O3T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | N2 | sing | 1.47Å | 1.47Å | |
| C1 | O1 | doub | 1.21Å | 1.25Å | |
| C1 | N1 | sing | 1.35Å | 1.33Å | |
| C21 | C4 | sing | 1.53Å | 1.53Å | |
| N1 | C3 | sing | 1.47Å | 1.46Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| N2 | C6 | sing | 1.47Å | 1.47Å | |
| N2 | C7 | sing | 1.35Å | 1.35Å | |
| O2 | C7 | doub | 1.21Å | 1.23Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C15 | C8 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C8 | C19 | sing | 1.53Å | 1.53Å | |
| C8 | O3 | sing | 1.43Å | 1.46Å | |
| F2 | C17 | sing | 1.40Å | 1.38Å | |
| C16 | C17 | sing | 1.53Å | 1.50Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| O3 | C9 | sing | 1.36Å | 1.38Å | |
| C17 | C18 | sing | 1.53Å | 1.50Å | |
| C17 | F1 | sing | 1.40Å | 1.38Å | |
| C14 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | CL2 | sing | 1.74Å | 1.74Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | CL1 | sing | 1.80Å | 1.07Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| N1 | H12 | sing | 0.97Å | 1.00Å | |
| C10 | H13 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | O1 | 118.6° | 120.0° |
| C2 | C1 | N1 | 117.9° | 120.0° |
| C1 | C2 | H1 | 109.6° | 109.5° |
| C1 | C2 | H2 | 109.5° | 109.5° |
| C1 | C2 | CL1 | 109.2° | 109.5° |
| C21 | C20 | N2 | 110.2° | 108.8° |
| C20 | C21 | C4 | 111.8° | 109.3° |
| C21 | C20 | H24 | 109.3° | 109.6° |
| C21 | C20 | H25 | 109.3° | 109.6° |
| C20 | C21 | H26 | 108.9° | 109.5° |
| C20 | C21 | H27 | 108.9° | 109.5° |
| C20 | N2 | C6 | 110.4° | 118.7° |
| C20 | N2 | C7 | 121.3° | 120.6° |
| N2 | C20 | H24 | 109.3° | 109.6° |
| N2 | C20 | H25 | 109.3° | 109.6° |
| O1 | C1 | N1 | 123.5° | 120.0° |
| C1 | N1 | C3 | 123.6° | 120.0° |
| C1 | N1 | H12 | 118.2° | 120.1° |
| C21 | C4 | C3 | 111.4° | 109.5° |
| C21 | C4 | C5 | 111.2° | 109.5° |
| C21 | C4 | H6 | 108.2° | 109.4° |
| C4 | C21 | H26 | 108.9° | 109.5° |
| C4 | C21 | H27 | 108.9° | 109.5° |
| N1 | C3 | C4 | 114.7° | 109.5° |
| N1 | C3 | H4 | 108.2° | 109.5° |
| N1 | C3 | H5 | 108.1° | 109.5° |
| C3 | N1 | H12 | 118.2° | 120.0° |
| C3 | C4 | C5 | 109.4° | 109.4° |
| C4 | C3 | H4 | 108.2° | 109.5° |
| C4 | C3 | H5 | 108.1° | 109.5° |
| C3 | C4 | H6 | 108.3° | 109.5° |
| C4 | C5 | C6 | 113.3° | 109.3° |
| C5 | C4 | H6 | 108.2° | 109.5° |
| C4 | C5 | H7 | 108.5° | 109.5° |
| C4 | C5 | H8 | 108.5° | 109.5° |
| C6 | N2 | C7 | 128.3° | 120.6° |
| N2 | C6 | C5 | 111.7° | 108.8° |
| N2 | C6 | H9 | 108.9° | 109.6° |
| N2 | C6 | H10 | 108.9° | 109.7° |
| N2 | C7 | O2 | 118.8° | 120.0° |
| N2 | C7 | C8 | 123.0° | 120.0° |
| O2 | C7 | C8 | 118.2° | 120.0° |
| C6 | C5 | H7 | 108.5° | 109.4° |
| C6 | C5 | H8 | 108.5° | 109.5° |
| C5 | C6 | H9 | 108.9° | 109.6° |
| C5 | C6 | H10 | 108.9° | 109.6° |
| C7 | C8 | C15 | 107.6° | 109.5° |
| C7 | C8 | C19 | 111.2° | 109.5° |
| C7 | C8 | O3 | 114.2° | 109.5° |
| C8 | C15 | C16 | 112.1° | 109.5° |
| C15 | C8 | C19 | 108.7° | 109.5° |
| C15 | C8 | O3 | 110.0° | 109.4° |
| C8 | C15 | H16 | 108.8° | 109.4° |
| C8 | C15 | H17 | 108.8° | 109.4° |
| C15 | C16 | C17 | 111.4° | 109.5° |
| C16 | C15 | H16 | 108.8° | 109.5° |
| C16 | C15 | H17 | 108.8° | 109.5° |
| C15 | C16 | H18 | 109.0° | 109.5° |
| C15 | C16 | H19 | 109.0° | 109.5° |
| C19 | C8 | O3 | 104.9° | 109.5° |
| C8 | C19 | C18 | 111.2° | 109.5° |
| C8 | C19 | H22 | 109.0° | 109.5° |
| C8 | C19 | H23 | 109.0° | 109.5° |
| C8 | O3 | C9 | 125.7° | 117.0° |
| F2 | C17 | C16 | 109.3° | 109.5° |
| F2 | C17 | C18 | 109.2° | 109.4° |
| F2 | C17 | F1 | 104.7° | 109.5° |
| C16 | C17 | C18 | 115.1° | 109.5° |
| C16 | C17 | F1 | 108.9° | 109.5° |
| C17 | C16 | H18 | 109.0° | 109.5° |
| C17 | C16 | H19 | 109.0° | 109.4° |
| C19 | C18 | C17 | 111.0° | 109.5° |
| C19 | C18 | H20 | 109.1° | 109.5° |
| C19 | C18 | H21 | 109.1° | 109.5° |
| C18 | C19 | H22 | 109.0° | 109.5° |
| C18 | C19 | H23 | 109.0° | 109.5° |
| O3 | C9 | C14 | 124.8° | 120.0° |
| O3 | C9 | C10 | 115.0° | 120.0° |
| C18 | C17 | F1 | 109.2° | 109.5° |
| C17 | C18 | H20 | 109.1° | 109.4° |
| C17 | C18 | H21 | 109.1° | 109.4° |
| C9 | C14 | C13 | 119.8° | 119.9° |
| C14 | C9 | C10 | 120.2° | 120.0° |
| C9 | C14 | H15 | 120.1° | 120.1° |
| C14 | C13 | C12 | 119.2° | 120.0° |
| C14 | C13 | H14 | 120.4° | 120.0° |
| C13 | C14 | H15 | 120.1° | 120.0° |
| C9 | C10 | C11 | 119.9° | 119.9° |
| C9 | C10 | H13 | 120.0° | 120.1° |
| C13 | C12 | C11 | 121.5° | 120.1° |
| C13 | C12 | CL2 | 119.8° | 120.0° |
| C12 | C13 | H14 | 120.4° | 120.0° |
| C10 | C11 | C12 | 119.4° | 120.0° |
| C10 | C11 | H11 | 120.3° | 120.0° |
| C11 | C10 | H13 | 120.0° | 120.0° |
| C11 | C12 | CL2 | 118.7° | 120.0° |
| C12 | C11 | H11 | 120.3° | 120.0° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H1 | C2 | CL1 | 109.5° | 109.4° |
| H2 | C2 | CL1 | 109.5° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H7 | C5 | H8 | 109.5° | 109.6° |
| H9 | C6 | H10 | 109.5° | 109.6° |
| H16 | C15 | H17 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.4° |
| H20 | C18 | H21 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.5° |
| H24 | C20 | H25 | 109.5° | 109.7° |
| H26 | C21 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | O1 | N1 | 179.8° | 179.8° |
| C2 | C1 | N1 | C3 | 175.3° | 179.8° |
| C1 | C2 | H1 | H2 | 120.1° | 120.0° |
| C1 | C2 | H1 | CL1 | 119.7° | 120.0° |
| C1 | C2 | H2 | CL1 | 119.7° | 120.0° |
| C2 | C1 | N1 | H12 | 4.7° | 0.3° |
| C21 | C20 | N2 | H24 | 120.1° | 119.8° |
| C21 | C20 | N2 | H25 | 120.1° | 119.8° |
| C20 | C21 | C4 | H26 | 120.4° | 120.0° |
| C20 | C21 | C4 | H27 | 120.3° | 120.0° |
| C20 | C21 | C4 | C3 | 171.8° | 178.7° |
| C20 | C21 | C4 | C5 | 49.5° | 61.3° |
| C21 | C20 | N2 | C6 | 62.4° | 53.6° |
| C21 | C20 | N2 | C7 | 118.4° | 126.4° |
| C20 | C21 | C4 | H6 | 69.3° | 58.7° |
| C21 | C20 | H24 | H25 | 119.7° | 120.3° |
| C20 | C21 | H26 | H27 | 119.0° | 120.0° |
| N2 | C20 | C21 | C4 | 58.1° | 54.6° |
| C20 | N2 | C6 | C7 | 179.2° | 180.0° |
| C20 | N2 | C7 | O2 | 2.5° | 174.7° |
| C20 | N2 | C6 | C5 | 58.8° | 53.6° |
| C20 | N2 | C7 | C8 | 176.9° | 5.3° |
| C20 | N2 | C6 | H9 | 61.5° | 173.4° |
| C20 | N2 | C6 | H10 | 179.2° | 66.3° |
| N2 | C20 | H24 | H25 | 119.6° | 120.3° |
| N2 | C20 | C21 | H26 | 62.3° | 174.6° |
| N2 | C20 | C21 | H27 | 178.4° | 65.3° |
| O1 | C1 | N1 | C3 | 4.5° | 0.0° |
| O1 | C1 | C2 | H1 | 120.7° | 119.9° |
| O1 | C1 | C2 | H2 | 0.6° | 120.0° |
| O1 | C1 | C2 | CL1 | 119.4° | 0.0° |
| O1 | C1 | N1 | H12 | 175.5° | 179.9° |
| C1 | N1 | C3 | H12 | 180.0° | 180.0° |
| C1 | N1 | C3 | C4 | 98.3° | 174.8° |
| N1 | C1 | C2 | H1 | 59.5° | 60.3° |
| N1 | C1 | C2 | H2 | 179.6° | 59.8° |
| N1 | C1 | C2 | CL1 | 60.5° | 179.7° |
| C1 | N1 | C3 | H4 | 140.9° | 65.2° |
| C1 | N1 | C3 | H5 | 22.4° | 54.8° |
| C21 | C4 | C3 | N1 | 63.4° | 65.1° |
| C21 | C4 | C3 | C5 | 123.4° | 120.1° |
| C21 | C4 | C3 | H6 | 118.9° | 120.0° |
| C21 | C4 | C5 | H6 | 118.8° | 120.0° |
| C21 | C4 | C5 | C6 | 46.1° | 61.3° |
| C21 | C4 | C3 | H4 | 57.4° | 174.9° |
| C21 | C4 | C3 | H5 | 175.9° | 54.9° |
| C21 | C4 | C5 | H7 | 74.4° | 58.6° |
| C21 | C4 | C5 | H8 | 166.7° | 178.7° |
| C4 | C21 | C20 | H24 | 62.0° | 174.4° |
| C4 | C21 | C20 | H25 | 178.2° | 65.1° |
| C4 | C21 | H26 | H27 | 118.9° | 120.1° |
| N1 | C3 | C4 | H4 | 120.8° | 120.0° |
| N1 | C3 | C4 | H5 | 120.8° | 120.0° |
| N1 | C3 | C4 | C5 | 173.3° | 174.8° |
| N1 | C3 | H4 | H5 | 117.6° | 120.0° |
| N1 | C3 | C4 | H6 | 55.5° | 54.9° |
| C3 | C4 | C5 | H6 | 117.8° | 120.0° |
| C3 | C4 | C5 | C6 | 169.6° | 178.6° |
| C4 | C3 | H4 | H5 | 117.6° | 120.0° |
| C3 | C4 | C5 | H7 | 49.0° | 61.5° |
| C3 | C4 | C5 | H8 | 69.9° | 58.7° |
| C4 | C3 | N1 | H12 | 81.7° | 5.2° |
| C3 | C4 | C21 | H26 | 51.4° | 58.7° |
| C3 | C4 | C21 | H27 | 67.9° | 61.4° |
| C4 | C5 | C6 | N2 | 51.1° | 54.6° |
| C4 | C5 | C6 | H7 | 120.5° | 119.9° |
| C4 | C5 | C6 | H8 | 120.6° | 119.9° |
| C5 | C4 | C3 | H4 | 65.9° | 54.9° |
| C5 | C4 | C3 | H5 | 52.5° | 65.1° |
| C4 | C5 | H7 | H8 | 118.2° | 120.1° |
| C4 | C5 | C6 | H9 | 69.3° | 174.4° |
| C4 | C5 | C6 | H10 | 171.4° | 65.3° |
| C5 | C4 | C21 | H26 | 70.9° | 178.7° |
| C5 | C4 | C21 | H27 | 169.8° | 58.6° |
| C6 | N2 | C7 | O2 | 176.6° | 5.3° |
| N2 | C6 | C5 | H9 | 120.3° | 119.8° |
| N2 | C6 | C5 | H10 | 120.3° | 119.9° |
| C6 | N2 | C7 | C8 | 4.0° | 174.7° |
| N2 | C6 | C5 | H7 | 69.5° | 65.3° |
| N2 | C6 | C5 | H8 | 171.6° | 174.6° |
| N2 | C6 | H9 | H10 | 119.0° | 120.4° |
| C6 | N2 | C20 | H24 | 57.7° | 173.4° |
| C6 | N2 | C20 | H25 | 177.5° | 66.2° |
| N2 | C7 | O2 | C8 | 179.4° | 180.0° |
| C7 | N2 | C6 | C5 | 122.0° | 126.4° |
| N2 | C7 | C8 | C15 | 73.7° | 81.1° |
| N2 | C7 | C8 | C19 | 167.4° | 158.9° |
| N2 | C7 | C8 | O3 | 48.8° | 38.9° |
| C7 | N2 | C6 | H9 | 117.7° | 6.6° |
| C7 | N2 | C6 | H10 | 1.7° | 113.7° |
| C7 | N2 | C20 | H24 | 121.5° | 6.6° |
| C7 | N2 | C20 | H25 | 1.8° | 113.8° |
| O2 | C7 | C8 | C15 | 106.9° | 98.9° |
| O2 | C7 | C8 | C19 | 12.1° | 21.1° |
| O2 | C7 | C8 | O3 | 130.6° | 141.1° |
| C6 | C5 | C4 | H6 | 72.7° | 58.6° |
| C6 | C5 | H7 | H8 | 118.3° | 120.1° |
| C5 | C6 | H9 | H10 | 119.0° | 120.3° |
| C7 | C8 | C15 | C19 | 120.6° | 120.0° |
| C7 | C8 | C15 | O3 | 125.1° | 120.0° |
| C7 | C8 | C15 | C16 | 177.8° | 180.0° |
| C7 | C8 | C19 | O3 | 124.0° | 120.0° |
| C7 | C8 | C19 | C18 | 176.8° | 180.0° |
| C7 | C8 | O3 | C9 | 39.1° | 58.5° |
| C7 | C8 | C15 | H16 | 61.8° | 60.0° |
| C7 | C8 | C15 | H17 | 57.4° | 60.0° |
| C7 | C8 | C19 | H22 | 56.6° | 60.0° |
| C7 | C8 | C19 | H23 | 62.9° | 60.0° |
| C8 | C15 | C16 | H16 | 120.4° | 120.0° |
| C8 | C15 | C16 | H17 | 120.4° | 120.0° |
| C15 | C8 | C19 | O3 | 117.7° | 119.9° |
| C8 | C15 | C16 | C17 | 52.8° | 60.0° |
| C15 | C8 | C19 | C18 | 58.5° | 60.0° |
| C15 | C8 | O3 | C9 | 160.3° | 178.5° |
| C8 | C15 | H16 | H17 | 118.8° | 120.0° |
| C8 | C15 | C16 | H18 | 67.5° | 60.0° |
| C8 | C15 | C16 | H19 | 173.1° | 180.0° |
| C15 | C8 | C19 | H22 | 61.7° | 60.0° |
| C15 | C8 | C19 | H23 | 178.8° | 180.0° |
| C16 | C15 | C8 | C19 | 57.3° | 60.0° |
| C16 | C15 | C8 | O3 | 57.1° | 60.0° |
| C15 | C16 | C17 | F2 | 73.3° | 60.0° |
| C15 | C16 | C17 | H18 | 120.3° | 120.1° |
| C15 | C16 | C17 | H19 | 120.3° | 120.0° |
| C15 | C16 | C17 | C18 | 50.0° | 60.0° |
| C15 | C16 | C17 | F1 | 172.9° | 180.0° |
| C16 | C15 | H16 | H17 | 118.8° | 120.0° |
| C15 | C16 | H18 | H19 | 119.1° | 120.0° |
| C8 | C19 | C18 | H22 | 120.2° | 120.0° |
| C8 | C19 | C18 | H23 | 120.3° | 120.0° |
| C19 | C8 | O3 | C9 | 82.9° | 61.5° |
| C8 | C19 | C18 | C17 | 55.4° | 60.0° |
| C19 | C8 | C15 | H16 | 177.6° | 180.0° |
| C19 | C8 | C15 | H17 | 63.1° | 60.0° |
| C8 | C19 | C18 | H20 | 175.7° | 60.0° |
| C8 | C19 | C18 | H21 | 64.8° | 180.0° |
| C8 | C19 | H22 | H23 | 119.2° | 120.0° |
| O3 | C8 | C19 | C18 | 59.2° | 60.0° |
| C8 | O3 | C9 | C14 | 15.8° | 5.7° |
| C8 | O3 | C9 | C10 | 164.4° | 174.3° |
| O3 | C8 | C15 | H16 | 63.2° | 60.0° |
| O3 | C8 | C15 | H17 | 177.5° | 180.0° |
| O3 | C8 | C19 | H22 | 179.4° | 180.0° |
| O3 | C8 | C19 | H23 | 61.1° | 60.0° |
| F2 | C17 | C16 | C18 | 123.3° | 120.0° |
| F2 | C17 | C16 | F1 | 113.8° | 120.0° |
| F2 | C17 | C18 | C19 | 72.0° | 60.0° |
| F2 | C17 | C18 | F1 | 113.9° | 120.0° |
| F2 | C17 | C16 | H18 | 166.4° | 180.0° |
| F2 | C17 | C16 | H19 | 47.0° | 60.0° |
| F2 | C17 | C18 | H20 | 48.3° | 180.0° |
| F2 | C17 | C18 | H21 | 167.8° | 60.1° |
| C16 | C17 | C18 | C19 | 51.4° | 60.0° |
| C16 | C17 | C18 | F1 | 122.8° | 120.0° |
| C17 | C16 | C15 | H16 | 173.2° | 180.0° |
| C17 | C16 | C15 | H17 | 67.6° | 60.0° |
| C17 | C16 | H18 | H19 | 119.1° | 119.9° |
| C16 | C17 | C18 | H20 | 171.6° | 60.1° |
| C16 | C17 | C18 | H21 | 68.9° | 180.0° |
| C19 | C18 | C17 | H20 | 120.2° | 120.0° |
| C19 | C18 | C17 | H21 | 120.2° | 120.1° |
| C19 | C18 | C17 | F1 | 174.1° | 180.0° |
| C19 | C18 | H20 | H21 | 119.3° | 120.1° |
| C18 | C19 | H22 | H23 | 119.2° | 120.0° |
| O3 | C9 | C14 | C10 | 179.8° | 180.0° |
| O3 | C9 | C14 | C13 | 179.4° | 179.7° |
| O3 | C9 | C10 | C11 | 179.4° | 180.0° |
| O3 | C9 | C10 | H13 | 0.6° | 0.0° |
| O3 | C9 | C14 | H15 | 0.6° | 0.0° |
| C18 | C17 | C16 | H18 | 70.3° | 60.1° |
| C18 | C17 | C16 | H19 | 170.3° | 180.0° |
| C17 | C18 | H20 | H21 | 119.3° | 119.9° |
| C17 | C18 | C19 | H22 | 64.8° | 60.0° |
| C17 | C18 | C19 | H23 | 175.7° | 180.0° |
| F1 | C17 | C16 | H18 | 52.6° | 59.9° |
| F1 | C17 | C16 | H19 | 66.8° | 60.0° |
| F1 | C17 | C18 | H20 | 65.6° | 60.0° |
| F1 | C17 | C18 | H21 | 53.9° | 60.0° |
| C9 | C14 | C13 | H15 | 180.0° | 179.7° |
| C9 | C14 | C13 | C12 | 0.0° | 0.2° |
| C14 | C9 | C10 | C11 | 0.8° | 0.0° |
| C14 | C9 | C10 | H13 | 179.3° | 180.0° |
| C9 | C14 | C13 | H14 | 179.9° | 179.7° |
| C13 | C14 | C9 | C10 | 0.8° | 0.2° |
| C14 | C13 | C12 | H14 | 180.0° | 180.0° |
| C14 | C13 | C12 | C11 | 0.9° | 0.0° |
| C14 | C13 | C12 | CL2 | 179.6° | 180.0° |
| C9 | C10 | C11 | H13 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 0.1° | 0.2° |
| C9 | C10 | C11 | H11 | 179.9° | 179.9° |
| C10 | C9 | C14 | H15 | 179.2° | 179.9° |
| C13 | C12 | C11 | C10 | 1.0° | 0.2° |
| C13 | C12 | C11 | CL2 | 179.5° | 180.0° |
| C13 | C12 | C11 | H11 | 179.0° | 179.9° |
| C12 | C13 | C14 | H15 | 180.0° | 180.0° |
| C10 | C11 | C12 | H11 | 180.0° | 179.8° |
| C10 | C11 | C12 | CL2 | 179.5° | 179.7° |
| C12 | C11 | C10 | H13 | 179.9° | 179.7° |
| C11 | C12 | C13 | H14 | 179.1° | 180.0° |
| CL2 | C12 | C11 | H11 | 0.5° | 0.1° |
| CL2 | C12 | C13 | H14 | 0.4° | 0.0° |
| H1 | C2 | H2 | CL1 | 120.1° | 120.0° |
| H4 | C3 | C4 | H6 | 176.3° | 65.1° |
| H4 | C3 | N1 | H12 | 39.1° | 114.8° |
| H5 | C3 | C4 | H6 | 65.2° | 174.9° |
| H5 | C3 | N1 | H12 | 157.6° | 125.2° |
| H6 | C4 | C5 | H7 | 166.8° | 178.6° |
| H6 | C4 | C5 | H8 | 47.9° | 61.3° |
| H6 | C4 | C21 | H26 | 170.3° | 61.3° |
| H6 | C4 | C21 | H27 | 51.0° | 178.6° |
| H7 | C5 | C6 | H9 | 170.2° | 54.5° |
| H7 | C5 | C6 | H10 | 50.9° | 174.8° |
| H8 | C5 | C6 | H9 | 51.3° | 65.6° |
| H8 | C5 | C6 | H10 | 68.0° | 54.7° |
| H11 | C11 | C10 | H13 | 0.2° | 0.1° |
| H14 | C13 | C14 | H15 | 0.0° | 0.0° |
| H16 | C15 | C16 | H18 | 52.9° | 59.9° |
| H16 | C15 | C16 | H19 | 66.5° | 60.0° |
| H17 | C15 | C16 | H18 | 172.1° | 180.0° |
| H17 | C15 | C16 | H19 | 52.7° | 60.0° |
| H20 | C18 | C19 | H22 | 55.4° | 180.0° |
| H20 | C18 | C19 | H23 | 64.1° | 60.1° |
| H21 | C18 | C19 | H22 | 175.0° | 60.0° |
| H21 | C18 | C19 | H23 | 55.5° | 60.0° |
| H24 | C20 | C21 | H26 | 177.6° | 65.6° |
| H24 | C20 | C21 | H27 | 58.3° | 54.5° |
| H25 | C20 | C21 | H26 | 57.8° | 54.9° |
| H25 | C20 | C21 | H27 | 61.5° | 174.9° |
