NG9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C17 | O2 | doub | 1.21Å | 1.23Å | |
| C17 | N3 | sing | 1.35Å | 1.33Å | |
| C24 | C22 | sing | 1.53Å | 1.52Å | |
| C23 | C22 | sing | 1.55Å | 1.53Å | |
| N3 | C16 | sing | 1.47Å | 1.47Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | N2 | sing | 1.47Å | 1.48Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C15 | C19 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C20 | N2 | sing | 1.47Å | 1.47Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.52Å | 1.53Å | |
| C22 | O3 | sing | 1.41Å | 1.45Å | |
| N2 | C12 | sing | 1.35Å | 1.35Å | |
| C21 | C5 | sing | 1.52Å | 1.55Å | |
| C12 | O1 | doub | 1.21Å | 1.23Å | |
| C12 | C5 | sing | 1.52Å | 1.54Å | |
| O3 | C2 | sing | 1.41Å | 1.45Å | |
| C5 | N1 | sing | 1.46Å | 1.47Å | |
| C5 | C4 | sing | 1.52Å | 1.54Å | |
| N1 | C6 | sing | 1.40Å | 1.40Å | |
| C4 | C2 | sing | 1.52Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.55Å | 1.53Å | |
| C6 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.37Å | Aromatic |
| C9 | CL2 | sing | 1.74Å | 1.74Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.10Å | 1.10Å | |
| C4 | H8 | sing | 1.10Å | 1.10Å | |
| C10 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| N1 | H12 | sing | 0.97Å | 1.00Å | |
| C7 | H13 | sing | 1.08Å | 1.08Å | |
| C8 | H14 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.08Å | 1.08Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| N3 | H21 | sing | 0.97Å | 1.00Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | CL1 | sing | 1.80Å | 1.07Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.10Å | 1.10Å | |
| C21 | H30 | sing | 1.10Å | 1.10Å | |
| C23 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C24 | H34 | sing | 1.09Å | 1.10Å | |
| C24 | H35 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | C17 | O2 | 115.6° | 120.0° |
| C18 | C17 | N3 | 122.2° | 120.0° |
| C17 | C18 | H22 | 109.6° | 109.4° |
| C17 | C18 | H23 | 109.5° | 109.4° |
| C17 | C18 | CL1 | 109.2° | 109.5° |
| O2 | C17 | N3 | 122.2° | 120.0° |
| C17 | N3 | C16 | 123.0° | 120.0° |
| C17 | N3 | H21 | 118.5° | 120.0° |
| C24 | C22 | C23 | 110.7° | 106.7° |
| C24 | C22 | C21 | 109.0° | 110.2° |
| C24 | C22 | O3 | 107.0° | 111.0° |
| C22 | C24 | H34 | 109.5° | 109.5° |
| C22 | C24 | H35 | 109.4° | 109.5° |
| C22 | C24 | H36 | 109.5° | 109.5° |
| C23 | C22 | C21 | 110.0° | 107.3° |
| C23 | C22 | O3 | 108.5° | 107.7° |
| C22 | C23 | H31 | 109.5° | 109.5° |
| C22 | C23 | H32 | 109.5° | 109.5° |
| C22 | C23 | H33 | 109.5° | 109.5° |
| N3 | C16 | C15 | 114.3° | 109.4° |
| N3 | C16 | H19 | 108.3° | 109.5° |
| N3 | C16 | H20 | 108.2° | 109.5° |
| C16 | N3 | H21 | 118.5° | 120.1° |
| C14 | C13 | N2 | 110.6° | 108.8° |
| C13 | C14 | C15 | 111.6° | 109.3° |
| C14 | C13 | H10 | 109.2° | 109.6° |
| C14 | C13 | H11 | 109.2° | 109.6° |
| C13 | C14 | H16 | 108.9° | 109.5° |
| C13 | C14 | H17 | 108.9° | 109.5° |
| C13 | N2 | C20 | 111.4° | 118.8° |
| C13 | N2 | C12 | 127.2° | 120.6° |
| N2 | C13 | H10 | 109.2° | 109.6° |
| N2 | C13 | H11 | 109.2° | 109.6° |
| C14 | C15 | C19 | 111.7° | 109.5° |
| C14 | C15 | C16 | 111.7° | 109.4° |
| C15 | C14 | H16 | 108.9° | 109.5° |
| C15 | C14 | H17 | 108.9° | 109.5° |
| C14 | C15 | H18 | 107.5° | 109.5° |
| C19 | C15 | C16 | 110.6° | 109.5° |
| C15 | C19 | C20 | 111.7° | 109.3° |
| C19 | C15 | H18 | 107.5° | 109.5° |
| C15 | C19 | H25 | 108.9° | 109.5° |
| C15 | C19 | H26 | 109.0° | 109.5° |
| C16 | C15 | H18 | 107.6° | 109.4° |
| C15 | C16 | H19 | 108.3° | 109.5° |
| C15 | C16 | H20 | 108.3° | 109.5° |
| N2 | C20 | C19 | 110.6° | 108.8° |
| C20 | N2 | C12 | 121.3° | 120.6° |
| N2 | C20 | H27 | 109.2° | 109.6° |
| N2 | C20 | H28 | 109.2° | 109.6° |
| C20 | C19 | H25 | 108.9° | 109.5° |
| C20 | C19 | H26 | 108.9° | 109.5° |
| C19 | C20 | H27 | 109.2° | 109.6° |
| C19 | C20 | H28 | 109.2° | 109.6° |
| C21 | C22 | O3 | 111.7° | 113.5° |
| C22 | C21 | C5 | 115.5° | 113.1° |
| C22 | C21 | H29 | 107.9° | 109.0° |
| C22 | C21 | H30 | 108.0° | 109.1° |
| C22 | O3 | C2 | 121.9° | 123.9° |
| N2 | C12 | O1 | 118.9° | 120.0° |
| N2 | C12 | C5 | 123.0° | 120.0° |
| C21 | C5 | C12 | 108.5° | 107.9° |
| C21 | C5 | N1 | 109.7° | 111.1° |
| C21 | C5 | C4 | 110.9° | 111.2° |
| C5 | C21 | H29 | 108.0° | 109.1° |
| C5 | C21 | H30 | 107.9° | 109.1° |
| O1 | C12 | C5 | 118.1° | 120.0° |
| C12 | C5 | N1 | 112.6° | 107.4° |
| C12 | C5 | C4 | 106.7° | 107.9° |
| O3 | C2 | C4 | 108.7° | 113.6° |
| O3 | C2 | C1 | 109.3° | 111.0° |
| O3 | C2 | C3 | 105.3° | 107.7° |
| N1 | C5 | C4 | 108.5° | 111.2° |
| C5 | N1 | C6 | 126.0° | 120.0° |
| C5 | N1 | H12 | 105.2° | 120.0° |
| C5 | C4 | C2 | 114.0° | 113.2° |
| C5 | C4 | H7 | 108.3° | 109.1° |
| C5 | C4 | H8 | 108.3° | 109.1° |
| N1 | C6 | C11 | 117.1° | 120.1° |
| N1 | C6 | C7 | 124.7° | 120.1° |
| C6 | N1 | H12 | 105.2° | 120.1° |
| C4 | C2 | C1 | 110.5° | 110.2° |
| C4 | C2 | C3 | 111.5° | 107.3° |
| C2 | C4 | H7 | 108.3° | 109.1° |
| C2 | C4 | H8 | 108.3° | 109.0° |
| C1 | C2 | C3 | 111.4° | 106.7° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C2 | C3 | H4 | 109.5° | 109.4° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C11 | C6 | C7 | 118.2° | 119.9° |
| C6 | C11 | C10 | 120.7° | 120.0° |
| C6 | C11 | H15 | 119.7° | 120.0° |
| C6 | C7 | C8 | 120.6° | 119.9° |
| C6 | C7 | H13 | 119.7° | 120.1° |
| C11 | C10 | C9 | 119.8° | 120.1° |
| C11 | C10 | H9 | 120.1° | 120.0° |
| C10 | C11 | H15 | 119.7° | 120.1° |
| C7 | C8 | C9 | 119.7° | 120.1° |
| C8 | C7 | H13 | 119.7° | 120.0° |
| C7 | C8 | H14 | 120.2° | 120.0° |
| C10 | C9 | C8 | 121.0° | 120.1° |
| C10 | C9 | CL2 | 119.9° | 119.9° |
| C9 | C10 | H9 | 120.1° | 120.0° |
| C8 | C9 | CL2 | 119.0° | 120.0° |
| C9 | C8 | H14 | 120.1° | 119.9° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.4° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H4 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.4° | 109.5° |
| H7 | C4 | H8 | 109.5° | 107.2° |
| H10 | C13 | H11 | 109.4° | 109.6° |
| H16 | C14 | H17 | 109.5° | 109.5° |
| H19 | C16 | H20 | 109.5° | 109.5° |
| H22 | C18 | H23 | 109.4° | 109.4° |
| H22 | C18 | CL1 | 109.5° | 109.5° |
| H23 | C18 | CL1 | 109.6° | 109.5° |
| H25 | C19 | H26 | 109.5° | 109.5° |
| H27 | C20 | H28 | 109.5° | 109.7° |
| H29 | C21 | H30 | 109.5° | 107.3° |
| H31 | C23 | H32 | 109.5° | 109.4° |
| H31 | C23 | H33 | 109.5° | 109.4° |
| H32 | C23 | H33 | 109.5° | 109.5° |
| H34 | C24 | H35 | 109.5° | 109.4° |
| H34 | C24 | H36 | 109.4° | 109.5° |
| H35 | C24 | H36 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | C17 | O2 | N3 | 177.3° | 180.0° |
| C18 | C17 | N3 | C16 | 179.1° | 180.0° |
| C18 | C17 | N3 | H21 | 0.9° | 0.0° |
| C17 | C18 | H22 | H23 | 120.1° | 119.9° |
| C17 | C18 | H22 | CL1 | 119.7° | 120.1° |
| C17 | C18 | H23 | CL1 | 119.8° | 120.0° |
| O2 | C17 | N3 | C16 | 2.0° | 0.0° |
| O2 | C17 | N3 | H21 | 178.0° | 180.0° |
| O2 | C17 | C18 | H22 | 117.8° | 120.0° |
| O2 | C17 | C18 | H23 | 2.2° | 120.1° |
| O2 | C17 | C18 | CL1 | 122.2° | 0.0° |
| C17 | N3 | C16 | H21 | 180.0° | 180.0° |
| C17 | N3 | C16 | C15 | 119.3° | 180.0° |
| C17 | N3 | C16 | H19 | 120.0° | 60.0° |
| C17 | N3 | C16 | H20 | 1.4° | 60.0° |
| N3 | C17 | C18 | H22 | 59.5° | 59.9° |
| N3 | C17 | C18 | H23 | 179.5° | 59.9° |
| N3 | C17 | C18 | CL1 | 60.5° | 180.0° |
| C24 | C22 | C23 | C21 | 120.4° | 118.1° |
| C24 | C22 | C23 | O3 | 117.1° | 119.3° |
| C24 | C22 | C21 | O3 | 118.1° | 125.3° |
| C24 | C22 | C21 | C5 | 167.3° | 83.0° |
| C24 | C22 | O3 | C2 | 139.9° | 87.3° |
| C24 | C22 | C21 | H29 | 46.4° | 155.5° |
| C24 | C22 | C21 | H30 | 71.8° | 38.7° |
| C24 | C22 | C23 | H31 | 180.0° | 58.1° |
| C24 | C22 | C23 | H32 | 60.0° | 61.9° |
| C24 | C22 | C23 | H33 | 60.0° | 178.1° |
| C22 | C24 | H34 | H35 | 120.0° | 120.0° |
| C22 | C24 | H34 | H36 | 120.0° | 120.1° |
| C22 | C24 | H35 | H36 | 120.0° | 120.0° |
| C23 | C22 | C21 | O3 | 120.5° | 118.9° |
| C23 | C22 | C21 | C5 | 71.3° | 161.2° |
| C23 | C22 | O3 | C2 | 100.7° | 156.1° |
| C23 | C22 | C21 | H29 | 167.9° | 39.7° |
| C23 | C22 | C21 | H30 | 49.6° | 77.1° |
| C22 | C23 | H31 | H32 | 120.0° | 120.0° |
| C22 | C23 | H31 | H33 | 120.0° | 120.0° |
| C22 | C23 | H32 | H33 | 120.0° | 120.0° |
| C23 | C22 | C24 | H34 | 180.0° | 176.2° |
| C23 | C22 | C24 | H35 | 60.0° | 63.8° |
| C23 | C22 | C24 | H36 | 60.0° | 56.1° |
| N3 | C16 | C15 | C14 | 76.7° | 175.0° |
| N3 | C16 | C15 | C19 | 158.3° | 64.9° |
| N3 | C16 | C15 | H19 | 120.7° | 120.0° |
| N3 | C16 | C15 | H20 | 120.7° | 120.0° |
| N3 | C16 | C15 | H18 | 41.1° | 55.0° |
| N3 | C16 | H19 | H20 | 117.8° | 120.0° |
| C14 | C13 | N2 | H10 | 120.2° | 119.8° |
| C14 | C13 | N2 | H11 | 120.2° | 119.8° |
| C13 | C14 | C15 | H16 | 120.3° | 120.0° |
| C13 | C14 | C15 | H17 | 120.3° | 120.0° |
| C13 | C14 | C15 | C19 | 49.8° | 61.4° |
| C13 | C14 | C15 | C16 | 174.2° | 178.6° |
| C14 | C13 | N2 | C20 | 60.5° | 53.6° |
| C14 | C13 | N2 | C12 | 119.7° | 126.3° |
| C14 | C13 | H10 | H11 | 119.5° | 120.3° |
| C13 | C14 | H16 | H17 | 119.0° | 120.1° |
| C13 | C14 | C15 | H18 | 68.0° | 58.7° |
| N2 | C13 | C14 | C15 | 54.7° | 54.6° |
| C13 | N2 | C20 | C12 | 179.8° | 180.0° |
| C13 | N2 | C20 | C19 | 60.7° | 53.6° |
| C13 | N2 | C12 | O1 | 176.3° | 3.3° |
| C13 | N2 | C12 | C5 | 3.7° | 176.8° |
| N2 | C13 | H10 | H11 | 119.5° | 120.4° |
| N2 | C13 | C14 | H16 | 65.7° | 65.3° |
| N2 | C13 | C14 | H17 | 175.0° | 174.6° |
| C13 | N2 | C20 | H27 | 59.5° | 66.2° |
| C13 | N2 | C20 | H28 | 179.2° | 173.4° |
| C14 | C15 | C19 | C16 | 125.0° | 120.0° |
| C14 | C15 | C19 | H18 | 117.7° | 120.0° |
| C14 | C15 | C16 | H18 | 117.8° | 120.0° |
| C14 | C15 | C19 | C20 | 49.9° | 61.4° |
| C15 | C14 | C13 | H10 | 65.5° | 174.4° |
| C15 | C14 | C13 | H11 | 174.9° | 65.2° |
| C15 | C14 | H16 | H17 | 119.0° | 120.1° |
| C14 | C15 | C16 | H19 | 44.0° | 65.0° |
| C14 | C15 | C16 | H20 | 162.6° | 55.0° |
| C14 | C15 | C19 | H25 | 70.4° | 58.6° |
| C14 | C15 | C19 | H26 | 170.2° | 178.6° |
| C19 | C15 | C16 | H18 | 117.2° | 120.0° |
| C15 | C19 | C20 | N2 | 55.0° | 54.6° |
| C15 | C19 | C20 | H25 | 120.3° | 120.0° |
| C15 | C19 | C20 | H26 | 120.4° | 120.0° |
| C19 | C15 | C14 | H16 | 70.5° | 58.6° |
| C19 | C15 | C14 | H17 | 170.1° | 178.7° |
| C19 | C15 | C16 | H19 | 81.0° | 55.1° |
| C19 | C15 | C16 | H20 | 37.6° | 175.1° |
| C15 | C19 | H25 | H26 | 119.0° | 120.1° |
| C15 | C19 | C20 | H27 | 65.1° | 65.1° |
| C15 | C19 | C20 | H28 | 175.2° | 174.4° |
| C16 | C15 | C19 | C20 | 174.9° | 178.6° |
| C16 | C15 | C14 | H16 | 53.8° | 61.4° |
| C16 | C15 | C14 | H17 | 65.5° | 58.6° |
| C15 | C16 | H19 | H20 | 117.8° | 120.0° |
| C15 | C16 | N3 | H21 | 60.7° | 0.0° |
| C16 | C15 | C19 | H25 | 54.6° | 61.4° |
| C16 | C15 | C19 | H26 | 64.7° | 58.6° |
| N2 | C20 | C19 | H27 | 120.2° | 119.7° |
| N2 | C20 | C19 | H28 | 120.2° | 119.8° |
| C20 | N2 | C12 | O1 | 3.5° | 176.7° |
| C20 | N2 | C12 | C5 | 176.5° | 3.2° |
| C20 | N2 | C13 | H10 | 59.6° | 173.4° |
| C20 | N2 | C13 | H11 | 179.3° | 66.2° |
| N2 | C20 | C19 | H25 | 65.3° | 65.4° |
| N2 | C20 | C19 | H26 | 175.4° | 174.6° |
| N2 | C20 | H27 | H28 | 119.5° | 120.3° |
| C19 | C20 | N2 | C12 | 119.5° | 126.4° |
| C20 | C19 | C15 | H18 | 67.8° | 58.7° |
| C20 | C19 | H25 | H26 | 119.0° | 120.1° |
| C19 | C20 | H27 | H28 | 119.5° | 120.4° |
| C22 | C21 | C5 | H29 | 120.9° | 121.5° |
| C22 | C21 | C5 | H30 | 120.9° | 121.6° |
| C22 | C21 | C5 | C12 | 95.0° | 168.2° |
| C21 | C22 | O3 | C2 | 20.7° | 37.5° |
| C22 | C21 | C5 | N1 | 141.7° | 74.3° |
| C22 | C21 | C5 | C4 | 21.9° | 50.0° |
| C22 | C21 | H29 | H30 | 117.3° | 118.0° |
| C21 | C22 | C23 | H31 | 59.6° | 60.0° |
| C21 | C22 | C23 | H32 | 60.4° | 180.0° |
| C21 | C22 | C23 | H33 | 179.5° | 60.0° |
| C21 | C22 | C24 | H34 | 59.0° | 60.1° |
| C21 | C22 | C24 | H35 | 179.0° | 180.0° |
| C21 | C22 | C24 | H36 | 61.0° | 60.0° |
| O3 | C22 | C21 | C5 | 49.2° | 42.3° |
| C22 | O3 | C2 | C4 | 31.4° | 37.4° |
| C22 | O3 | C2 | C1 | 89.3° | 87.5° |
| C22 | O3 | C2 | C3 | 150.9° | 156.1° |
| O3 | C22 | C21 | H29 | 71.6° | 79.2° |
| O3 | C22 | C21 | H30 | 170.1° | 163.9° |
| O3 | C22 | C23 | H31 | 62.9° | 177.4° |
| O3 | C22 | C23 | H32 | 177.2° | 57.4° |
| O3 | C22 | C23 | H33 | 57.1° | 62.6° |
| O3 | C22 | C24 | H34 | 62.0° | 66.6° |
| O3 | C22 | C24 | H35 | 58.0° | 53.3° |
| O3 | C22 | C24 | H36 | 178.0° | 173.3° |
| N2 | C12 | C5 | C21 | 66.3° | 73.1° |
| N2 | C12 | O1 | C5 | 180.0° | 179.9° |
| N2 | C12 | C5 | N1 | 55.3° | 46.8° |
| N2 | C12 | C5 | C4 | 174.2° | 166.7° |
| C12 | N2 | C13 | H10 | 120.2° | 6.5° |
| C12 | N2 | C13 | H11 | 0.5° | 113.8° |
| C12 | N2 | C20 | H27 | 120.3° | 113.9° |
| C12 | N2 | C20 | H28 | 0.6° | 6.5° |
| C21 | C5 | C12 | O1 | 113.7° | 107.0° |
| C21 | C5 | C12 | N1 | 121.6° | 119.9° |
| C21 | C5 | C12 | C4 | 119.5° | 120.2° |
| C21 | C5 | N1 | C4 | 121.3° | 124.3° |
| C21 | C5 | N1 | C6 | 158.5° | 170.3° |
| C21 | C5 | C4 | C2 | 31.8° | 50.0° |
| C21 | C5 | C4 | H7 | 152.5° | 71.7° |
| C21 | C5 | C4 | H8 | 88.9° | 171.5° |
| C21 | C5 | N1 | H12 | 79.3° | 9.8° |
| C5 | C21 | H29 | H30 | 117.3° | 118.0° |
| O1 | C12 | C5 | N1 | 124.7° | 133.1° |
| O1 | C12 | C5 | C4 | 5.8° | 13.2° |
| C12 | C5 | N1 | C4 | 117.8° | 117.9° |
| C12 | C5 | N1 | C6 | 37.5° | 52.5° |
| C12 | C5 | C4 | C2 | 149.8° | 168.1° |
| C12 | C5 | C4 | H7 | 89.5° | 46.5° |
| C12 | C5 | C4 | H8 | 29.1° | 70.4° |
| C12 | C5 | N1 | H12 | 159.7° | 127.6° |
| C12 | C5 | C21 | H29 | 144.2° | 46.7° |
| C12 | C5 | C21 | H30 | 25.9° | 70.2° |
| O3 | C2 | C4 | C5 | 59.3° | 42.2° |
| O3 | C2 | C4 | C1 | 119.9° | 125.3° |
| O3 | C2 | C4 | C3 | 115.6° | 118.9° |
| O3 | C2 | C1 | C3 | 115.9° | 117.1° |
| O3 | C2 | C1 | H1 | 180.0° | 57.1° |
| O3 | C2 | C1 | H2 | 60.0° | 62.9° |
| O3 | C2 | C1 | H3 | 60.0° | 177.1° |
| O3 | C2 | C3 | H4 | 180.0° | 179.3° |
| O3 | C2 | C3 | H5 | 60.0° | 60.7° |
| O3 | C2 | C3 | H6 | 60.0° | 59.2° |
| O3 | C2 | C4 | H7 | 180.0° | 79.5° |
| O3 | C2 | C4 | H8 | 61.4° | 163.8° |
| C5 | N1 | C6 | H12 | 122.2° | 179.9° |
| N1 | C5 | C4 | C2 | 88.7° | 74.4° |
| C5 | N1 | C6 | C11 | 168.5° | 176.0° |
| C5 | N1 | C6 | C7 | 11.8° | 4.2° |
| N1 | C5 | C4 | H7 | 32.0° | 164.0° |
| N1 | C5 | C4 | H8 | 150.6° | 47.2° |
| N1 | C5 | C21 | H29 | 20.8° | 164.1° |
| N1 | C5 | C21 | H30 | 97.4° | 47.3° |
| C4 | C5 | N1 | C6 | 80.3° | 65.3° |
| C5 | C4 | C2 | H7 | 120.7° | 121.7° |
| C5 | C4 | C2 | H8 | 120.7° | 121.6° |
| C5 | C4 | C2 | C1 | 60.6° | 83.1° |
| C5 | C4 | C2 | C3 | 174.9° | 161.1° |
| C5 | C4 | H7 | H8 | 117.9° | 118.0° |
| C4 | C5 | N1 | H12 | 41.9° | 114.6° |
| C4 | C5 | C21 | H29 | 99.0° | 71.5° |
| C4 | C5 | C21 | H30 | 142.8° | 171.6° |
| N1 | C6 | C11 | C7 | 179.8° | 179.8° |
| N1 | C6 | C11 | C10 | 178.8° | 179.8° |
| N1 | C6 | C7 | C8 | 178.7° | 179.8° |
| N1 | C6 | C7 | H13 | 1.3° | 0.2° |
| N1 | C6 | C11 | H15 | 1.2° | 0.2° |
| C4 | C2 | C1 | C3 | 124.5° | 116.2° |
| C4 | C2 | C1 | H1 | 60.4° | 176.2° |
| C4 | C2 | C1 | H2 | 179.5° | 63.8° |
| C4 | C2 | C1 | H3 | 59.6° | 56.1° |
| C4 | C2 | C3 | H4 | 62.3° | 58.1° |
| C4 | C2 | C3 | H5 | 57.7° | 61.9° |
| C4 | C2 | C3 | H6 | 177.7° | 178.1° |
| C2 | C4 | H7 | H8 | 118.0° | 117.9° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | C3 | H4 | 61.7° | 60.1° |
| C1 | C2 | C3 | H5 | 178.3° | 180.0° |
| C1 | C2 | C3 | H6 | 58.3° | 60.0° |
| C1 | C2 | C4 | H7 | 60.1° | 155.3° |
| C1 | C2 | C4 | H8 | 178.7° | 38.5° |
| C3 | C2 | C1 | H1 | 64.1° | 60.0° |
| C3 | C2 | C1 | H2 | 55.9° | 180.0° |
| C3 | C2 | C1 | H3 | 175.9° | 60.1° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C3 | C2 | C4 | H7 | 64.4° | 39.4° |
| C3 | C2 | C4 | H8 | 54.3° | 77.3° |
| C6 | C11 | C10 | H15 | 180.0° | 180.0° |
| C11 | C6 | C7 | C8 | 1.6° | 0.1° |
| C6 | C11 | C10 | C9 | 2.1° | 0.0° |
| C6 | C11 | C10 | H9 | 177.9° | 180.0° |
| C11 | C6 | N1 | H12 | 69.3° | 4.1° |
| C11 | C6 | C7 | H13 | 178.4° | 180.0° |
| C7 | C6 | C11 | C10 | 1.4° | 0.0° |
| C6 | C7 | C8 | H13 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 2.3° | 0.0° |
| C7 | C6 | N1 | H12 | 110.4° | 175.7° |
| C6 | C7 | C8 | H14 | 177.7° | 179.9° |
| C7 | C6 | C11 | H15 | 178.5° | 179.9° |
| C11 | C10 | C9 | H9 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 2.8° | 0.0° |
| C11 | C10 | C9 | CL2 | 179.9° | 180.0° |
| C7 | C8 | C9 | C10 | 2.9° | 0.0° |
| C7 | C8 | C9 | H14 | 180.0° | 180.0° |
| C7 | C8 | C9 | CL2 | 179.8° | 180.0° |
| C10 | C9 | C8 | CL2 | 177.3° | 180.0° |
| C10 | C9 | C8 | H14 | 177.1° | 180.0° |
| C9 | C10 | C11 | H15 | 177.9° | 180.0° |
| C8 | C9 | C10 | H9 | 177.2° | 180.0° |
| C9 | C8 | C7 | H13 | 177.7° | 180.0° |
| CL2 | C9 | C10 | H9 | 0.1° | 0.0° |
| CL2 | C9 | C8 | H14 | 0.3° | 0.0° |
| H1 | C1 | H2 | H3 | 119.9° | 120.0° |
| H4 | C3 | H5 | H6 | 120.0° | 120.1° |
| H9 | C10 | C11 | H15 | 2.1° | 0.1° |
| H10 | C13 | C14 | H16 | 174.1° | 54.5° |
| H10 | C13 | C14 | H17 | 54.8° | 65.6° |
| H11 | C13 | C14 | H16 | 54.5° | 174.9° |
| H11 | C13 | C14 | H17 | 64.8° | 54.8° |
| H13 | C7 | C8 | H14 | 2.4° | 0.0° |
| H16 | C14 | C15 | H18 | 171.7° | 178.6° |
| H17 | C14 | C15 | H18 | 52.4° | 61.3° |
| H18 | C15 | C16 | H19 | 161.8° | 175.0° |
| H18 | C15 | C16 | H20 | 79.6° | 65.0° |
| H18 | C15 | C19 | H25 | 171.8° | 178.6° |
| H18 | C15 | C19 | H26 | 52.5° | 61.3° |
| H19 | C16 | N3 | H21 | 60.0° | 120.0° |
| H20 | C16 | N3 | H21 | 178.6° | 120.0° |
| H22 | C18 | H23 | CL1 | 120.1° | 120.1° |
| H25 | C19 | C20 | H27 | 174.5° | 174.9° |
| H25 | C19 | C20 | H28 | 54.9° | 54.5° |
| H26 | C19 | C20 | H27 | 55.2° | 54.9° |
| H26 | C19 | C20 | H28 | 64.5° | 65.6° |
| H31 | C23 | H32 | H33 | 120.0° | 119.9° |
| H34 | C24 | H35 | H36 | 120.0° | 120.0° |
