A1EVQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C27 | doub | 1.22Å | 1.26Å | |
| C27 | O3 | sing | 1.35Å | 1.26Å | |
| C27 | C24 | sing | 1.47Å | 1.53Å | |
| C25 | C24 | doub | 1.40Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.40Å | 1.39Å | Aromatic |
| C26 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| O2 | C20 | doub | 1.22Å | 1.19Å | |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | N2 | sing | 1.39Å | 1.47Å | |
| C20 | N2 | sing | 1.34Å | 1.49Å | |
| C20 | N3 | sing | 1.34Å | 1.46Å | |
| N2 | C19 | sing | 1.47Å | 1.49Å | |
| N3 | C16 | sing | 1.47Å | 1.44Å | |
| C19 | C16 | sing | 1.54Å | 1.53Å | |
| C16 | C15 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C15 | C14 | sing | 1.53Å | 1.55Å | |
| C14 | N1 | sing | 1.47Å | 1.47Å | |
| N1 | C13 | sing | 1.47Å | 1.49Å | |
| N1 | C18 | sing | 1.47Å | 1.47Å | |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C13 | C5 | sing | 1.51Å | 1.56Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C11 | C12 | sing | 1.53Å | 1.50Å | |
| C10 | C12 | sing | 1.53Å | 1.55Å | |
| C10 | C6 | sing | 1.51Å | 1.55Å | |
| C5 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.40Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | O1 | sing | 1.36Å | 1.42Å | |
| C2 | O1 | sing | 1.43Å | 1.41Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.51Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.08Å | 1.08Å | |
| C23 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C4 | H27 | sing | 1.08Å | 1.08Å | |
| C7 | H28 | sing | 1.08Å | 1.08Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| C9 | H30 | sing | 1.09Å | 1.10Å | |
| C9 | H31 | sing | 1.09Å | 1.10Å | |
| N3 | H33 | sing | 0.97Å | 1.00Å | |
| O3 | H34 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C27 | O3 | 120.2° | 119.9° |
| O4 | C27 | C24 | 119.5° | 120.0° |
| O3 | C27 | C24 | 120.3° | 120.0° |
| C27 | O3 | H34 | 109.5° | 117.0° |
| C27 | C24 | C25 | 119.4° | 120.1° |
| C27 | C24 | C23 | 120.3° | 120.1° |
| C24 | C25 | C26 | 119.8° | 119.8° |
| C25 | C24 | C23 | 120.3° | 119.9° |
| C24 | C25 | H25 | 120.1° | 120.1° |
| C25 | C26 | C21 | 120.0° | 120.1° |
| C26 | C25 | H25 | 120.1° | 120.0° |
| C25 | C26 | H26 | 120.0° | 119.9° |
| C24 | C23 | C22 | 120.0° | 119.9° |
| C24 | C23 | H24 | 120.0° | 120.0° |
| C26 | C21 | C22 | 120.3° | 120.2° |
| C26 | C21 | N2 | 119.2° | 119.9° |
| C21 | C26 | H26 | 120.0° | 120.0° |
| O2 | C20 | N2 | 125.9° | 123.1° |
| O2 | C20 | N3 | 126.3° | 123.1° |
| C23 | C22 | C21 | 119.7° | 120.1° |
| C23 | C22 | H23 | 120.2° | 120.0° |
| C22 | C23 | H24 | 120.0° | 120.0° |
| C22 | C21 | N2 | 120.6° | 119.9° |
| C21 | C22 | H23 | 120.2° | 119.9° |
| C21 | N2 | C20 | 125.8° | 125.4° |
| C21 | N2 | C19 | 126.5° | 125.4° |
| N2 | C20 | N3 | 107.9° | 113.9° |
| C20 | N2 | C19 | 107.7° | 109.2° |
| C20 | N3 | C16 | 110.1° | 109.0° |
| C20 | N3 | H33 | 125.0° | 125.5° |
| N2 | C19 | C16 | 106.6° | 103.7° |
| N2 | C19 | H19 | 110.2° | 110.6° |
| N2 | C19 | H20 | 110.2° | 110.7° |
| N3 | C16 | C19 | 107.7° | 104.4° |
| N3 | C16 | C15 | 113.6° | 110.7° |
| N3 | C16 | C17 | 114.3° | 110.7° |
| C16 | N3 | H33 | 124.9° | 125.5° |
| C19 | C16 | C15 | 110.6° | 110.2° |
| C19 | C16 | C17 | 100.7° | 110.3° |
| C16 | C19 | H19 | 110.2° | 110.6° |
| C16 | C19 | H20 | 110.2° | 110.6° |
| C15 | C16 | C17 | 109.2° | 110.4° |
| C16 | C15 | C14 | 110.5° | 109.3° |
| C16 | C15 | H13 | 109.2° | 109.6° |
| C16 | C15 | H14 | 109.2° | 109.5° |
| C16 | C17 | C18 | 109.8° | 109.3° |
| C16 | C17 | H15 | 109.4° | 109.5° |
| C16 | C17 | H16 | 109.4° | 109.5° |
| C15 | C14 | N1 | 110.2° | 109.5° |
| C15 | C14 | H11 | 109.3° | 109.5° |
| C15 | C14 | H12 | 109.3° | 109.5° |
| C14 | C15 | H13 | 109.2° | 109.5° |
| C14 | C15 | H14 | 109.2° | 109.5° |
| C14 | N1 | C13 | 110.9° | 111.0° |
| C14 | N1 | C18 | 113.0° | 111.3° |
| N1 | C14 | H11 | 109.3° | 109.5° |
| N1 | C14 | H12 | 109.3° | 109.4° |
| C13 | N1 | C18 | 114.0° | 111.0° |
| N1 | C13 | C5 | 114.3° | 109.5° |
| N1 | C13 | H9 | 108.2° | 109.5° |
| N1 | C13 | H10 | 108.2° | 109.5° |
| N1 | C18 | C17 | 111.0° | 109.5° |
| N1 | C18 | H17 | 109.1° | 109.5° |
| N1 | C18 | H18 | 109.1° | 109.5° |
| C18 | C17 | H15 | 109.4° | 109.5° |
| C18 | C17 | H16 | 109.4° | 109.5° |
| C17 | C18 | H17 | 109.1° | 109.5° |
| C17 | C18 | H18 | 109.1° | 109.5° |
| C13 | C5 | C6 | 118.9° | 120.0° |
| C13 | C5 | C4 | 121.3° | 120.0° |
| C5 | C13 | H9 | 108.2° | 109.4° |
| C5 | C13 | H10 | 108.2° | 109.4° |
| C10 | C11 | C12 | 61.2° | 60.0° |
| C11 | C10 | C12 | 57.7° | 60.0° |
| C11 | C10 | C6 | 121.5° | 117.5° |
| C11 | C10 | H4 | 109.6° | 117.5° |
| C10 | C11 | H5 | 119.8° | 117.5° |
| C10 | C11 | H6 | 119.8° | 117.5° |
| C11 | C12 | C10 | 61.1° | 60.0° |
| C12 | C11 | H5 | 119.8° | 117.5° |
| C12 | C11 | H6 | 119.8° | 117.6° |
| C11 | C12 | H7 | 119.8° | 117.4° |
| C11 | C12 | H8 | 119.8° | 117.5° |
| C12 | C10 | C6 | 137.2° | 117.5° |
| C12 | C10 | H4 | 109.6° | 117.4° |
| C10 | C12 | H7 | 119.8° | 117.5° |
| C10 | C12 | H8 | 119.8° | 117.5° |
| C10 | C6 | C5 | 119.6° | 120.0° |
| C10 | C6 | C7 | 119.8° | 119.9° |
| C6 | C10 | H4 | 109.7° | 115.6° |
| C6 | C5 | C4 | 119.7° | 120.1° |
| C5 | C6 | C7 | 120.5° | 120.1° |
| C5 | C4 | C3 | 119.7° | 119.9° |
| C5 | C4 | H27 | 120.1° | 120.1° |
| C6 | C7 | C8 | 119.9° | 120.0° |
| C6 | C7 | H28 | 120.0° | 120.0° |
| C4 | C3 | C8 | 120.3° | 119.9° |
| C4 | C3 | O1 | 120.3° | 120.0° |
| C3 | C4 | H27 | 120.1° | 120.0° |
| C7 | C8 | C3 | 119.9° | 120.0° |
| C7 | C8 | C9 | 119.6° | 120.0° |
| C8 | C7 | H28 | 120.1° | 119.9° |
| C8 | C3 | O1 | 119.4° | 120.1° |
| C3 | C8 | C9 | 120.5° | 120.0° |
| C3 | O1 | C2 | 114.3° | 117.0° |
| O1 | C2 | C1 | 108.4° | 109.5° |
| O1 | C2 | H21 | 109.7° | 109.5° |
| O1 | C2 | H22 | 109.7° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.4° |
| C1 | C2 | H21 | 109.8° | 109.5° |
| C1 | C2 | H22 | 109.7° | 109.4° |
| C8 | C9 | H29 | 109.5° | 109.5° |
| C8 | C9 | H30 | 109.5° | 109.4° |
| C8 | C9 | H31 | 109.5° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H5 | C11 | H6 | 109.5° | 115.5° |
| H7 | C12 | H8 | 109.5° | 115.6° |
| H9 | C13 | H10 | 109.5° | 109.5° |
| H11 | C14 | H12 | 109.5° | 109.4° |
| H13 | C15 | H14 | 109.4° | 109.5° |
| H15 | C17 | H16 | 109.4° | 109.6° |
| H17 | C18 | H18 | 109.5° | 109.4° |
| H19 | C19 | H20 | 109.5° | 110.5° |
| H21 | C2 | H22 | 109.4° | 109.5° |
| H29 | C9 | H30 | 109.5° | 109.5° |
| H29 | C9 | H31 | 109.5° | 109.5° |
| H30 | C9 | H31 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C27 | O3 | C24 | 179.8° | 179.9° |
| O4 | C27 | C24 | C25 | 15.1° | 180.0° |
| O4 | C27 | C24 | C23 | 165.0° | 0.0° |
| O4 | C27 | O3 | H34 | 0.0° | 0.1° |
| O3 | C27 | C24 | C25 | 165.1° | 0.0° |
| O3 | C27 | C24 | C23 | 14.8° | 180.0° |
| C27 | C24 | C25 | C23 | 179.9° | 180.0° |
| C27 | C24 | C25 | C26 | 180.0° | 179.8° |
| C27 | C24 | C23 | C22 | 180.0° | 180.0° |
| C27 | C24 | C23 | H24 | 0.0° | 0.1° |
| C27 | C24 | C25 | H25 | 0.0° | 0.0° |
| C24 | C27 | O3 | H34 | 179.8° | 180.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | C21 | 0.3° | 0.5° |
| C25 | C24 | C23 | C22 | 0.2° | 0.0° |
| C25 | C24 | C23 | H24 | 179.9° | 180.0° |
| C24 | C25 | C26 | H26 | 179.7° | 180.0° |
| C26 | C25 | C24 | C23 | 0.1° | 0.2° |
| C25 | C26 | C21 | H26 | 180.0° | 179.5° |
| C25 | C26 | C21 | C22 | 0.5° | 0.5° |
| C25 | C26 | C21 | N2 | 179.7° | 179.8° |
| C24 | C23 | C22 | H24 | 180.0° | 179.9° |
| C24 | C23 | C22 | C21 | 0.4° | 0.0° |
| C24 | C23 | C22 | H23 | 179.6° | 180.0° |
| C23 | C24 | C25 | H25 | 179.9° | 180.0° |
| C26 | C21 | C22 | C23 | 0.6° | 0.3° |
| C26 | C21 | C22 | N2 | 179.2° | 179.7° |
| C26 | C21 | N2 | C20 | 40.7° | 6.1° |
| C26 | C21 | N2 | C19 | 138.9° | 173.9° |
| C26 | C21 | C22 | H23 | 179.4° | 179.8° |
| C21 | C26 | C25 | H25 | 179.7° | 179.7° |
| O2 | C20 | N2 | C21 | 0.7° | 0.0° |
| O2 | C20 | N2 | N3 | 179.6° | 180.0° |
| O2 | C20 | N2 | C19 | 179.6° | 180.0° |
| O2 | C20 | N3 | C16 | 179.9° | 180.0° |
| O2 | C20 | N3 | H33 | 0.1° | 0.0° |
| C23 | C22 | C21 | H23 | 180.0° | 180.0° |
| C23 | C22 | C21 | N2 | 179.7° | 179.9° |
| C22 | C21 | N2 | C20 | 140.1° | 174.2° |
| C22 | C21 | N2 | C19 | 40.2° | 5.7° |
| C21 | C22 | C23 | H24 | 179.6° | 179.9° |
| C22 | C21 | C26 | H26 | 179.5° | 180.0° |
| C21 | N2 | C20 | C19 | 179.7° | 179.9° |
| C21 | N2 | C20 | N3 | 179.7° | 180.0° |
| C21 | N2 | C19 | C16 | 179.2° | 179.9° |
| C21 | N2 | C19 | H19 | 59.6° | 61.4° |
| C21 | N2 | C19 | H20 | 61.3° | 61.4° |
| N2 | C21 | C22 | H23 | 0.3° | 0.1° |
| N2 | C21 | C26 | H26 | 0.3° | 0.3° |
| N2 | C20 | N3 | C16 | 0.5° | 0.1° |
| C20 | N2 | C19 | C16 | 0.5° | 0.0° |
| C20 | N2 | C19 | H19 | 120.0° | 118.5° |
| C20 | N2 | C19 | H20 | 119.1° | 118.7° |
| N2 | C20 | N3 | H33 | 179.5° | 179.9° |
| N3 | C20 | N2 | C19 | 0.0° | 0.0° |
| C20 | N3 | C16 | H33 | 180.0° | 180.0° |
| C20 | N3 | C16 | C19 | 0.8° | 0.1° |
| C20 | N3 | C16 | C15 | 122.0° | 118.6° |
| C20 | N3 | C16 | C17 | 111.8° | 118.6° |
| N2 | C19 | C16 | N3 | 0.8° | 0.0° |
| N2 | C19 | C16 | H19 | 119.6° | 118.5° |
| N2 | C19 | C16 | H20 | 119.5° | 118.7° |
| N2 | C19 | C16 | C15 | 123.9° | 118.9° |
| N2 | C19 | C16 | C17 | 120.8° | 118.9° |
| N2 | C19 | H19 | H20 | 121.4° | 123.0° |
| N3 | C16 | C19 | C15 | 124.6° | 118.8° |
| N3 | C16 | C19 | C17 | 120.0° | 118.9° |
| N3 | C16 | C15 | C17 | 128.8° | 122.9° |
| N3 | C16 | C15 | C14 | 76.0° | 179.3° |
| N3 | C16 | C17 | C18 | 69.4° | 179.3° |
| N3 | C16 | C15 | H13 | 44.2° | 60.8° |
| N3 | C16 | C15 | H14 | 163.9° | 59.4° |
| N3 | C16 | C17 | H15 | 170.5° | 60.9° |
| N3 | C16 | C17 | H16 | 50.6° | 59.3° |
| N3 | C16 | C19 | H19 | 120.3° | 118.6° |
| N3 | C16 | C19 | H20 | 118.8° | 118.7° |
| C19 | C16 | C15 | C17 | 109.9° | 122.2° |
| C19 | C16 | C15 | C14 | 162.8° | 65.8° |
| C19 | C16 | C17 | C18 | 175.4° | 65.7° |
| C19 | C16 | C15 | H13 | 77.0° | 54.2° |
| C19 | C16 | C15 | H14 | 42.6° | 174.3° |
| C19 | C16 | C17 | H15 | 55.3° | 54.1° |
| C19 | C16 | C17 | H16 | 64.5° | 174.3° |
| C16 | C19 | H19 | H20 | 121.3° | 122.8° |
| C19 | C16 | N3 | H33 | 179.2° | 180.0° |
| C16 | C15 | C14 | H13 | 120.2° | 120.0° |
| C16 | C15 | C14 | H14 | 120.2° | 120.0° |
| C16 | C15 | C14 | N1 | 4.9° | 58.3° |
| C15 | C16 | C17 | C18 | 59.0° | 56.4° |
| C16 | C15 | C14 | H11 | 125.0° | 178.3° |
| C16 | C15 | C14 | H12 | 115.2° | 61.7° |
| C16 | C15 | H13 | H14 | 119.5° | 120.1° |
| C15 | C16 | C17 | H15 | 61.1° | 176.2° |
| C15 | C16 | C17 | H16 | 179.1° | 63.6° |
| C15 | C16 | C19 | H19 | 4.3° | 122.6° |
| C15 | C16 | C19 | H20 | 116.6° | 0.2° |
| C15 | C16 | N3 | H33 | 58.0° | 61.4° |
| C17 | C16 | C15 | C14 | 52.9° | 56.4° |
| C16 | C17 | C18 | N1 | 6.4° | 58.3° |
| C16 | C17 | C18 | H15 | 120.0° | 119.9° |
| C16 | C17 | C18 | H16 | 120.1° | 120.0° |
| C17 | C16 | C15 | H13 | 173.0° | 176.3° |
| C17 | C16 | C15 | H14 | 67.3° | 63.6° |
| C16 | C17 | H15 | H16 | 119.8° | 120.2° |
| C16 | C17 | C18 | H17 | 113.9° | 61.7° |
| C16 | C17 | C18 | H18 | 126.6° | 178.4° |
| C17 | C16 | C19 | H19 | 119.7° | 0.4° |
| C17 | C16 | C19 | H20 | 1.2° | 122.4° |
| C17 | C16 | N3 | H33 | 68.2° | 61.4° |
| C15 | C14 | N1 | H11 | 120.1° | 120.0° |
| C15 | C14 | N1 | H12 | 120.1° | 120.0° |
| C15 | C14 | N1 | C13 | 169.3° | 173.7° |
| C15 | C14 | N1 | C18 | 61.2° | 62.1° |
| C15 | C14 | H11 | H12 | 119.7° | 120.0° |
| C14 | C15 | H13 | H14 | 119.5° | 120.0° |
| C14 | N1 | C13 | C18 | 128.9° | 124.3° |
| C14 | N1 | C18 | C17 | 55.0° | 62.2° |
| C14 | N1 | C13 | C5 | 95.1° | 170.0° |
| C14 | N1 | C13 | H9 | 144.2° | 70.1° |
| C14 | N1 | C13 | H10 | 25.6° | 50.0° |
| N1 | C14 | H11 | H12 | 119.7° | 120.0° |
| N1 | C14 | C15 | H13 | 115.3° | 178.3° |
| N1 | C14 | C15 | H14 | 125.0° | 61.7° |
| C14 | N1 | C18 | H17 | 175.2° | 57.9° |
| C14 | N1 | C18 | H18 | 65.3° | 177.8° |
| C13 | N1 | C18 | C17 | 177.2° | 173.7° |
| N1 | C13 | C5 | H9 | 120.7° | 120.0° |
| N1 | C13 | C5 | H10 | 120.7° | 120.0° |
| N1 | C13 | C5 | C6 | 104.0° | 80.0° |
| N1 | C13 | C5 | C4 | 77.4° | 99.9° |
| N1 | C13 | H9 | H10 | 117.8° | 120.1° |
| C13 | N1 | C14 | H11 | 49.2° | 53.6° |
| C13 | N1 | C14 | H12 | 70.6° | 66.3° |
| C13 | N1 | C18 | H17 | 56.9° | 66.3° |
| C13 | N1 | C18 | H18 | 62.6° | 53.7° |
| N1 | C18 | C17 | H17 | 120.3° | 120.0° |
| N1 | C18 | C17 | H18 | 120.2° | 120.0° |
| C18 | N1 | C13 | C5 | 33.8° | 65.7° |
| C18 | N1 | C13 | H9 | 86.9° | 54.3° |
| C18 | N1 | C13 | H10 | 154.5° | 174.3° |
| C18 | N1 | C14 | H11 | 178.7° | 177.8° |
| C18 | N1 | C14 | H12 | 58.9° | 57.9° |
| N1 | C18 | C17 | H15 | 113.7° | 178.2° |
| N1 | C18 | C17 | H16 | 126.4° | 61.6° |
| N1 | C18 | H17 | H18 | 119.3° | 120.0° |
| C18 | C17 | H15 | H16 | 119.9° | 120.1° |
| C17 | C18 | H17 | H18 | 119.3° | 120.0° |
| C13 | C5 | C6 | C10 | 0.9° | 0.0° |
| C13 | C5 | C6 | C4 | 178.6° | 179.9° |
| C13 | C5 | C6 | C7 | 179.5° | 180.0° |
| C13 | C5 | C4 | C3 | 179.3° | 180.0° |
| C5 | C13 | H9 | H10 | 117.8° | 120.0° |
| C13 | C5 | C4 | H27 | 0.7° | 0.0° |
| C10 | C11 | C12 | H5 | 109.8° | 107.5° |
| C10 | C11 | C12 | H6 | 109.8° | 107.5° |
| C11 | C10 | C12 | C6 | 103.2° | 107.5° |
| C11 | C10 | C12 | H4 | 101.3° | 107.5° |
| C11 | C10 | C6 | H4 | 129.6° | 145.7° |
| C11 | C10 | C6 | C5 | 97.8° | 171.4° |
| C11 | C10 | C6 | C7 | 82.6° | 8.7° |
| C10 | C11 | H5 | H6 | 144.1° | 145.7° |
| C10 | C11 | C12 | H7 | 109.8° | 107.5° |
| C10 | C11 | C12 | H8 | 109.8° | 107.5° |
| C12 | C11 | H5 | H6 | 144.1° | 145.7° |
| C11 | C12 | H7 | H8 | 144.2° | 145.7° |
| C12 | C10 | C6 | H4 | 155.5° | 145.7° |
| C12 | C10 | C6 | C5 | 172.8° | 120.0° |
| C12 | C10 | C6 | C7 | 7.6° | 60.0° |
| C10 | C12 | H7 | H8 | 144.1° | 145.7° |
| C10 | C6 | C5 | C7 | 179.6° | 179.9° |
| C10 | C6 | C5 | C4 | 179.6° | 179.9° |
| C10 | C6 | C7 | C8 | 179.9° | 180.0° |
| C6 | C10 | C11 | H5 | 121.1° | 145.0° |
| C6 | C10 | C11 | H6 | 19.3° | 0.0° |
| C6 | C10 | C12 | H7 | 147.0° | 0.0° |
| C6 | C10 | C12 | H8 | 6.6° | 145.0° |
| C10 | C6 | C7 | H28 | 0.1° | 0.0° |
| C6 | C5 | C4 | C3 | 0.7° | 0.1° |
| C5 | C6 | C7 | C8 | 0.6° | 0.1° |
| C5 | C6 | C10 | H4 | 31.7° | 25.7° |
| C6 | C5 | C13 | H9 | 16.7° | 160.0° |
| C6 | C5 | C13 | H10 | 135.3° | 40.0° |
| C6 | C5 | C4 | H27 | 179.3° | 180.0° |
| C5 | C6 | C7 | H28 | 179.4° | 179.9° |
| C4 | C5 | C6 | C7 | 0.9° | 0.0° |
| C5 | C4 | C3 | H27 | 180.0° | 180.0° |
| C5 | C4 | C3 | C8 | 0.3° | 0.0° |
| C5 | C4 | C3 | O1 | 179.8° | 179.7° |
| C4 | C5 | C13 | H9 | 161.9° | 20.1° |
| C4 | C5 | C13 | H10 | 43.3° | 140.1° |
| C6 | C7 | C8 | H28 | 180.0° | 180.0° |
| C6 | C7 | C8 | C3 | 0.2° | 0.1° |
| C6 | C7 | C8 | C9 | 179.9° | 179.7° |
| C7 | C6 | C10 | H4 | 147.9° | 154.3° |
| C4 | C3 | C8 | C7 | 0.1° | 0.1° |
| C4 | C3 | C8 | O1 | 179.9° | 179.7° |
| C4 | C3 | O1 | C2 | 47.6° | 0.3° |
| C4 | C3 | C8 | C9 | 180.0° | 179.8° |
| C7 | C8 | C3 | C9 | 179.9° | 179.8° |
| C7 | C8 | C3 | O1 | 180.0° | 179.8° |
| C7 | C8 | C9 | H29 | 90.0° | 90.2° |
| C7 | C8 | C9 | H30 | 149.9° | 29.8° |
| C7 | C8 | C9 | H31 | 30.0° | 149.8° |
| C8 | C3 | O1 | C2 | 132.5° | 180.0° |
| C8 | C3 | C4 | H27 | 179.6° | 180.0° |
| C3 | C8 | C7 | H28 | 179.8° | 179.9° |
| C3 | C8 | C9 | H29 | 90.0° | 89.9° |
| C3 | C8 | C9 | H30 | 30.0° | 150.0° |
| C3 | C8 | C9 | H31 | 149.9° | 30.0° |
| C3 | O1 | C2 | C1 | 126.3° | 180.0° |
| O1 | C3 | C8 | C9 | 0.1° | 0.1° |
| C3 | O1 | C2 | H21 | 113.8° | 60.0° |
| C3 | O1 | C2 | H22 | 6.5° | 60.1° |
| O1 | C3 | C4 | H27 | 0.2° | 0.3° |
| O1 | C2 | C1 | H21 | 119.8° | 120.0° |
| O1 | C2 | C1 | H22 | 119.9° | 120.0° |
| O1 | C2 | C1 | H1 | 180.0° | 60.0° |
| O1 | C2 | C1 | H2 | 60.0° | 180.0° |
| O1 | C2 | C1 | H3 | 60.0° | 60.0° |
| O1 | C2 | H21 | H22 | 120.5° | 120.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 119.9° |
| C2 | C1 | H2 | H3 | 120.0° | 119.9° |
| C1 | C2 | H21 | H22 | 120.5° | 119.9° |
| C9 | C8 | C7 | H28 | 0.1° | 0.3° |
| C8 | C9 | H29 | H30 | 120.0° | 120.0° |
| C8 | C9 | H29 | H31 | 120.0° | 119.9° |
| C8 | C9 | H30 | H31 | 120.0° | 119.9° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H1 | C1 | C2 | H21 | 60.2° | 180.0° |
| H1 | C1 | C2 | H22 | 60.1° | 60.0° |
| H2 | C1 | C2 | H21 | 179.8° | 60.0° |
| H2 | C1 | C2 | H22 | 59.9° | 60.0° |
| H3 | C1 | C2 | H21 | 59.9° | 60.0° |
| H3 | C1 | C2 | H22 | 179.8° | 180.0° |
| H4 | C10 | C11 | H5 | 8.5° | 0.0° |
| H4 | C10 | C11 | H6 | 148.9° | 145.0° |
| H4 | C10 | C12 | H7 | 8.5° | 145.1° |
| H4 | C10 | C12 | H8 | 148.9° | 0.0° |
| H5 | C11 | C12 | H7 | 0.0° | 145.0° |
| H5 | C11 | C12 | H8 | 140.5° | 0.0° |
| H6 | C11 | C12 | H7 | 140.4° | 0.0° |
| H6 | C11 | C12 | H8 | 0.0° | 145.0° |
| H11 | C14 | C15 | H13 | 4.8° | 61.7° |
| H11 | C14 | C15 | H14 | 114.9° | 58.3° |
| H12 | C14 | C15 | H13 | 124.6° | 58.3° |
| H12 | C14 | C15 | H14 | 4.9° | 178.3° |
| H15 | C17 | C18 | H17 | 126.1° | 58.2° |
| H15 | C17 | C18 | H18 | 6.6° | 61.8° |
| H16 | C17 | C18 | H17 | 6.2° | 178.3° |
| H16 | C17 | C18 | H18 | 113.3° | 58.4° |
| H23 | C22 | C23 | H24 | 0.4° | 0.0° |
| H25 | C25 | C26 | H26 | 0.3° | 0.2° |
| H29 | C9 | H30 | H31 | 120.0° | 120.1° |
