | 69.8° | 59.9° |
| H14 | C14 | C15 | C16 | 116.6° | 60.0° |
| H14 | C14 | C15 | H15 | 123.4° | 180.0° |
| H14 | C14 | C15 | H15A | 2.2° | 60.0° |
| H14A | C14 | C15 | C16 | 4.6° | 60.0° |
| H14A | C14 | C15 | H15 | 115.4° | 60.0° |
| H14A | C14 | C15 | H15A | 123.4° | 179.9° |
| C16 | C15 | H15 | H15A | 118.8° | 120.0° |
| C15 | C16 | C17 | H16 | 120.0° | 120.0° |
| C15 | C16 | C17 | H16A | 120.2° | 120.0° |
| C15 | C16 | H16 | H16A | 120.3° | 119.9° |
| C15 | C16 | C17 | O18 | 94.6° | 0.0° |
| C15 | C16 | C17 | O19 | 85.5° | 180.0° |
| H15 | C15 | C16 | C17 | 70.0° | 60.0° |
| H15 | C15 | C16 | H16 | 170.0° | 180.0° |
| H15 | C15 | C16 | H16A | 50.3° | 60.0° |
| H15A | C15 | C16 | C17 | 51.2° | 60.0° |
| H15A | C15 | C16 | H16 | 68.8° | 60.0° |
| H15A | C15 | C16 | H16A | 171.4° | 179.9° |
| C17 | C16 | H16 | H16A | 120.2° | 120.1° |
| C16 | C17 | O18 | O19 | 179.9° | 180.0° |
| C16 | C17 | O19 | HO19 | 179.8° | 180.0° |
| H16 | C16 | C17 | O18 | 25.4° | 120.0° |
| H16 | C16 | C17 | O19 | 154.5° | 60.0° |
| H16A | C16 | C17 | O18 | 145.1° | 120.0° |
| H16A | C16 | C17 | O19 | 34.8° | 60.0° |
| O18 | C17 | O19 | HO19 | 0.0° | 0.0° |
