YO0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C35 | sing | 1.43Å | 1.32Å | |
| C35 | C21 | sing | 1.51Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.57Å | |
| C23 | C22 | sing | 1.53Å | 1.56Å | |
| C24 | O2 | sing | 1.43Å | 1.48Å | |
| C21 | C19 | sing | 1.46Å | 1.44Å | |
| C22 | C20 | sing | 1.51Å | 1.55Å | |
| C19 | C20 | doub | 1.36Å | 1.43Å | Aromatic |
| C19 | N3 | sing | 1.38Å | 1.34Å | Aromatic |
| O2 | C25 | sing | 1.36Å | 1.47Å | |
| C20 | C15 | sing | 1.41Å | 1.46Å | Aromatic |
| C30 | C25 | doub | 1.37Å | 1.40Å | Aromatic |
| C30 | C29 | sing | 1.39Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.41Å | 1.42Å | Aromatic |
| C29 | C28 | doub | 1.36Å | 1.38Å | Aromatic |
| N3 | C14 | sing | 1.37Å | 1.35Å | Aromatic |
| C26 | C31 | doub | 1.40Å | 1.44Å | Aromatic |
| C26 | C27 | sing | 1.42Å | 1.38Å | Aromatic |
| C31 | C32 | sing | 1.36Å | 1.40Å | Aromatic |
| C28 | C27 | sing | 1.41Å | 1.43Å | Aromatic |
| C27 | C34 | doub | 1.41Å | 1.42Å | Aromatic |
| C15 | C14 | doub | 1.41Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.42Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.40Å | 1.43Å | Aromatic |
| C34 | C33 | sing | 1.36Å | 1.42Å | Aromatic |
| C16 | C17 | doub | 1.36Å | 1.40Å | Aromatic |
| C13 | C10 | sing | 1.48Å | 1.54Å | |
| C13 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 1.44Å | Aromatic |
| C10 | C9 | doub | 1.36Å | 1.46Å | Aromatic |
| C10 | C8 | sing | 1.41Å | 1.46Å | Aromatic |
| C11 | C9 | sing | 1.51Å | 1.54Å | |
| C9 | N2 | sing | 1.35Å | 1.35Å | Aromatic |
| C7 | C8 | sing | 1.51Å | 1.53Å | |
| C7 | O1 | sing | 1.43Å | 1.39Å | |
| C8 | N1 | doub | 1.31Å | 1.34Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.41Å | Aromatic |
| C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| N2 | N1 | sing | 1.40Å | 1.35Å | Aromatic |
| N2 | C12 | sing | 1.47Å | 1.45Å | |
| C3 | C2 | sing | 1.38Å | 1.41Å | Aromatic |
| O1 | C5 | sing | 1.36Å | 1.43Å | |
| C5 | C6 | doub | 1.39Å | 1.42Å | Aromatic |
| C2 | C1 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C1 | sing | 1.38Å | 1.41Å | Aromatic |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.08Å | 1.08Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.08Å | 1.08Å | |
| C1 | H14 | sing | 1.08Å | 1.08Å | |
| C2 | H15 | sing | 1.08Å | 1.08Å | |
| C3 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.08Å | 1.08Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å | |
| C30 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | H29 | sing | 1.08Å | 1.08Å | |
| C32 | H30 | sing | 1.08Å | 1.08Å | |
| C33 | H31 | sing | 1.08Å | 1.08Å | |
| C34 | H32 | sing | 1.08Å | 1.08Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | O5 | sing | 1.43Å | 1.07Å | |
| O3 | H35 | sing | 0.97Å | 0.95Å | |
| C21 | O4 | doub | 1.21Å | 1.31Å | |
| O5 | H7 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C35 | C21 | 123.0° | 109.5° |
| O3 | C35 | H33 | 110.2° | 109.5° |
| O3 | C35 | O5 | 100.3° | 109.4° |
| C35 | O3 | H35 | 109.5° | 114.0° |
| C35 | C21 | C19 | 118.6° | 120.0° |
| C21 | C35 | H33 | 107.4° | 109.5° |
| C21 | C35 | O5 | 100.3° | 109.4° |
| C35 | C21 | O4 | 109.0° | 120.0° |
| C24 | C23 | C22 | 115.7° | 109.5° |
| C23 | C24 | O2 | 110.7° | 109.4° |
| C23 | C24 | H11 | 109.1° | 109.4° |
| C23 | C24 | H12 | 109.2° | 109.4° |
| C24 | C23 | H25 | 107.9° | 109.5° |
| C24 | C23 | H26 | 107.9° | 109.4° |
| C23 | C22 | C20 | 110.7° | 109.5° |
| C23 | C22 | H9 | 109.2° | 109.5° |
| C23 | C22 | H10 | 109.2° | 109.4° |
| C22 | C23 | H25 | 107.9° | 109.5° |
| C22 | C23 | H26 | 107.9° | 109.4° |
| C24 | O2 | C25 | 112.4° | 117.0° |
| O2 | C24 | H11 | 109.2° | 109.5° |
| O2 | C24 | H12 | 109.2° | 109.5° |
| C21 | C19 | C20 | 132.7° | 125.5° |
| C21 | C19 | N3 | 119.6° | 125.5° |
| C19 | C21 | O4 | 106.8° | 120.0° |
| C22 | C20 | C19 | 130.6° | 126.1° |
| C22 | C20 | C15 | 123.8° | 126.2° |
| C20 | C22 | H9 | 109.2° | 109.5° |
| C20 | C22 | H10 | 109.1° | 109.4° |
| C20 | C19 | N3 | 107.7° | 109.0° |
| C19 | C20 | C15 | 105.6° | 107.7° |
| C19 | N3 | C14 | 112.0° | 108.8° |
| C19 | N3 | H1 | 124.0° | 125.6° |
| O2 | C25 | C30 | 119.4° | 120.2° |
| O2 | C25 | C26 | 120.8° | 120.3° |
| C20 | C15 | C14 | 106.0° | 107.0° |
| C20 | C15 | C16 | 134.4° | 133.3° |
| C25 | C30 | C29 | 120.2° | 120.9° |
| C30 | C25 | C26 | 119.8° | 119.5° |
| C25 | C30 | H28 | 119.9° | 119.6° |
| C30 | C29 | C28 | 120.1° | 121.1° |
| C30 | C29 | H27 | 120.0° | 119.5° |
| C29 | C30 | H28 | 119.9° | 119.5° |
| C25 | C26 | C31 | 120.4° | 121.3° |
| C25 | C26 | C27 | 119.8° | 119.3° |
| C29 | C28 | C27 | 120.0° | 119.8° |
| C29 | C28 | H13 | 120.0° | 120.1° |
| C28 | C29 | H27 | 120.0° | 119.4° |
| N3 | C14 | C15 | 108.8° | 107.6° |
| N3 | C14 | C13 | 130.6° | 133.1° |
| C14 | N3 | H1 | 124.0° | 125.6° |
| C31 | C26 | C27 | 119.8° | 119.4° |
| C26 | C31 | C32 | 120.1° | 119.6° |
| C26 | C31 | H29 | 120.0° | 120.2° |
| C26 | C27 | C28 | 120.1° | 119.4° |
| C26 | C27 | C34 | 120.0° | 119.3° |
| C31 | C32 | C33 | 119.9° | 121.0° |
| C32 | C31 | H29 | 119.9° | 120.2° |
| C31 | C32 | H30 | 120.0° | 119.5° |
| C28 | C27 | C34 | 119.9° | 121.3° |
| C27 | C28 | H13 | 120.0° | 120.1° |
| C27 | C34 | C33 | 120.1° | 119.6° |
| C27 | C34 | H32 | 119.9° | 120.2° |
| C14 | C15 | C16 | 119.7° | 119.7° |
| C15 | C14 | C13 | 120.6° | 119.3° |
| C15 | C16 | C17 | 119.8° | 120.1° |
| C15 | C16 | H23 | 120.1° | 120.0° |
| C32 | C33 | C34 | 120.0° | 120.9° |
| C33 | C32 | H30 | 120.0° | 119.4° |
| C32 | C33 | H31 | 120.0° | 119.6° |
| C14 | C13 | C10 | 118.9° | 120.2° |
| C14 | C13 | C18 | 119.8° | 119.6° |
| C34 | C33 | H31 | 120.0° | 119.5° |
| C33 | C34 | H32 | 120.0° | 120.2° |
| C16 | C17 | C18 | 120.4° | 120.8° |
| C16 | C17 | H6 | 119.8° | 119.6° |
| C17 | C16 | H23 | 120.1° | 119.9° |
| C10 | C13 | C18 | 121.3° | 120.2° |
| C13 | C10 | C9 | 126.8° | 126.2° |
| C13 | C10 | C8 | 127.9° | 126.2° |
| C13 | C18 | C17 | 119.7° | 120.5° |
| C13 | C18 | H24 | 120.1° | 119.8° |
| C18 | C17 | H6 | 119.8° | 119.6° |
| C17 | C18 | H24 | 120.1° | 119.7° |
| C9 | C10 | C8 | 105.3° | 107.5° |
| C10 | C9 | C11 | 126.9° | 126.2° |
| C10 | C9 | N2 | 105.9° | 107.6° |
| C10 | C8 | C7 | 127.0° | 125.9° |
| C10 | C8 | N1 | 106.5° | 108.1° |
| C11 | C9 | N2 | 127.2° | 126.2° |
| C9 | C11 | H17 | 109.5° | 109.4° |
| C9 | C11 | H18 | 109.4° | 109.5° |
| C9 | C11 | H19 | 109.4° | 109.5° |
| C9 | N2 | N1 | 111.4° | 108.2° |
| C9 | N2 | C12 | 124.3° | 125.9° |
| C8 | C7 | O1 | 106.7° | 109.5° |
| C7 | C8 | N1 | 126.5° | 126.0° |
| C8 | C7 | H4 | 110.2° | 109.5° |
| C8 | C7 | H5 | 110.2° | 109.5° |
| C7 | O1 | C5 | 114.7° | 117.0° |
| O1 | C7 | H4 | 110.2° | 109.5° |
| O1 | C7 | H5 | 110.2° | 109.5° |
| C8 | N1 | N2 | 110.9° | 108.5° |
| C3 | C4 | C5 | 119.8° | 120.0° |
| C4 | C3 | C2 | 119.9° | 120.1° |
| C3 | C4 | H2 | 120.1° | 120.0° |
| C4 | C3 | H16 | 120.0° | 120.0° |
| C4 | C5 | O1 | 120.4° | 120.1° |
| C4 | C5 | C6 | 120.2° | 119.8° |
| C5 | C4 | H2 | 120.1° | 120.0° |
| N1 | N2 | C12 | 124.3° | 125.8° |
| N2 | C12 | H20 | 109.5° | 109.5° |
| N2 | C12 | H21 | 109.5° | 109.4° |
| N2 | C12 | H22 | 109.5° | 109.5° |
| C3 | C2 | C1 | 120.3° | 120.1° |
| C3 | C2 | H15 | 119.8° | 120.0° |
| C2 | C3 | H16 | 120.1° | 120.0° |
| O1 | C5 | C6 | 119.4° | 120.1° |
| C5 | C6 | C1 | 119.9° | 120.0° |
| C5 | C6 | H3 | 120.1° | 120.0° |
| C2 | C1 | C6 | 119.9° | 120.1° |
| C2 | C1 | H14 | 120.1° | 120.0° |
| C1 | C2 | H15 | 119.8° | 119.9° |
| C1 | C6 | H3 | 120.1° | 120.0° |
| C6 | C1 | H14 | 120.0° | 120.0° |
| H4 | C7 | H5 | 109.4° | 109.4° |
| H9 | C22 | H10 | 109.5° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H17 | C11 | H18 | 109.5° | 109.5° |
| H17 | C11 | H19 | 109.5° | 109.5° |
| H18 | C11 | H19 | 109.5° | 109.5° |
| H20 | C12 | H21 | 109.5° | 109.4° |
| H20 | C12 | H22 | 109.4° | 109.5° |
| H21 | C12 | H22 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H33 | C35 | O5 | 115.4° | 109.5° |
| C35 | O5 | H7 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C35 | C21 | H33 | 129.5° | 120.1° |
| O3 | C35 | C21 | O5 | 109.6° | 120.0° |
| O3 | C35 | C21 | C19 | 83.0° | 155.0° |
| O3 | C35 | H33 | O5 | 112.7° | 120.0° |
| O3 | C35 | C21 | O4 | 154.6° | 25.0° |
| O3 | C35 | O5 | H7 | 159.5° | 60.0° |
| C35 | C21 | C19 | O4 | 123.5° | 180.0° |
| C35 | C21 | C19 | C20 | 9.3° | 180.0° |
| C35 | C21 | C19 | N3 | 170.7° | 0.0° |
| C21 | C35 | H33 | O5 | 110.9° | 120.0° |
| C21 | C35 | O3 | H35 | 180.0° | 179.9° |
| C21 | C35 | O5 | H7 | 33.0° | 60.0° |
| C24 | C23 | C22 | H25 | 120.9° | 120.0° |
| C24 | C23 | C22 | H26 | 120.9° | 120.0° |
| C23 | C24 | O2 | H11 | 120.2° | 120.0° |
| C23 | C24 | O2 | H12 | 120.2° | 120.0° |
| C24 | C23 | C22 | C20 | 123.6° | 180.0° |
| C23 | C24 | O2 | C25 | 148.9° | 180.0° |
| C24 | C23 | C22 | H9 | 3.4° | 59.9° |
| C24 | C23 | C22 | H10 | 116.2° | 60.0° |
| C23 | C24 | H11 | H12 | 119.4° | 120.0° |
| C24 | C23 | H25 | H26 | 117.2° | 120.0° |
| C22 | C23 | C24 | O2 | 26.1° | 180.0° |
| C23 | C22 | C20 | H9 | 120.2° | 120.0° |
| C23 | C22 | C20 | H10 | 120.2° | 119.9° |
| C23 | C22 | C20 | C19 | 86.8° | 90.5° |
| C23 | C22 | C20 | C15 | 92.7° | 90.0° |
| C23 | C22 | H9 | H10 | 119.5° | 120.0° |
| C22 | C23 | C24 | H11 | 146.3° | 60.0° |
| C22 | C23 | C24 | H12 | 94.1° | 60.0° |
| C22 | C23 | H25 | H26 | 117.2° | 120.0° |
| C24 | O2 | C25 | C30 | 45.0° | 0.1° |
| C24 | O2 | C25 | C26 | 134.6° | 180.0° |
| O2 | C24 | H11 | H12 | 119.4° | 120.0° |
| O2 | C24 | C23 | H25 | 147.0° | 60.0° |
| O2 | C24 | C23 | H26 | 94.8° | 60.0° |
| C21 | C19 | C20 | C22 | 0.3° | 0.2° |
| C21 | C19 | C20 | N3 | 180.0° | 180.0° |
| C21 | C19 | C20 | C15 | 179.8° | 179.8° |
| C21 | C19 | N3 | C14 | 179.9° | 180.0° |
| C21 | C19 | N3 | H1 | 0.1° | 0.3° |
| C19 | C21 | C35 | H33 | 147.5° | 85.0° |
| C19 | C21 | C35 | O5 | 26.6° | 35.0° |
| C22 | C20 | C19 | C15 | 179.6° | 179.6° |
| C22 | C20 | C19 | N3 | 179.7° | 179.9° |
| C22 | C20 | C15 | C14 | 179.8° | 180.0° |
| C22 | C20 | C15 | C16 | 0.4° | 0.5° |
| C20 | C22 | H9 | H10 | 119.4° | 120.0° |
| C20 | C22 | C23 | H25 | 115.5° | 60.0° |
| C20 | C22 | C23 | H26 | 2.7° | 60.1° |
| C20 | C19 | N3 | C14 | 0.1° | 0.0° |
| C19 | C20 | C15 | C14 | 0.2° | 0.4° |
| C19 | C20 | C15 | C16 | 180.0° | 179.9° |
| C20 | C19 | N3 | H1 | 179.9° | 179.7° |
| C19 | C20 | C22 | H9 | 153.0° | 29.6° |
| C19 | C20 | C22 | H10 | 33.4° | 149.6° |
| C20 | C19 | C21 | O4 | 132.8° | 0.0° |
| N3 | C19 | C20 | C15 | 0.1° | 0.3° |
| C19 | N3 | C14 | H1 | 180.0° | 179.7° |
| C19 | N3 | C14 | C15 | 0.0° | 0.3° |
| C19 | N3 | C14 | C13 | 179.9° | 179.7° |
| N3 | C19 | C21 | O4 | 47.2° | 180.0° |
| O2 | C25 | C30 | C26 | 179.7° | 179.9° |
| O2 | C25 | C30 | C29 | 180.0° | 180.0° |
| O2 | C25 | C26 | C31 | 0.3° | 0.0° |
| O2 | C25 | C26 | C27 | 179.9° | 179.7° |
| C25 | O2 | C24 | H11 | 28.7° | 60.0° |
| C25 | O2 | C24 | H12 | 90.9° | 60.1° |
| O2 | C25 | C30 | H28 | 0.0° | 0.1° |
| C20 | C15 | C14 | N3 | 0.1° | 0.4° |
| C20 | C15 | C14 | C16 | 179.8° | 179.5° |
| C20 | C15 | C14 | C13 | 179.8° | 179.5° |
| C20 | C15 | C16 | C17 | 179.8° | 179.4° |
| C15 | C20 | C22 | H9 | 27.5° | 150.0° |
| C15 | C20 | C22 | H10 | 147.1° | 30.0° |
| C20 | C15 | C16 | H23 | 0.2° | 0.6° |
| C25 | C30 | C29 | H28 | 180.0° | 180.0° |
| C25 | C30 | C29 | C28 | 0.2° | 0.3° |
| C30 | C25 | C26 | C31 | 179.9° | 180.0° |
| C30 | C25 | C26 | C27 | 0.3° | 0.2° |
| C25 | C30 | C29 | H27 | 179.8° | 180.0° |
| C29 | C30 | C25 | C26 | 0.3° | 0.0° |
| C30 | C29 | C28 | H27 | 180.0° | 179.7° |
| C30 | C29 | C28 | C27 | 0.1° | 0.3° |
| C30 | C29 | C28 | H13 | 179.9° | 179.7° |
| C25 | C26 | C31 | C27 | 179.8° | 179.8° |
| C25 | C26 | C31 | C32 | 179.8° | 179.7° |
| C25 | C26 | C27 | C28 | 0.1° | 0.2° |
| C25 | C26 | C27 | C34 | 179.8° | 179.7° |
| C26 | C25 | C30 | H28 | 179.7° | 180.0° |
| C25 | C26 | C31 | H29 | 0.2° | 0.2° |
| C29 | C28 | C27 | C26 | 0.0° | 0.1° |
| C29 | C28 | C27 | H13 | 180.0° | 180.0° |
| C29 | C28 | C27 | C34 | 179.9° | 180.0° |
| C28 | C29 | C30 | H28 | 179.8° | 179.8° |
| N3 | C14 | C15 | C13 | 179.9° | 180.0° |
| N3 | C14 | C15 | C16 | 180.0° | 180.0° |
| N3 | C14 | C13 | C10 | 0.0° | 0.1° |
| N3 | C14 | C13 | C18 | 180.0° | 180.0° |
| C26 | C31 | C32 | H29 | 180.0° | 179.9° |
| C31 | C26 | C27 | C28 | 179.9° | 180.0° |
| C31 | C26 | C27 | C34 | 0.0° | 0.0° |
| C26 | C31 | C32 | C33 | 0.0° | 0.1° |
| C26 | C31 | C32 | H30 | 180.0° | 180.0° |
| C27 | C26 | C31 | C32 | 0.0° | 0.1° |
| C26 | C27 | C28 | C34 | 179.9° | 179.9° |
| C26 | C27 | C34 | C33 | 0.1° | 0.0° |
| C26 | C27 | C28 | H13 | 180.0° | 180.0° |
| C27 | C26 | C31 | H29 | 180.0° | 180.0° |
| C26 | C27 | C34 | H32 | 179.9° | 179.9° |
| C31 | C32 | C33 | H30 | 180.0° | 179.9° |
| C31 | C32 | C33 | C34 | 0.1° | 0.1° |
| C31 | C32 | C33 | H31 | 179.9° | 180.0° |
| C28 | C27 | C34 | C33 | 180.0° | 180.0° |
| C27 | C28 | C29 | H27 | 179.9° | 180.0° |
| C28 | C27 | C34 | H32 | 0.0° | 0.1° |
| C27 | C34 | C33 | C32 | 0.1° | 0.0° |
| C27 | C34 | C33 | H32 | 180.0° | 179.9° |
| C34 | C27 | C28 | H13 | 0.1° | 0.0° |
| C27 | C34 | C33 | H31 | 179.9° | 180.0° |
| C14 | C15 | C16 | C17 | 0.0° | 0.1° |
| C15 | C14 | C13 | C10 | 179.9° | 180.0° |
| C15 | C14 | C13 | C18 | 0.1° | 0.0° |
| C15 | C14 | N3 | H1 | 180.0° | 180.0° |
| C14 | C15 | C16 | H23 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 0.0° | 0.0° |
| C15 | C16 | C17 | H23 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.1° | 0.1° |
| C15 | C16 | C17 | H6 | 179.9° | 180.0° |
| C32 | C33 | C34 | H31 | 180.0° | 179.9° |
| C33 | C32 | C31 | H29 | 180.0° | 180.0° |
| C32 | C33 | C34 | H32 | 179.9° | 180.0° |
| C14 | C13 | C10 | C18 | 180.0° | 180.0° |
| C14 | C13 | C18 | C17 | 0.1° | 0.0° |
| C14 | C13 | C10 | C9 | 67.9° | 89.9° |
| C14 | C13 | C10 | C8 | 111.1° | 90.0° |
| C13 | C14 | N3 | H1 | 0.1° | 0.0° |
| C14 | C13 | C18 | H24 | 179.9° | 180.0° |
| C34 | C33 | C32 | H30 | 179.9° | 180.0° |
| C16 | C17 | C18 | C13 | 0.1° | 0.1° |
| C16 | C17 | C18 | H6 | 180.0° | 179.9° |
| C16 | C17 | C18 | H24 | 179.9° | 180.0° |
| C10 | C13 | C18 | C17 | 179.8° | 179.9° |
| C13 | C10 | C9 | C8 | 179.2° | 179.9° |
| C13 | C10 | C9 | C11 | 0.6° | 0.2° |
| C13 | C10 | C9 | N2 | 179.6° | 180.0° |
| C13 | C10 | C8 | C7 | 1.1° | 0.1° |
| C13 | C10 | C8 | N1 | 179.6° | 180.0° |
| C10 | C13 | C18 | H24 | 0.1° | 0.0° |
| C13 | C18 | C17 | H24 | 180.0° | 179.9° |
| C18 | C13 | C10 | C9 | 112.0° | 90.1° |
| C18 | C13 | C10 | C8 | 69.0° | 90.1° |
| C13 | C18 | C17 | H6 | 179.9° | 180.0° |
| C18 | C17 | C16 | H23 | 180.0° | 180.0° |
| C10 | C9 | C11 | N2 | 179.8° | 179.8° |
| C9 | C10 | C8 | C7 | 179.7° | 179.9° |
| C9 | C10 | C8 | N1 | 0.5° | 0.1° |
| C10 | C9 | N2 | N1 | 0.1° | 0.1° |
| C10 | C9 | N2 | C12 | 179.8° | 180.0° |
| C10 | C9 | C11 | H17 | 90.1° | 90.1° |
| C10 | C9 | C11 | H18 | 149.9° | 149.9° |
| C10 | C9 | C11 | H19 | 29.9° | 29.9° |
| C8 | C10 | C9 | C11 | 179.8° | 179.9° |
| C8 | C10 | C9 | N2 | 0.4° | 0.1° |
| C10 | C8 | C7 | N1 | 179.1° | 180.0° |
| C10 | C8 | C7 | O1 | 109.7° | 90.1° |
| C10 | C8 | N1 | N2 | 0.4° | 0.1° |
| C10 | C8 | C7 | H4 | 130.7° | 30.0° |
| C10 | C8 | C7 | H5 | 9.9° | 149.9° |
| C11 | C9 | N2 | N1 | 180.0° | 179.9° |
| C11 | C9 | N2 | C12 | 0.1° | 0.1° |
| C9 | C11 | H17 | H18 | 120.0° | 120.0° |
| C9 | C11 | H17 | H19 | 120.0° | 120.0° |
| C9 | C11 | H18 | H19 | 120.0° | 120.1° |
| C9 | N2 | N1 | C8 | 0.2° | 0.0° |
| C9 | N2 | N1 | C12 | 180.0° | 180.0° |
| N2 | C9 | C11 | H17 | 90.1° | 90.1° |
| N2 | C9 | C11 | H18 | 29.9° | 29.9° |
| N2 | C9 | C11 | H19 | 149.9° | 149.9° |
| C9 | N2 | C12 | H20 | 180.0° | 90.0° |
| C9 | N2 | C12 | H21 | 59.9° | 30.0° |
| C9 | N2 | C12 | H22 | 60.1° | 150.0° |
| C8 | C7 | O1 | H4 | 119.6° | 120.1° |
| C8 | C7 | O1 | H5 | 119.6° | 120.0° |
| C7 | C8 | N1 | N2 | 179.6° | 180.0° |
| C8 | C7 | O1 | C5 | 173.8° | 180.0° |
| C8 | C7 | H4 | H5 | 121.3° | 120.0° |
| O1 | C7 | C8 | N1 | 69.4° | 90.0° |
| C7 | O1 | C5 | C4 | 1.9° | 180.0° |
| C7 | O1 | C5 | C6 | 178.0° | 0.0° |
| O1 | C7 | H4 | H5 | 121.3° | 120.0° |
| C8 | N1 | N2 | C12 | 179.9° | 180.0° |
| N1 | C8 | C7 | H4 | 50.2° | 149.9° |
| N1 | C8 | C7 | H5 | 171.0° | 30.0° |
| C3 | C4 | C5 | H2 | 180.0° | 179.7° |
| C4 | C3 | C2 | H16 | 180.0° | 180.0° |
| C3 | C4 | C5 | O1 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.0° | 0.0° |
| C4 | C3 | C2 | C1 | 0.0° | 0.0° |
| C4 | C3 | C2 | H15 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.0° | 0.0° |
| C4 | C5 | O1 | C6 | 179.9° | 180.0° |
| C4 | C5 | C6 | C1 | 0.0° | 0.0° |
| C4 | C5 | C6 | H3 | 180.0° | 179.9° |
| C5 | C4 | C3 | H16 | 180.0° | 180.0° |
| N1 | N2 | C12 | H20 | 0.0° | 90.0° |
| N1 | N2 | C12 | H21 | 120.0° | 150.0° |
| N1 | N2 | C12 | H22 | 120.0° | 30.0° |
| N2 | C12 | H20 | H21 | 120.0° | 119.9° |
| N2 | C12 | H20 | H22 | 120.0° | 120.0° |
| N2 | C12 | H21 | H22 | 120.0° | 120.0° |
| C3 | C2 | C1 | H15 | 180.0° | 180.0° |
| C3 | C2 | C1 | C6 | 0.1° | 0.0° |
| C2 | C3 | C4 | H2 | 180.0° | 179.7° |
| C3 | C2 | C1 | H14 | 179.9° | 179.9° |
| O1 | C5 | C6 | C1 | 179.9° | 180.0° |
| O1 | C5 | C4 | H2 | 0.0° | 0.3° |
| O1 | C5 | C6 | H3 | 0.1° | 0.1° |
| C5 | O1 | C7 | H4 | 54.3° | 59.9° |
| C5 | O1 | C7 | H5 | 66.6° | 60.0° |
| C5 | C6 | C1 | C2 | 0.1° | 0.0° |
| C5 | C6 | C1 | H3 | 180.0° | 179.9° |
| C6 | C5 | C4 | H2 | 180.0° | 179.7° |
| C5 | C6 | C1 | H14 | 180.0° | 179.9° |
| C2 | C1 | C6 | H14 | 180.0° | 179.9° |
| C2 | C1 | C6 | H3 | 179.9° | 179.9° |
| C1 | C2 | C3 | H16 | 180.0° | 180.0° |
| C6 | C1 | C2 | H15 | 179.9° | 180.0° |
| H2 | C4 | C3 | H16 | 0.0° | 0.3° |
| H3 | C6 | C1 | H14 | 0.1° | 0.0° |
| H6 | C17 | C16 | H23 | 0.1° | 0.0° |
| H6 | C17 | C18 | H24 | 0.1° | 0.1° |
| H9 | C22 | C23 | H25 | 124.3° | 180.0° |
| H9 | C22 | C23 | H26 | 117.5° | 60.0° |
| H10 | C22 | C23 | H25 | 4.7° | 60.0° |
| H10 | C22 | C23 | H26 | 122.9° | 180.0° |
| H11 | C24 | C23 | H25 | 92.8° | 180.0° |
| H11 | C24 | C23 | H26 | 25.4° | 60.0° |
| H12 | C24 | C23 | H25 | 26.8° | 60.0° |
| H12 | C24 | C23 | H26 | 145.0° | 180.0° |
| H13 | C28 | C29 | H27 | 0.1° | 0.0° |
| H14 | C1 | C2 | H15 | 0.0° | 0.0° |
| H15 | C2 | C3 | H16 | 0.0° | 0.0° |
| H17 | C11 | H18 | H19 | 120.0° | 120.0° |
| H20 | C12 | H21 | H22 | 120.0° | 120.1° |
| H27 | C29 | C30 | H28 | 0.2° | 0.0° |
| H29 | C31 | C32 | H30 | 0.0° | 0.1° |
| H30 | C32 | C33 | H31 | 0.1° | 0.1° |
| H31 | C33 | C34 | H32 | 0.1° | 0.1° |
| H33 | C35 | O3 | H35 | 51.7° | 60.0° |
| H33 | C35 | C21 | O4 | 25.1° | 95.0° |
| H33 | C35 | O5 | H7 | 82.1° | 180.0° |
| O5 | C35 | O3 | H35 | 70.4° | 60.0° |
| O5 | C35 | C21 | O4 | 95.8° | 145.0° |
