B0T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C15 | doub | 1.21Å | 1.27Å | |
| C15 | O5 | sing | 1.34Å | 1.26Å | |
| C15 | C25 | sing | 1.51Å | 1.52Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | C21 | sing | 1.53Å | 1.53Å | |
| O7 | C21 | sing | 1.43Å | 1.43Å | |
| O7 | C11 | sing | 1.36Å | 1.37Å | |
| C21 | C20 | sing | 1.54Å | 1.51Å | |
| C6 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | O6 | sing | 1.43Å | 1.44Å | |
| C12 | O6 | sing | 1.36Å | 1.39Å | |
| C12 | C8 | doub | 1.40Å | 1.38Å | Aromatic |
| C24 | N2 | sing | 1.47Å | 1.50Å | |
| C10 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C23 | sing | 1.51Å | 1.51Å | |
| C8 | C14 | sing | 1.47Å | 1.48Å | |
| N2 | C23 | sing | 1.47Å | 1.53Å | |
| N2 | C22 | sing | 1.47Å | 1.50Å | |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C14 | O4 | doub | 1.21Å | 1.26Å | |
| C14 | O1 | sing | 1.35Å | 1.29Å | |
| C22 | C9 | sing | 1.51Å | 1.50Å | |
| O3 | C13 | doub | 1.21Å | 1.22Å | |
| C17 | C18 | sing | 1.53Å | 1.51Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | N1 | sing | 1.47Å | 1.46Å | |
| C13 | N1 | sing | 1.35Å | 1.39Å | |
| C13 | C7 | sing | 1.48Å | 1.48Å | |
| C9 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C9 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | C3 | sing | 1.40Å | 1.38Å | Aromatic |
| C4 | C2 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| N1 | H30 | sing | 0.97Å | 1.00Å | |
| O1 | H32 | sing | 0.97Å | 0.95Å | |
| O5 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C15 | O5 | 127.8° | 120.0° |
| O2 | C15 | C25 | 116.0° | 120.0° |
| O5 | C15 | C25 | 116.2° | 120.0° |
| C15 | O5 | H33 | 109.5° | 117.0° |
| C15 | C25 | C26 | 106.8° | 109.5° |
| C15 | C25 | H26 | 110.2° | 109.4° |
| C15 | C25 | H27 | 110.1° | 109.5° |
| C25 | C26 | C21 | 111.6° | 109.5° |
| C26 | C25 | H26 | 110.1° | 109.4° |
| C26 | C25 | H27 | 110.2° | 109.5° |
| C25 | C26 | H28 | 108.9° | 109.5° |
| C25 | C26 | H29 | 108.9° | 109.4° |
| C26 | C21 | O7 | 111.3° | 109.8° |
| C26 | C21 | C20 | 109.8° | 109.7° |
| C26 | C21 | H18 | 108.0° | 109.7° |
| C21 | C26 | H28 | 108.9° | 109.5° |
| C21 | C26 | H29 | 108.9° | 109.5° |
| C21 | O7 | C11 | 112.6° | 116.7° |
| O7 | C21 | C20 | 109.9° | 108.3° |
| O7 | C21 | H18 | 109.4° | 109.7° |
| O7 | C11 | C6 | 117.1° | 119.4° |
| O7 | C11 | C12 | 122.3° | 120.7° |
| C21 | C20 | O6 | 107.9° | 108.2° |
| C21 | C20 | H16 | 109.8° | 109.8° |
| C21 | C20 | H17 | 109.8° | 109.7° |
| C20 | C21 | H18 | 108.3° | 109.6° |
| C11 | C6 | C5 | 119.6° | 120.5° |
| C6 | C11 | C12 | 120.7° | 119.9° |
| C11 | C6 | H6 | 120.2° | 119.7° |
| C6 | C5 | C10 | 120.4° | 120.3° |
| C6 | C5 | H5 | 119.8° | 119.8° |
| C5 | C6 | H6 | 120.1° | 119.8° |
| C11 | C12 | O6 | 121.6° | 120.9° |
| C11 | C12 | C8 | 119.8° | 119.7° |
| C5 | C10 | C8 | 119.9° | 120.0° |
| C5 | C10 | C23 | 118.3° | 120.0° |
| C10 | C5 | H5 | 119.8° | 119.9° |
| C20 | O6 | C12 | 112.6° | 116.7° |
| O6 | C20 | H16 | 109.9° | 109.7° |
| O6 | C20 | H17 | 109.8° | 109.7° |
| O6 | C12 | C8 | 118.6° | 119.5° |
| C12 | C8 | C10 | 119.6° | 119.7° |
| C12 | C8 | C14 | 119.7° | 120.2° |
| C24 | N2 | C23 | 116.6° | 111.0° |
| C24 | N2 | C22 | 108.7° | 111.0° |
| N2 | C24 | H23 | 109.5° | 109.4° |
| N2 | C24 | H24 | 109.4° | 109.5° |
| N2 | C24 | H25 | 109.5° | 109.4° |
| C8 | C10 | C23 | 121.8° | 120.0° |
| C10 | C8 | C14 | 120.7° | 120.1° |
| C10 | C23 | N2 | 107.5° | 109.5° |
| C10 | C23 | H21 | 109.9° | 109.5° |
| C10 | C23 | H22 | 110.0° | 109.5° |
| C8 | C14 | O4 | 119.6° | 120.0° |
| C8 | C14 | O1 | 115.4° | 120.0° |
| C23 | N2 | C22 | 116.8° | 111.0° |
| N2 | C23 | H21 | 110.0° | 109.5° |
| N2 | C23 | H22 | 110.0° | 109.4° |
| N2 | C22 | C9 | 115.8° | 109.5° |
| N2 | C22 | H19 | 107.9° | 109.5° |
| N2 | C22 | H20 | 107.8° | 109.5° |
| C16 | C17 | C18 | 111.5° | 109.5° |
| C17 | C16 | H7 | 109.5° | 109.5° |
| C17 | C16 | H8 | 109.5° | 109.5° |
| C17 | C16 | H9 | 109.4° | 109.4° |
| C16 | C17 | H10 | 108.9° | 109.5° |
| C16 | C17 | H11 | 108.9° | 109.4° |
| O4 | C14 | O1 | 124.7° | 120.0° |
| C14 | O1 | H32 | 109.5° | 117.0° |
| C22 | C9 | C7 | 122.8° | 120.1° |
| C22 | C9 | C4 | 118.2° | 120.1° |
| C9 | C22 | H19 | 107.9° | 109.5° |
| C9 | C22 | H20 | 107.9° | 109.5° |
| O3 | C13 | N1 | 124.9° | 120.0° |
| O3 | C13 | C7 | 119.5° | 120.0° |
| C17 | C18 | C19 | 107.2° | 109.5° |
| C17 | C18 | N1 | 114.4° | 109.5° |
| C18 | C17 | H10 | 108.9° | 109.5° |
| C18 | C17 | H11 | 109.0° | 109.5° |
| C17 | C18 | H12 | 108.0° | 109.5° |
| C19 | C18 | N1 | 110.5° | 109.4° |
| C19 | C18 | H12 | 108.0° | 109.4° |
| C18 | C19 | H13 | 109.5° | 109.4° |
| C18 | C19 | H14 | 109.5° | 109.5° |
| C18 | C19 | H15 | 109.5° | 109.5° |
| C18 | N1 | C13 | 121.6° | 120.0° |
| N1 | C18 | H12 | 108.6° | 109.5° |
| C18 | N1 | H30 | 119.2° | 119.9° |
| N1 | C13 | C7 | 115.5° | 120.0° |
| C13 | N1 | H30 | 119.2° | 120.1° |
| C13 | C7 | C9 | 121.4° | 120.1° |
| C13 | C7 | C3 | 117.9° | 120.2° |
| C7 | C9 | C4 | 119.0° | 119.9° |
| C9 | C7 | C3 | 120.7° | 119.7° |
| C9 | C4 | C2 | 120.5° | 120.1° |
| C9 | C4 | H4 | 119.8° | 119.9° |
| C7 | C3 | C1 | 119.7° | 119.9° |
| C7 | C3 | H3 | 120.2° | 120.1° |
| C4 | C2 | C1 | 119.9° | 120.2° |
| C4 | C2 | H2 | 120.0° | 119.9° |
| C2 | C4 | H4 | 119.7° | 119.9° |
| C3 | C1 | C2 | 120.1° | 120.2° |
| C3 | C1 | H1 | 119.9° | 120.0° |
| C1 | C3 | H3 | 120.1° | 120.1° |
| C2 | C1 | H1 | 120.0° | 119.8° |
| C1 | C2 | H2 | 120.0° | 119.9° |
| H7 | C16 | H8 | 109.4° | 109.5° |
| H7 | C16 | H9 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.4° |
| H10 | C17 | H11 | 109.5° | 109.4° |
| H13 | C19 | H14 | 109.4° | 109.5° |
| H13 | C19 | H15 | 109.5° | 109.5° |
| H14 | C19 | H15 | 109.5° | 109.5° |
| H16 | C20 | H17 | 109.5° | 109.7° |
| H19 | C22 | H20 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.5° | 109.4° |
| H23 | C24 | H24 | 109.5° | 109.5° |
| H23 | C24 | H25 | 109.5° | 109.5° |
| H24 | C24 | H25 | 109.4° | 109.5° |
| H26 | C25 | H27 | 109.5° | 109.5° |
| H28 | C26 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C15 | O5 | C25 | 179.0° | 180.0° |
| O2 | C15 | C25 | C26 | 139.3° | 0.1° |
| O2 | C15 | C25 | H26 | 101.1° | 120.0° |
| O2 | C15 | C25 | H27 | 19.8° | 120.0° |
| O2 | C15 | O5 | H33 | 0.0° | 0.0° |
| O5 | C15 | C25 | C26 | 41.5° | 180.0° |
| O5 | C15 | C25 | H26 | 78.1° | 60.0° |
| O5 | C15 | C25 | H27 | 161.1° | 60.0° |
| C15 | C25 | C26 | H26 | 119.6° | 120.0° |
| C15 | C25 | C26 | H27 | 119.6° | 120.0° |
| C15 | C25 | C26 | C21 | 75.5° | 180.0° |
| C15 | C25 | H26 | H27 | 121.2° | 120.0° |
| C15 | C25 | C26 | H28 | 44.9° | 60.0° |
| C15 | C25 | C26 | H29 | 164.2° | 60.0° |
| C25 | C15 | O5 | H33 | 179.1° | 180.0° |
| C25 | C26 | C21 | H28 | 120.3° | 120.1° |
| C25 | C26 | C21 | H29 | 120.3° | 120.0° |
| C25 | C26 | C21 | O7 | 53.1° | 66.2° |
| C25 | C26 | C21 | C20 | 175.0° | 174.9° |
| C25 | C26 | C21 | H18 | 67.0° | 54.4° |
| C26 | C25 | H26 | H27 | 121.3° | 120.0° |
| C25 | C26 | H28 | H29 | 119.0° | 120.0° |
| C26 | C21 | O7 | C20 | 121.9° | 119.7° |
| C26 | C21 | O7 | H18 | 119.3° | 120.6° |
| C26 | C21 | O7 | C11 | 170.5° | 165.8° |
| C26 | C21 | C20 | H18 | 117.8° | 120.6° |
| C26 | C21 | C20 | O6 | 171.5° | 179.4° |
| C26 | C21 | C20 | H16 | 51.7° | 60.9° |
| C26 | C21 | C20 | H17 | 68.8° | 59.7° |
| C21 | C26 | C25 | H26 | 164.9° | 60.0° |
| C21 | C26 | C25 | H27 | 44.1° | 60.0° |
| C21 | C26 | H28 | H29 | 119.0° | 120.0° |
| O7 | C21 | C20 | H18 | 119.5° | 119.7° |
| C21 | O7 | C11 | C6 | 163.9° | 163.0° |
| C21 | O7 | C11 | C12 | 17.9° | 17.2° |
| O7 | C21 | C20 | O6 | 65.8° | 59.6° |
| O7 | C21 | C20 | H16 | 174.4° | 179.3° |
| O7 | C21 | C20 | H17 | 53.9° | 60.0° |
| O7 | C21 | C26 | H28 | 173.4° | 53.9° |
| O7 | C21 | C26 | H29 | 67.2° | 173.8° |
| C11 | O7 | C21 | C20 | 48.6° | 46.1° |
| O7 | C11 | C6 | C12 | 178.2° | 179.8° |
| O7 | C11 | C6 | C5 | 179.9° | 179.7° |
| O7 | C11 | C12 | O6 | 2.6° | 0.5° |
| O7 | C11 | C12 | C8 | 179.4° | 179.9° |
| O7 | C11 | C6 | H6 | 0.1° | 0.3° |
| C11 | O7 | C21 | H18 | 70.2° | 73.6° |
| C21 | C20 | O6 | H16 | 119.8° | 119.7° |
| C21 | C20 | O6 | H17 | 119.7° | 119.7° |
| C21 | C20 | O6 | C12 | 49.5° | 46.3° |
| C21 | C20 | H16 | H17 | 120.7° | 120.7° |
| C20 | C21 | C26 | H28 | 64.6° | 65.0° |
| C20 | C21 | C26 | H29 | 54.7° | 55.0° |
| C11 | C6 | C5 | H6 | 180.0° | 179.9° |
| C11 | C6 | C5 | C10 | 0.3° | 0.0° |
| C6 | C11 | C12 | O6 | 179.3° | 179.7° |
| C6 | C11 | C12 | C8 | 2.5° | 0.1° |
| C11 | C6 | C5 | H5 | 179.7° | 179.7° |
| C5 | C6 | C11 | C12 | 1.7° | 0.1° |
| C6 | C5 | C10 | H5 | 180.0° | 179.7° |
| C6 | C5 | C10 | C8 | 0.4° | 0.3° |
| C6 | C5 | C10 | C23 | 178.1° | 179.6° |
| C11 | C12 | O6 | C20 | 20.0° | 17.4° |
| C11 | C12 | O6 | C8 | 176.9° | 179.6° |
| C11 | C12 | C8 | C10 | 1.8° | 0.4° |
| C11 | C12 | C8 | C14 | 179.4° | 179.9° |
| C12 | C11 | C6 | H6 | 178.3° | 179.9° |
| C5 | C10 | C8 | C12 | 0.4° | 0.5° |
| C5 | C10 | C8 | C23 | 178.5° | 179.9° |
| C5 | C10 | C8 | C14 | 178.0° | 180.0° |
| C5 | C10 | C23 | N2 | 102.6° | 101.9° |
| C10 | C5 | C6 | H6 | 179.7° | 179.9° |
| C5 | C10 | C23 | H21 | 137.8° | 138.0° |
| C5 | C10 | C23 | H22 | 17.2° | 18.1° |
| C20 | O6 | C12 | C8 | 163.1° | 163.0° |
| O6 | C20 | H16 | H17 | 120.7° | 120.6° |
| O6 | C20 | C21 | H18 | 53.7° | 60.0° |
| O6 | C12 | C8 | C10 | 178.7° | 180.0° |
| O6 | C12 | C8 | C14 | 3.6° | 0.5° |
| C12 | O6 | C20 | H16 | 169.2° | 166.0° |
| C12 | O6 | C20 | H17 | 70.3° | 73.4° |
| C12 | C8 | C10 | C14 | 177.7° | 179.5° |
| C12 | C8 | C10 | C23 | 178.8° | 179.4° |
| C12 | C8 | C14 | O4 | 141.1° | 84.4° |
| C12 | C8 | C14 | O1 | 45.2° | 95.5° |
| C24 | N2 | C23 | C10 | 40.1° | 63.0° |
| C24 | N2 | C23 | C22 | 130.9° | 124.0° |
| C24 | N2 | C22 | C9 | 161.8° | 66.0° |
| C24 | N2 | C22 | H19 | 77.2° | 54.0° |
| C24 | N2 | C22 | H20 | 40.9° | 174.0° |
| C24 | N2 | C23 | H21 | 159.7° | 177.0° |
| C24 | N2 | C23 | H22 | 79.7° | 57.0° |
| N2 | C24 | H23 | H24 | 120.0° | 120.0° |
| N2 | C24 | H23 | H25 | 120.1° | 120.0° |
| N2 | C24 | H24 | H25 | 120.0° | 120.0° |
| C8 | C10 | C23 | N2 | 75.9° | 78.2° |
| C10 | C8 | C14 | O4 | 41.2° | 96.1° |
| C10 | C8 | C14 | O1 | 132.5° | 84.0° |
| C8 | C10 | C5 | H5 | 179.6° | 180.0° |
| C8 | C10 | C23 | H21 | 43.7° | 41.9° |
| C8 | C10 | C23 | H22 | 164.3° | 161.9° |
| C23 | C10 | C8 | C14 | 3.5° | 0.1° |
| C10 | C23 | N2 | H21 | 119.7° | 120.0° |
| C10 | C23 | N2 | H22 | 119.7° | 120.0° |
| C10 | C23 | N2 | C22 | 170.9° | 173.1° |
| C23 | C10 | C5 | H5 | 1.9° | 0.1° |
| C10 | C23 | H21 | H22 | 120.9° | 120.0° |
| C8 | C14 | O4 | O1 | 173.1° | 179.9° |
| C8 | C14 | O1 | H32 | 173.4° | 180.0° |
| C23 | N2 | C22 | C9 | 63.7° | 170.0° |
| C23 | N2 | C22 | H19 | 57.2° | 70.0° |
| C23 | N2 | C22 | H20 | 175.4° | 50.0° |
| N2 | C23 | H21 | H22 | 120.9° | 120.0° |
| C23 | N2 | C24 | H23 | 180.0° | 60.5° |
| C23 | N2 | C24 | H24 | 60.0° | 179.5° |
| C23 | N2 | C24 | H25 | 60.0° | 59.5° |
| N2 | C22 | C9 | H19 | 120.9° | 120.0° |
| N2 | C22 | C9 | H20 | 120.9° | 120.0° |
| N2 | C22 | C9 | C7 | 101.2° | 80.0° |
| N2 | C22 | C9 | C4 | 78.7° | 100.3° |
| N2 | C22 | H19 | H20 | 117.1° | 120.0° |
| C22 | N2 | C23 | H21 | 69.4° | 53.0° |
| C22 | N2 | C23 | H22 | 51.2° | 67.0° |
| C22 | N2 | C24 | H23 | 45.5° | 175.5° |
| C22 | N2 | C24 | H24 | 74.5° | 55.5° |
| C22 | N2 | C24 | H25 | 165.5° | 64.5° |
| C16 | C17 | C18 | H10 | 120.3° | 120.0° |
| C16 | C17 | C18 | H11 | 120.3° | 120.0° |
| C16 | C17 | C18 | C19 | 173.4° | 175.0° |
| C16 | C17 | C18 | N1 | 63.7° | 65.0° |
| C17 | C16 | H7 | H8 | 120.0° | 120.0° |
| C17 | C16 | H7 | H9 | 120.0° | 120.0° |
| C17 | C16 | H8 | H9 | 120.0° | 119.9° |
| C16 | C17 | H10 | H11 | 119.1° | 119.9° |
| C16 | C17 | C18 | H12 | 57.3° | 55.0° |
| O4 | C14 | O1 | H32 | 0.0° | 0.1° |
| C22 | C9 | C7 | C13 | 0.5° | 0.0° |
| C22 | C9 | C7 | C4 | 179.9° | 179.7° |
| C22 | C9 | C7 | C3 | 179.8° | 180.0° |
| C22 | C9 | C4 | C2 | 179.7° | 180.0° |
| C22 | C9 | C4 | H4 | 0.3° | 0.0° |
| C9 | C22 | H19 | H20 | 117.1° | 120.0° |
| O3 | C13 | N1 | C18 | 2.1° | 0.0° |
| O3 | C13 | N1 | C7 | 177.9° | 179.9° |
| O3 | C13 | C7 | C9 | 53.4° | 0.0° |
| O3 | C13 | C7 | C3 | 127.0° | 180.0° |
| O3 | C13 | N1 | H30 | 177.8° | 179.9° |
| C17 | C18 | C19 | N1 | 125.2° | 120.0° |
| C17 | C18 | C19 | H12 | 116.1° | 120.0° |
| C17 | C18 | N1 | H12 | 120.7° | 120.0° |
| C17 | C18 | N1 | C13 | 147.5° | 155.0° |
| C18 | C17 | C16 | H7 | 180.0° | 180.0° |
| C18 | C17 | C16 | H8 | 60.0° | 60.0° |
| C18 | C17 | C16 | H9 | 60.0° | 60.0° |
| C18 | C17 | H10 | H11 | 119.1° | 120.0° |
| C17 | C18 | C19 | H13 | 180.0° | 60.0° |
| C17 | C18 | C19 | H14 | 60.0° | 60.0° |
| C17 | C18 | C19 | H15 | 60.0° | 180.0° |
| C17 | C18 | N1 | H30 | 32.5° | 25.0° |
| C19 | C18 | N1 | H12 | 118.3° | 120.0° |
| C19 | C18 | N1 | C13 | 91.5° | 85.0° |
| C19 | C18 | C17 | H10 | 66.3° | 65.0° |
| C19 | C18 | C17 | H11 | 53.1° | 55.0° |
| C18 | C19 | H13 | H14 | 120.0° | 120.0° |
| C18 | C19 | H13 | H15 | 120.0° | 120.0° |
| C18 | C19 | H14 | H15 | 120.0° | 120.0° |
| C19 | C18 | N1 | H30 | 88.5° | 95.1° |
| C18 | N1 | C13 | H30 | 180.0° | 180.0° |
| C18 | N1 | C13 | C7 | 175.8° | 180.0° |
| N1 | C18 | C17 | H10 | 56.6° | 55.0° |
| N1 | C18 | C17 | H11 | 176.0° | 175.0° |
| N1 | C18 | C19 | H13 | 54.7° | 60.0° |
| N1 | C18 | C19 | H14 | 65.2° | 180.0° |
| N1 | C18 | C19 | H15 | 174.8° | 60.0° |
| N1 | C13 | C7 | C9 | 124.7° | 180.0° |
| N1 | C13 | C7 | C3 | 55.0° | 0.0° |
| C13 | N1 | C18 | H12 | 26.8° | 35.0° |
| C13 | C7 | C9 | C3 | 179.7° | 180.0° |
| C13 | C7 | C9 | C4 | 179.4° | 179.7° |
| C13 | C7 | C3 | C1 | 178.9° | 179.9° |
| C13 | C7 | C3 | H3 | 1.2° | 0.0° |
| C7 | C13 | N1 | H30 | 4.2° | 0.0° |
| C7 | C9 | C4 | C2 | 0.2° | 0.3° |
| C9 | C7 | C3 | C1 | 0.8° | 0.1° |
| C9 | C7 | C3 | H3 | 179.2° | 180.0° |
| C7 | C9 | C4 | H4 | 179.8° | 179.8° |
| C7 | C9 | C22 | H19 | 19.7° | 160.0° |
| C7 | C9 | C22 | H20 | 137.9° | 40.0° |
| C4 | C9 | C7 | C3 | 0.3° | 0.3° |
| C9 | C4 | C2 | H4 | 180.0° | 180.0° |
| C9 | C4 | C2 | C1 | 0.2° | 0.0° |
| C9 | C4 | C2 | H2 | 179.8° | 180.0° |
| C4 | C9 | C22 | H19 | 160.4° | 19.7° |
| C4 | C9 | C22 | H20 | 42.2° | 139.7° |
| C7 | C3 | C1 | H3 | 180.0° | 179.9° |
| C7 | C3 | C1 | C2 | 0.8° | 0.2° |
| C7 | C3 | C1 | H1 | 179.2° | 179.9° |
| C4 | C2 | C1 | C3 | 0.3° | 0.3° |
| C4 | C2 | C1 | H2 | 180.0° | 180.0° |
| C4 | C2 | C1 | H1 | 179.7° | 180.0° |
| C3 | C1 | C2 | H1 | 180.0° | 179.7° |
| C3 | C1 | C2 | H2 | 179.7° | 179.7° |
| C2 | C1 | C3 | H3 | 179.2° | 179.7° |
| C1 | C2 | C4 | H4 | 179.8° | 180.0° |
| H1 | C1 | C2 | H2 | 0.3° | 0.0° |
| H1 | C1 | C3 | H3 | 0.8° | 0.0° |
| H2 | C2 | C4 | H4 | 0.2° | 0.0° |
| H5 | C5 | C6 | H6 | 0.2° | 0.4° |
| H7 | C16 | H8 | H9 | 120.0° | 120.1° |
| H7 | C16 | C17 | H10 | 59.7° | 60.0° |
| H7 | C16 | C17 | H11 | 59.7° | 60.0° |
| H8 | C16 | C17 | H10 | 60.3° | 60.0° |
| H8 | C16 | C17 | H11 | 179.7° | 180.0° |
| H9 | C16 | C17 | H10 | 179.7° | 180.0° |
| H9 | C16 | C17 | H11 | 60.3° | 60.1° |
| H10 | C17 | C18 | H12 | 177.6° | 175.0° |
| H11 | C17 | C18 | H12 | 63.0° | 65.0° |
| H12 | C18 | C19 | H13 | 63.9° | 180.0° |
| H12 | C18 | C19 | H14 | 176.1° | 60.0° |
| H12 | C18 | C19 | H15 | 56.1° | 60.0° |
| H12 | C18 | N1 | H30 | 153.2° | 145.0° |
| H13 | C19 | H14 | H15 | 120.0° | 120.0° |
| H16 | C20 | C21 | H18 | 66.1° | 59.6° |
| H17 | C20 | C21 | H18 | 173.4° | 179.7° |
| H18 | C21 | C26 | H28 | 53.3° | 174.5° |
| H18 | C21 | C26 | H29 | 172.7° | 65.5° |
| H23 | C24 | H24 | H25 | 120.0° | 120.1° |
| H26 | C25 | C26 | H28 | 74.7° | 60.0° |
| H26 | C25 | C26 | H29 | 44.6° | 180.0° |
| H27 | C25 | C26 | H28 | 164.4° | NaN° |
| H27 | C25 | C26 | H29 | 76.2° | 60.0° |
