DJV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C5 | sing | 1.35Å | 1.36Å | |
| C3 | C5 | doub | 1.38Å | 1.36Å | Aromatic |
| C3 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
| F2 | C6 | sing | 1.35Å | 1.35Å | |
| C5 | C1 | sing | 1.38Å | 1.37Å | Aromatic |
| C6 | C2 | doub | 1.39Å | 1.38Å | Aromatic |
| C1 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C19 | sing | 1.51Å | 1.51Å | |
| C19 | C22 | sing | 1.53Å | 1.54Å | |
| O1 | C7 | doub | 1.21Å | 1.23Å | |
| C22 | N2 | sing | 1.46Å | 1.46Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C7 | N2 | sing | 1.35Å | 1.34Å | |
| C7 | C18 | sing | 1.51Å | 1.50Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C8 | C10 | sing | 1.53Å | 1.52Å | |
| O2 | C21 | sing | 1.43Å | 1.43Å | |
| C9 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C15 | sing | 1.53Å | 1.52Å | |
| C21 | C17 | sing | 1.53Å | 1.56Å | |
| C10 | C12 | sing | 1.53Å | 1.52Å | |
| C12 | C15 | sing | 1.53Å | 1.52Å | |
| C15 | C20 | sing | 1.53Å | 1.51Å | |
| C13 | C17 | sing | 1.55Å | 1.54Å | |
| C13 | C16 | sing | 1.55Å | 1.53Å | |
| C20 | O3 | sing | 1.43Å | 1.44Å | |
| C17 | N1 | sing | 1.48Å | 1.47Å | |
| O3 | C16 | sing | 1.43Å | 1.43Å | |
| C16 | C14 | sing | 1.54Å | 1.52Å | |
| N1 | C14 | sing | 1.47Å | 1.47Å | |
| O2 | H32 | sing | 0.97Å | 0.95Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| N1 | H30 | sing | 1.01Å | 1.00Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H29 | sing | 1.09Å | 1.10Å | |
| N2 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C5 | C3 | 118.2° | 120.0° |
| F1 | C5 | C1 | 118.2° | 120.0° |
| C5 | C3 | C6 | 115.9° | 119.9° |
| C3 | C5 | C1 | 123.6° | 120.0° |
| C5 | C3 | H3 | 122.1° | 120.1° |
| C3 | C6 | F2 | 118.0° | 120.0° |
| C3 | C6 | C2 | 123.8° | 120.0° |
| C6 | C3 | H3 | 122.1° | 120.0° |
| F2 | C6 | C2 | 118.3° | 120.0° |
| C5 | C1 | C4 | 119.1° | 120.0° |
| C5 | C1 | H1 | 120.5° | 120.0° |
| C6 | C2 | C4 | 118.7° | 120.0° |
| C6 | C2 | H2 | 120.7° | 120.0° |
| C1 | C4 | C2 | 119.0° | 120.1° |
| C1 | C4 | C19 | 119.5° | 120.0° |
| C4 | C1 | H1 | 120.5° | 120.0° |
| C2 | C4 | C19 | 121.4° | 120.0° |
| C4 | C2 | H2 | 120.7° | 120.0° |
| C4 | C19 | C22 | 112.4° | 109.4° |
| C4 | C19 | H25 | 108.8° | 109.5° |
| C4 | C19 | H24 | 108.8° | 109.5° |
| C19 | C22 | N2 | 109.4° | 109.5° |
| C19 | C22 | C21 | 112.8° | 109.4° |
| C22 | C19 | H25 | 108.7° | 109.5° |
| C22 | C19 | H24 | 108.7° | 109.5° |
| C19 | C22 | H29 | 108.1° | 109.4° |
| O1 | C7 | N2 | 122.4° | 120.0° |
| O1 | C7 | C18 | 122.1° | 120.0° |
| N2 | C22 | C21 | 109.1° | 109.5° |
| C22 | N2 | C7 | 124.2° | 120.0° |
| N2 | C22 | H29 | 109.2° | 109.5° |
| C22 | N2 | H31 | 117.9° | 120.1° |
| C22 | C21 | O2 | 109.4° | 109.5° |
| C22 | C21 | C17 | 113.8° | 109.5° |
| C22 | C21 | H28 | 108.5° | 109.5° |
| C21 | C22 | H29 | 108.1° | 109.5° |
| N2 | C7 | C18 | 115.5° | 120.0° |
| C7 | N2 | H31 | 117.9° | 119.9° |
| C7 | C18 | H22 | 109.5° | 109.5° |
| C7 | C18 | H21 | 109.5° | 109.5° |
| C7 | C18 | H23 | 109.5° | 109.5° |
| C9 | C8 | C10 | 110.9° | 109.5° |
| C8 | C9 | C11 | 110.9° | 109.5° |
| C9 | C8 | H5 | 109.1° | 109.5° |
| C9 | C8 | H4 | 109.1° | 109.5° |
| C8 | C9 | H7 | 109.1° | 109.5° |
| C8 | C9 | H6 | 109.1° | 109.5° |
| C8 | C10 | C12 | 111.1° | 109.5° |
| C10 | C8 | H5 | 109.1° | 109.5° |
| C10 | C8 | H4 | 109.1° | 109.4° |
| C8 | C10 | H9 | 109.0° | 109.4° |
| C8 | C10 | H8 | 109.1° | 109.5° |
| O2 | C21 | C17 | 106.7° | 109.4° |
| C21 | O2 | H32 | 109.5° | 114.1° |
| O2 | C21 | H28 | 110.0° | 109.5° |
| C9 | C11 | C15 | 111.8° | 109.5° |
| C11 | C9 | H7 | 109.1° | 109.4° |
| C11 | C9 | H6 | 109.1° | 109.4° |
| C9 | C11 | H11 | 108.9° | 109.5° |
| C9 | C11 | H10 | 108.9° | 109.5° |
| C11 | C15 | C12 | 108.7° | 109.5° |
| C11 | C15 | C20 | 110.6° | 109.5° |
| C15 | C11 | H11 | 108.9° | 109.4° |
| C15 | C11 | H10 | 108.9° | 109.5° |
| C11 | C15 | H18 | 108.5° | 109.4° |
| C21 | C17 | C13 | 113.4° | 110.4° |
| C21 | C17 | N1 | 109.9° | 110.3° |
| C21 | C17 | H20 | 109.7° | 110.4° |
| C17 | C21 | H28 | 108.2° | 109.5° |
| C10 | C12 | C15 | 111.5° | 109.5° |
| C12 | C10 | H9 | 109.1° | 109.4° |
| C12 | C10 | H8 | 109.0° | 109.5° |
| C10 | C12 | H13 | 109.0° | 109.5° |
| C10 | C12 | H12 | 108.9° | 109.4° |
| C12 | C15 | C20 | 111.8° | 109.5° |
| C15 | C12 | H13 | 108.9° | 109.5° |
| C15 | C12 | H12 | 109.0° | 109.4° |
| C12 | C15 | H18 | 108.5° | 109.5° |
| C15 | C20 | O3 | 110.0° | 109.4° |
| C20 | C15 | H18 | 108.7° | 109.5° |
| C15 | C20 | H26 | 109.3° | 109.4° |
| C15 | C20 | H27 | 109.3° | 109.5° |
| C17 | C13 | C16 | 105.5° | 101.7° |
| C13 | C17 | N1 | 102.7° | 104.8° |
| C17 | C13 | H14 | 110.5° | 111.0° |
| C17 | C13 | H15 | 110.4° | 111.0° |
| C13 | C17 | H20 | 110.0° | 110.4° |
| C13 | C16 | O3 | 111.1° | 110.7° |
| C13 | C16 | C14 | 104.4° | 103.0° |
| C16 | C13 | H14 | 110.4° | 111.0° |
| C16 | C13 | H15 | 110.4° | 111.0° |
| C13 | C16 | H19 | 111.6° | 110.7° |
| C20 | O3 | C16 | 114.7° | 114.0° |
| O3 | C20 | H26 | 109.4° | 109.5° |
| O3 | C20 | H27 | 109.3° | 109.5° |
| C17 | N1 | C14 | 104.3° | 108.5° |
| C17 | N1 | H30 | 110.8° | 111.0° |
| N1 | C17 | H20 | 111.0° | 110.4° |
| O3 | C16 | C14 | 104.4° | 110.7° |
| O3 | C16 | H19 | 113.1° | 110.8° |
| C16 | C14 | N1 | 103.3° | 107.2° |
| C16 | C14 | H17 | 111.0° | 109.9° |
| C16 | C14 | H16 | 111.0° | 110.0° |
| C14 | C16 | H19 | 111.7° | 110.7° |
| C14 | N1 | H30 | 110.8° | 111.0° |
| N1 | C14 | H17 | 111.0° | 109.8° |
| N1 | C14 | H16 | 111.0° | 109.9° |
| H5 | C8 | H4 | 109.5° | 109.5° |
| H7 | C9 | H6 | 109.5° | 109.5° |
| H9 | C10 | H8 | 109.5° | 109.5° |
| H11 | C11 | H10 | 109.4° | 109.5° |
| H13 | C12 | H12 | 109.5° | 109.5° |
| H14 | C13 | H15 | 109.5° | 110.8° |
| H17 | C14 | H16 | 109.5° | 109.9° |
| H22 | C18 | H21 | 109.5° | 109.5° |
| H22 | C18 | H23 | 109.5° | 109.5° |
| H21 | C18 | H23 | 109.4° | 109.4° |
| H25 | C19 | H24 | 109.4° | 109.5° |
| H26 | C20 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C5 | C3 | C1 | 179.7° | 180.0° |
| F1 | C5 | C3 | C6 | 177.2° | 180.0° |
| F1 | C5 | C1 | C4 | 177.6° | 180.0° |
| F1 | C5 | C1 | H1 | 2.4° | 0.0° |
| F1 | C5 | C3 | H3 | 2.8° | 0.0° |
| C5 | C3 | C6 | H3 | 180.0° | 180.0° |
| C5 | C3 | C6 | F2 | 179.3° | 179.7° |
| C5 | C3 | C6 | C2 | 0.9° | 0.0° |
| C3 | C5 | C1 | C4 | 2.2° | 0.1° |
| C3 | C5 | C1 | H1 | 177.8° | 180.0° |
| C3 | C6 | F2 | C2 | 179.8° | 179.7° |
| C6 | C3 | C5 | C1 | 2.5° | 0.1° |
| C3 | C6 | C2 | C4 | 1.1° | 0.0° |
| C3 | C6 | C2 | H2 | 179.0° | 180.0° |
| F2 | C6 | C2 | C4 | 178.8° | 179.7° |
| F2 | C6 | C3 | H3 | 0.7° | 0.3° |
| F2 | C6 | C2 | H2 | 1.2° | 0.2° |
| C5 | C1 | C4 | H1 | 180.0° | 179.9° |
| C5 | C1 | C4 | C2 | 0.0° | 0.1° |
| C5 | C1 | C4 | C19 | 176.2° | 180.0° |
| C1 | C5 | C3 | H3 | 177.5° | 179.9° |
| C6 | C2 | C4 | C1 | 1.5° | 0.1° |
| C6 | C2 | C4 | H2 | 180.0° | 179.9° |
| C6 | C2 | C4 | C19 | 177.6° | 180.0° |
| C2 | C6 | C3 | H3 | 179.1° | 179.9° |
| C1 | C4 | C2 | C19 | 176.1° | 179.9° |
| C1 | C4 | C19 | C22 | 58.7° | 90.0° |
| C1 | C4 | C2 | H2 | 178.5° | 180.0° |
| C1 | C4 | C19 | H25 | 61.7° | 150.0° |
| C1 | C4 | C19 | H24 | 179.2° | 30.0° |
| C2 | C4 | C19 | C22 | 117.4° | 90.0° |
| C2 | C4 | C1 | H1 | 180.0° | 180.0° |
| C2 | C4 | C19 | H25 | 122.2° | 30.0° |
| C2 | C4 | C19 | H24 | 3.1° | 150.0° |
| C4 | C19 | C22 | H25 | 120.5° | 120.0° |
| C4 | C19 | C22 | H24 | 120.5° | 120.0° |
| C4 | C19 | C22 | N2 | 55.1° | 65.0° |
| C4 | C19 | C22 | C21 | 176.7° | 175.0° |
| C19 | C4 | C1 | H1 | 3.8° | 0.0° |
| C19 | C4 | C2 | H2 | 2.4° | 0.1° |
| C4 | C19 | H25 | H24 | 118.7° | 120.0° |
| C4 | C19 | C22 | H29 | 63.8° | 55.0° |
| C19 | C22 | N2 | C21 | 123.9° | 120.0° |
| C19 | C22 | N2 | H29 | 118.2° | 120.0° |
| C19 | C22 | C21 | H29 | 119.5° | 120.0° |
| C19 | C22 | N2 | C7 | 116.3° | 60.0° |
| C19 | C22 | C21 | O2 | 63.9° | 60.0° |
| C19 | C22 | C21 | C17 | 176.8° | 180.0° |
| C22 | C19 | H25 | H24 | 118.7° | 120.0° |
| C19 | C22 | C21 | H28 | 56.2° | 60.0° |
| C19 | C22 | N2 | H31 | 63.7° | 120.0° |
| O1 | C7 | N2 | C22 | 3.0° | 0.0° |
| O1 | C7 | N2 | C18 | 177.6° | 179.7° |
| O1 | C7 | C18 | H22 | 0.0° | 90.0° |
| O1 | C7 | C18 | H21 | 120.0° | 150.0° |
| O1 | C7 | C18 | H23 | 120.0° | 30.0° |
| O1 | C7 | N2 | H31 | 177.0° | 180.0° |
| N2 | C22 | C21 | H29 | 118.7° | 120.1° |
| C22 | N2 | C7 | H31 | 180.0° | 180.0° |
| C22 | N2 | C7 | C18 | 174.6° | 179.7° |
| N2 | C22 | C21 | O2 | 174.3° | 180.0° |
| N2 | C22 | C21 | C17 | 55.0° | 60.0° |
| N2 | C22 | C19 | H25 | 175.5° | 175.0° |
| N2 | C22 | C19 | H24 | 65.4° | 55.0° |
| N2 | C22 | C21 | H28 | 65.6° | 60.0° |
| C21 | C22 | N2 | C7 | 119.9° | 60.0° |
| C22 | C21 | O2 | C17 | 123.6° | 120.0° |
| C22 | C21 | O2 | H28 | 119.2° | 120.1° |
| C22 | C21 | C17 | H28 | 120.8° | 120.1° |
| C22 | C21 | C17 | C13 | 60.3° | 180.0° |
| C22 | C21 | C17 | N1 | 174.6° | 64.6° |
| C22 | C21 | O2 | H32 | 180.0° | 59.9° |
| C22 | C21 | C17 | H20 | 63.1° | 57.6° |
| C21 | C22 | C19 | H25 | 62.9° | 55.0° |
| C21 | C22 | C19 | H24 | 56.2° | 65.0° |
| C21 | C22 | N2 | H31 | 60.1° | 120.0° |
| N2 | C7 | C18 | H22 | 177.6° | 89.7° |
| N2 | C7 | C18 | H21 | 62.4° | 30.3° |
| N2 | C7 | C18 | H23 | 57.6° | 150.2° |
| C7 | N2 | C22 | H29 | 1.9° | 180.0° |
| C7 | C18 | H22 | H21 | 120.0° | 120.0° |
| C7 | C18 | H22 | H23 | 120.0° | 120.1° |
| C7 | C18 | H21 | H23 | 120.0° | 120.0° |
| C18 | C7 | N2 | H31 | 5.4° | 0.3° |
| C9 | C8 | C10 | H5 | 120.2° | 120.0° |
| C9 | C8 | C10 | H4 | 120.2° | 120.0° |
| C8 | C9 | C11 | H7 | 120.2° | 120.0° |
| C8 | C9 | C11 | H6 | 120.2° | 120.0° |
| C8 | C9 | C11 | C15 | 56.9° | 60.0° |
| C9 | C8 | C10 | C12 | 55.1° | 60.0° |
| C9 | C8 | H5 | H4 | 119.3° | 120.0° |
| C8 | C9 | H7 | H6 | 119.3° | 120.1° |
| C9 | C8 | C10 | H9 | 65.1° | 60.0° |
| C9 | C8 | C10 | H8 | 175.3° | 179.9° |
| C8 | C9 | C11 | H11 | 63.4° | 60.0° |
| C8 | C9 | C11 | H10 | 177.3° | 180.0° |
| C10 | C8 | C9 | C11 | 54.8° | 60.0° |
| C8 | C10 | C12 | H9 | 120.2° | 119.9° |
| C8 | C10 | C12 | H8 | 120.2° | 120.1° |
| C8 | C10 | C12 | C15 | 57.3° | 59.9° |
| C10 | C8 | H5 | H4 | 119.4° | 119.9° |
| C10 | C8 | C9 | H7 | 175.0° | 180.0° |
| C10 | C8 | C9 | H6 | 65.4° | 60.0° |
| C8 | C10 | H9 | H8 | 119.3° | 120.0° |
| C8 | C10 | C12 | H13 | 177.6° | 180.0° |
| C8 | C10 | C12 | H12 | 63.0° | 60.0° |
| O2 | C21 | C17 | H28 | 118.4° | 120.0° |
| O2 | C21 | C17 | C13 | 60.5° | 60.0° |
| O2 | C21 | C17 | N1 | 53.8° | 175.4° |
| O2 | C21 | C17 | H20 | 176.1° | 62.4° |
| O2 | C21 | C22 | H29 | 55.7° | 59.9° |
| C9 | C11 | C15 | H11 | 120.4° | 120.0° |
| C9 | C11 | C15 | H10 | 120.4° | 120.0° |
| C9 | C11 | C15 | C12 | 57.4° | 60.0° |
| C9 | C11 | C15 | C20 | 179.5° | NaN° |
| C11 | C9 | C8 | H5 | 175.0° | 180.0° |
| C11 | C9 | C8 | H4 | 65.4° | 60.0° |
| C11 | C9 | H7 | H6 | 119.4° | 119.9° |
| C9 | C11 | H11 | H10 | 118.9° | 120.1° |
| C9 | C11 | C15 | H18 | 60.4° | 60.0° |
| C11 | C15 | C12 | C10 | 57.5° | 60.0° |
| C11 | C15 | C12 | C20 | 122.3° | 120.0° |
| C11 | C15 | C12 | H18 | 117.8° | 120.0° |
| C11 | C15 | C20 | H18 | 119.0° | 119.9° |
| C11 | C15 | C20 | O3 | 179.2° | 175.0° |
| C15 | C11 | C9 | H7 | 177.1° | 180.0° |
| C15 | C11 | C9 | H6 | 63.3° | 60.0° |
| C15 | C11 | H11 | H10 | 118.9° | 120.0° |
| C11 | C15 | C12 | H13 | 177.8° | 180.0° |
| C11 | C15 | C12 | H12 | 62.8° | 59.9° |
| C11 | C15 | C20 | H26 | 59.1° | 65.1° |
| C11 | C15 | C20 | H27 | 60.7° | 55.0° |
| C21 | C17 | C13 | N1 | 118.5° | 118.8° |
| C21 | C17 | C13 | H20 | 123.3° | 122.4° |
| C21 | C17 | C13 | C16 | 141.2° | 155.9° |
| C21 | C17 | N1 | H20 | 121.5° | 122.3° |
| C21 | C17 | N1 | C14 | 162.7° | 143.0° |
| C17 | C21 | O2 | H32 | 56.4° | 60.1° |
| C21 | C17 | N1 | H30 | 43.5° | 20.7° |
| C21 | C17 | C13 | H14 | 99.4° | 37.7° |
| C21 | C17 | C13 | H15 | 21.9° | 86.0° |
| C17 | C21 | C22 | H29 | 63.7° | 60.0° |
| C10 | C12 | C15 | H13 | 120.3° | 120.1° |
| C10 | C12 | C15 | H12 | 120.3° | 119.9° |
| C10 | C12 | C15 | C20 | 179.8° | 180.0° |
| C12 | C10 | C8 | H5 | 175.3° | 180.0° |
| C12 | C10 | C8 | H4 | 65.1° | 60.0° |
| C12 | C10 | H9 | H8 | 119.3° | 120.0° |
| C10 | C12 | H13 | H12 | 119.1° | 120.0° |
| C10 | C12 | C15 | H18 | 60.3° | 60.0° |
| C12 | C15 | C20 | H18 | 119.8° | 120.0° |
| C12 | C15 | C20 | O3 | 58.0° | 65.0° |
| C15 | C12 | C10 | H9 | 62.9° | 60.0° |
| C15 | C12 | C10 | H8 | 177.5° | 180.0° |
| C12 | C15 | C11 | H11 | 62.9° | 60.0° |
| C12 | C15 | C11 | H10 | 177.8° | 180.0° |
| C15 | C12 | H13 | H12 | 119.1° | 120.0° |
| C12 | C15 | C20 | H26 | 62.2° | 55.0° |
| C12 | C15 | C20 | H27 | 178.0° | 175.1° |
| C15 | C20 | O3 | H26 | 120.1° | 119.9° |
| C15 | C20 | O3 | H27 | 120.1° | 120.0° |
| C15 | C20 | O3 | C16 | 177.9° | 180.0° |
| C20 | C15 | C11 | H11 | 60.1° | 60.0° |
| C20 | C15 | C11 | H10 | 59.1° | 60.0° |
| C20 | C15 | C12 | H13 | 59.9° | 60.0° |
| C20 | C15 | C12 | H12 | 59.5° | 60.1° |
| C15 | C20 | H26 | H27 | 119.8° | 120.0° |
| C17 | C13 | C16 | H14 | 119.4° | 118.2° |
| C17 | C13 | C16 | H15 | 119.4° | 118.1° |
| C13 | C17 | N1 | H20 | 117.5° | 118.9° |
| C17 | C13 | C16 | O3 | 108.4° | 154.0° |
| C17 | C13 | C16 | C14 | 3.6° | 35.7° |
| C13 | C17 | N1 | C14 | 41.7° | 24.1° |
| C13 | C17 | N1 | H30 | 77.5° | 98.1° |
| C17 | C13 | H14 | H15 | 121.8° | 123.8° |
| C17 | C13 | C16 | H19 | 124.3° | 82.7° |
| C13 | C17 | C21 | H28 | 178.9° | 59.9° |
| C13 | C16 | O3 | C20 | 73.9° | 150.0° |
| C16 | C13 | C17 | N1 | 22.7° | 37.1° |
| C13 | C16 | O3 | C14 | 112.0° | 113.6° |
| C13 | C16 | O3 | H19 | 126.4° | 123.2° |
| C13 | C16 | C14 | H19 | 120.7° | 118.4° |
| C13 | C16 | C14 | N1 | 28.8° | 22.3° |
| C16 | C13 | H14 | H15 | 121.8° | 123.8° |
| C13 | C16 | C14 | H17 | 90.2° | 97.1° |
| C13 | C16 | C14 | H16 | 147.8° | 141.8° |
| C16 | C13 | C17 | H20 | 95.5° | 81.7° |
| C20 | O3 | C16 | C14 | 174.1° | 96.4° |
| O3 | C20 | C15 | H18 | 61.8° | 55.1° |
| C20 | O3 | C16 | H19 | 52.5° | 26.8° |
| O3 | C20 | H26 | H27 | 119.7° | 120.1° |
| C17 | N1 | C14 | C16 | 44.6° | 1.0° |
| C17 | N1 | C14 | H30 | 119.2° | 122.3° |
| N1 | C17 | C13 | H14 | 142.1° | 81.0° |
| N1 | C17 | C13 | H15 | 96.6° | 155.2° |
| C17 | N1 | C14 | H17 | 74.4° | 120.4° |
| C17 | N1 | C14 | H16 | 163.6° | 118.6° |
| N1 | C17 | C21 | H28 | 64.6° | 55.4° |
| O3 | C16 | C14 | H19 | 122.5° | 123.2° |
| O3 | C16 | C14 | N1 | 88.0° | 140.6° |
| O3 | C16 | C13 | H14 | 132.2° | 35.9° |
| O3 | C16 | C13 | H15 | 10.9° | 87.9° |
| O3 | C16 | C14 | H17 | 153.0° | 21.3° |
| O3 | C16 | C14 | H16 | 31.0° | 99.8° |
| C16 | O3 | C20 | H26 | 57.9° | 60.0° |
| C16 | O3 | C20 | H27 | 62.0° | 60.1° |
| C16 | C14 | N1 | H17 | 119.0° | 119.4° |
| C16 | C14 | N1 | H16 | 119.0° | 119.6° |
| C16 | C14 | N1 | H30 | 74.6° | 121.3° |
| C14 | C16 | C13 | H14 | 115.8° | 82.5° |
| C14 | C16 | C13 | H15 | 122.9° | 153.8° |
| C16 | C14 | H17 | H16 | 122.9° | 121.2° |
| N1 | C14 | H17 | H16 | 122.9° | 121.0° |
| N1 | C14 | C16 | H19 | 149.4° | 96.1° |
| C14 | N1 | C17 | H20 | 75.8° | 94.8° |
| H32 | O2 | C21 | H28 | 60.8° | 180.0° |
| H30 | N1 | C14 | H17 | 166.4° | 1.9° |
| H30 | N1 | C14 | H16 | 44.4° | 119.1° |
| H30 | N1 | C17 | H20 | 165.0° | 143.0° |
| H5 | C8 | C9 | H7 | 64.8° | 60.0° |
| H5 | C8 | C9 | H6 | 54.8° | 60.0° |
| H5 | C8 | C10 | H9 | 55.1° | 60.0° |
| H5 | C8 | C10 | H8 | 64.5° | 60.0° |
| H4 | C8 | C9 | H7 | 54.8° | 60.0° |
| H4 | C8 | C9 | H6 | 174.4° | 179.9° |
| H4 | C8 | C10 | H9 | 174.7° | 180.0° |
| H4 | C8 | C10 | H8 | 55.1° | 60.0° |
| H7 | C9 | C11 | H11 | 56.8° | 60.0° |
| H7 | C9 | C11 | H10 | 62.5° | 60.0° |
| H6 | C9 | C11 | H11 | 176.3° | 180.0° |
| H6 | C9 | C11 | H10 | 57.1° | 60.0° |
| H9 | C10 | C12 | H13 | 57.4° | 60.0° |
| H9 | C10 | C12 | H12 | 176.8° | 179.9° |
| H8 | C10 | C12 | H13 | 62.2° | 60.0° |
| H8 | C10 | C12 | H12 | 57.2° | 60.1° |
| H11 | C11 | C15 | H18 | 179.2° | 180.0° |
| H10 | C11 | C15 | H18 | 60.0° | 60.0° |
| H13 | C12 | C15 | H18 | 60.0° | 60.0° |
| H12 | C12 | C15 | H18 | 179.4° | 179.9° |
| H14 | C13 | C16 | H19 | 5.0° | 159.2° |
| H14 | C13 | C17 | H20 | 23.9° | 160.1° |
| H15 | C13 | C16 | H19 | 116.3° | 35.4° |
| H15 | C13 | C17 | H20 | 145.2° | 36.4° |
| H17 | C14 | C16 | H19 | 30.5° | 144.5° |
| H16 | C14 | C16 | H19 | 91.5° | 23.4° |
| H18 | C15 | C20 | H26 | 178.1° | 175.0° |
| H18 | C15 | C20 | H27 | 58.2° | 64.9° |
| H20 | C17 | C21 | H28 | 57.7° | 177.7° |
| H22 | C18 | H21 | H23 | 120.0° | 120.0° |
| H25 | C19 | C22 | H29 | 56.6° | 64.9° |
| H24 | C19 | C22 | H29 | 175.7° | 175.0° |
| H28 | C21 | C22 | H29 | 175.7° | 180.0° |
| H29 | C22 | N2 | H31 | 178.1° | 0.0° |
