1R8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.40Å | Aromatic |
| C20 | C18 | sing | 1.51Å | 1.53Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | O13 | sing | 1.36Å | 1.37Å | |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| O13 | C1 | sing | 1.42Å | 1.44Å | |
| C19 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C2 | C3 | sing | 1.54Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.55Å | |
| C14 | C11 | sing | 1.51Å | 1.56Å | |
| C3 | C4 | sing | 1.54Å | 1.55Å | |
| C1 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | N10 | sing | 1.47Å | 1.49Å | |
| N10 | C9 | sing | 1.47Å | 1.48Å | |
| O8 | C6 | sing | 1.43Å | 1.42Å | |
| C9 | C6 | sing | 1.53Å | 1.52Å | |
| O32 | C31 | doub | 1.21Å | 1.23Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | C22 | sing | 1.53Å | 1.54Å | |
| C5 | N7 | sing | 1.46Å | 1.47Å | |
| C31 | N7 | sing | 1.35Å | 1.34Å | |
| C31 | C36 | sing | 1.51Å | 1.53Å | |
| C28 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C28 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C27 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| C35 | C34 | sing | 1.53Å | 1.54Å | |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C34 | C33 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C29 | sing | 1.51Å | 1.55Å | |
| C33 | C30 | sing | 1.53Å | 1.56Å | |
| C30 | C29 | sing | 1.53Å | 1.56Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| N10 | H18 | sing | 1.01Å | 1.00Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| C9 | H21 | sing | 1.09Å | 1.10Å | |
| C6 | H22 | sing | 1.09Å | 1.10Å | |
| O8 | H23 | sing | 0.97Å | 0.95Å | |
| C5 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C27 | H29 | sing | 1.08Å | 1.08Å | |
| C26 | H30 | sing | 1.08Å | 1.08Å | |
| C29 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C30 | H33 | sing | 1.09Å | 1.10Å | |
| C30 | H34 | sing | 1.09Å | 1.10Å | |
| C33 | H35 | sing | 1.09Å | 1.10Å | |
| C33 | H36 | sing | 1.09Å | 1.10Å | |
| C34 | H37 | sing | 1.09Å | 1.10Å | |
| C34 | H38 | sing | 1.09Å | 1.10Å | |
| C35 | H39 | sing | 1.09Å | 1.10Å | |
| C35 | H40 | sing | 1.09Å | 1.10Å | |
| C36 | H41 | sing | 1.09Å | 1.10Å | |
| C36 | H42 | sing | 1.09Å | 1.10Å | |
| N7 | H43 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C18 | 109.7° | 109.5° |
| C21 | C20 | H11 | 109.4° | 109.5° |
| C21 | C20 | H12 | 109.4° | 109.5° |
| C20 | C21 | H13 | 109.5° | 109.5° |
| C20 | C21 | H14 | 109.4° | 109.4° |
| C20 | C21 | H15 | 109.5° | 109.5° |
| C16 | C17 | C18 | 120.1° | 119.9° |
| C17 | C16 | C15 | 120.2° | 120.3° |
| C17 | C16 | H9 | 119.9° | 119.9° |
| C16 | C17 | H10 | 119.9° | 120.0° |
| C17 | C18 | C20 | 120.9° | 120.0° |
| C17 | C18 | C19 | 119.6° | 120.0° |
| C18 | C17 | H10 | 120.0° | 120.1° |
| C16 | C15 | O13 | 118.2° | 118.2° |
| C16 | C15 | C14 | 119.7° | 119.8° |
| C15 | C16 | H9 | 119.9° | 119.8° |
| C20 | C18 | C19 | 119.5° | 120.0° |
| C18 | C20 | H11 | 109.4° | 109.4° |
| C18 | C20 | H12 | 109.4° | 109.5° |
| C18 | C19 | C14 | 121.2° | 120.5° |
| C18 | C19 | H16 | 119.4° | 119.8° |
| O13 | C15 | C14 | 122.1° | 122.0° |
| C15 | O13 | C1 | 116.6° | 117.5° |
| C15 | C14 | C19 | 119.2° | 119.6° |
| C15 | C14 | C11 | 121.6° | 122.1° |
| O13 | C1 | C2 | 114.0° | 114.0° |
| O13 | C1 | C4 | 113.5° | 114.0° |
| O13 | C1 | C12 | 111.8° | 112.0° |
| C19 | C14 | C11 | 119.2° | 118.4° |
| C14 | C19 | H16 | 119.4° | 119.7° |
| C3 | C2 | C1 | 89.7° | 86.9° |
| C2 | C3 | C4 | 90.0° | 87.2° |
| C3 | C2 | H1 | 114.2° | 113.7° |
| C3 | C2 | H2 | 114.1° | 113.7° |
| C2 | C3 | H3 | 114.1° | 113.6° |
| C2 | C3 | H4 | 114.1° | 113.6° |
| C2 | C1 | C4 | 89.9° | 87.6° |
| C2 | C1 | C12 | 114.9° | 113.6° |
| C1 | C2 | H1 | 114.1° | 113.6° |
| C1 | C2 | H2 | 114.1° | 113.6° |
| C14 | C11 | C12 | 110.7° | 110.0° |
| C14 | C11 | N10 | 112.5° | 109.3° |
| C14 | C11 | H17 | 106.9° | 109.4° |
| C3 | C4 | C1 | 89.7° | 87.0° |
| C4 | C3 | H3 | 114.1° | 113.6° |
| C4 | C3 | H4 | 114.1° | 113.6° |
| C3 | C4 | H5 | 114.2° | 113.7° |
| C3 | C4 | H6 | 114.1° | 113.6° |
| C4 | C1 | C12 | 111.0° | 113.7° |
| C1 | C4 | H5 | 114.1° | 113.6° |
| C1 | C4 | H6 | 114.1° | 113.7° |
| C1 | C12 | C11 | 109.4° | 108.2° |
| C1 | C12 | H7 | 109.5° | 109.7° |
| C1 | C12 | H8 | 109.5° | 109.7° |
| C12 | C11 | N10 | 111.6° | 109.4° |
| C11 | C12 | H7 | 109.5° | 109.7° |
| C11 | C12 | H8 | 109.5° | 109.7° |
| C12 | C11 | H17 | 107.1° | 109.4° |
| C11 | N10 | C9 | 115.2° | 111.0° |
| N10 | C11 | H17 | 107.7° | 109.3° |
| C11 | N10 | H18 | 108.0° | 111.0° |
| N10 | C9 | C6 | 108.8° | 109.5° |
| C9 | N10 | H18 | 108.0° | 111.0° |
| N10 | C9 | H20 | 109.6° | 109.5° |
| N10 | C9 | H21 | 109.6° | 109.4° |
| O8 | C6 | C9 | 107.2° | 109.4° |
| O8 | C6 | C5 | 109.6° | 109.4° |
| O8 | C6 | H22 | 109.6° | 109.5° |
| C6 | O8 | H23 | 109.5° | 114.1° |
| C9 | C6 | C5 | 114.2° | 109.5° |
| C6 | C9 | H20 | 109.6° | 109.5° |
| C6 | C9 | H21 | 109.6° | 109.4° |
| C9 | C6 | H22 | 108.1° | 109.5° |
| O32 | C31 | N7 | 124.1° | 119.9° |
| O32 | C31 | C36 | 120.2° | 119.9° |
| C6 | C5 | C22 | 110.5° | 109.4° |
| C6 | C5 | N7 | 109.9° | 109.4° |
| C5 | C6 | H22 | 108.0° | 109.5° |
| C6 | C5 | H24 | 108.5° | 109.4° |
| C22 | C5 | N7 | 110.3° | 109.7° |
| C5 | C22 | C23 | 112.2° | 109.5° |
| C22 | C5 | H24 | 108.4° | 109.4° |
| C5 | C22 | H25 | 108.8° | 109.5° |
| C5 | C22 | H26 | 108.8° | 109.4° |
| C5 | N7 | C31 | 122.6° | 120.1° |
| N7 | C5 | H24 | 109.2° | 109.4° |
| C5 | N7 | H43 | 118.7° | 120.0° |
| N7 | C31 | C36 | 115.7° | 120.2° |
| C31 | N7 | H43 | 118.7° | 119.9° |
| C31 | C36 | C35 | 112.2° | 109.6° |
| C31 | C36 | H41 | 108.8° | 109.4° |
| C31 | C36 | H42 | 108.8° | 109.4° |
| C27 | C28 | C23 | 119.2° | 120.0° |
| C28 | C27 | C26 | 120.8° | 120.0° |
| C27 | C28 | H28 | 120.4° | 120.0° |
| C28 | C27 | H29 | 119.6° | 120.0° |
| C28 | C23 | C22 | 120.3° | 120.0° |
| C28 | C23 | C24 | 120.0° | 120.0° |
| C23 | C28 | H28 | 120.4° | 120.0° |
| C22 | C23 | C24 | 119.7° | 120.0° |
| C23 | C22 | H25 | 108.8° | 109.4° |
| C23 | C22 | H26 | 108.8° | 109.4° |
| C27 | C26 | C25 | 119.7° | 120.0° |
| C26 | C27 | H29 | 119.6° | 120.0° |
| C27 | C26 | H30 | 120.2° | 120.0° |
| C23 | C24 | C25 | 120.9° | 120.0° |
| C23 | C24 | H27 | 119.6° | 119.9° |
| C36 | C35 | C34 | 113.6° | 109.4° |
| C36 | C35 | H39 | 108.4° | 109.5° |
| C36 | C35 | H40 | 108.4° | 109.5° |
| C35 | C36 | H41 | 108.8° | 109.5° |
| C35 | C36 | H42 | 108.8° | 109.5° |
| C35 | C34 | C33 | 113.1° | 109.4° |
| C35 | C34 | H37 | 108.6° | 109.5° |
| C35 | C34 | H38 | 108.6° | 109.5° |
| C34 | C35 | H39 | 108.4° | 109.5° |
| C34 | C35 | H40 | 108.4° | 109.5° |
| C26 | C25 | C24 | 119.5° | 120.0° |
| C26 | C25 | C29 | 121.0° | 120.0° |
| C25 | C26 | H30 | 120.2° | 120.0° |
| C34 | C33 | C30 | 111.2° | 109.4° |
| C34 | C33 | H35 | 109.1° | 109.5° |
| C34 | C33 | H36 | 109.1° | 109.5° |
| C33 | C34 | H37 | 108.6° | 109.5° |
| C33 | C34 | H38 | 108.5° | 109.5° |
| C24 | C25 | C29 | 119.5° | 120.0° |
| C25 | C24 | H27 | 119.6° | 120.0° |
| C25 | C29 | C30 | 112.4° | 109.4° |
| C25 | C29 | H31 | 108.7° | 109.5° |
| C25 | C29 | H32 | 108.8° | 109.5° |
| C33 | C30 | C29 | 114.0° | 109.4° |
| C33 | C30 | H33 | 108.4° | 109.5° |
| C33 | C30 | H34 | 108.3° | 109.5° |
| C30 | C33 | H35 | 109.0° | 109.4° |
| C30 | C33 | H36 | 109.1° | 109.5° |
| C30 | C29 | H31 | 108.7° | 109.5° |
| C30 | C29 | H32 | 108.7° | 109.5° |
| C29 | C30 | H33 | 108.3° | 109.5° |
| C29 | C30 | H34 | 108.4° | 109.4° |
| H1 | C2 | H2 | 109.5° | 112.9° |
| H3 | C3 | H4 | 109.4° | 112.9° |
| H5 | C4 | H6 | 109.5° | 112.9° |
| H7 | C12 | H8 | 109.4° | 109.8° |
| H11 | C20 | H12 | 109.5° | 109.5° |
| H13 | C21 | H14 | 109.5° | 109.5° |
| H13 | C21 | H15 | 109.4° | 109.5° |
| H14 | C21 | H15 | 109.5° | 109.5° |
| H20 | C9 | H21 | 109.5° | 109.5° |
| H25 | C22 | H26 | 109.5° | 109.5° |
| H31 | C29 | H32 | 109.5° | 109.5° |
| H33 | C30 | H34 | 109.5° | 109.5° |
| H35 | C33 | H36 | 109.5° | 109.5° |
| H37 | C34 | H38 | 109.5° | 109.4° |
| H39 | C35 | H40 | 109.5° | 109.5° |
| H41 | C36 | H42 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C18 | C17 | 102.8° | 90.0° |
| C21 | C20 | C18 | H11 | 120.1° | 120.0° |
| C21 | C20 | C18 | H12 | 120.0° | 120.0° |
| C21 | C20 | C18 | C19 | 76.8° | 90.0° |
| C21 | C20 | H11 | H12 | 119.9° | 120.0° |
| C20 | C21 | H13 | H14 | 120.0° | 120.0° |
| C20 | C21 | H13 | H15 | 120.0° | 120.0° |
| C20 | C21 | H14 | H15 | 120.0° | 120.0° |
| C16 | C17 | C18 | H10 | 180.0° | 179.9° |
| C17 | C16 | C15 | H9 | 180.0° | 179.9° |
| C16 | C17 | C18 | C20 | 179.8° | 179.8° |
| C16 | C17 | C18 | C19 | 0.3° | 0.2° |
| C17 | C16 | C15 | O13 | 179.7° | 179.6° |
| C17 | C16 | C15 | C14 | 1.4° | 0.3° |
| C18 | C17 | C16 | C15 | 0.7° | 0.0° |
| C17 | C18 | C20 | C19 | 179.5° | 180.0° |
| C17 | C18 | C19 | C14 | 0.6° | 0.0° |
| C18 | C17 | C16 | H9 | 179.3° | 180.0° |
| C17 | C18 | C20 | H11 | 137.2° | 150.0° |
| C17 | C18 | C20 | H12 | 17.3° | 30.0° |
| C17 | C18 | C19 | H16 | 179.4° | 180.0° |
| C16 | C15 | O13 | C14 | 178.9° | 179.9° |
| C16 | C15 | O13 | C1 | 160.0° | 166.3° |
| C16 | C15 | C14 | C19 | 1.7° | 0.4° |
| C16 | C15 | C14 | C11 | 179.9° | 179.0° |
| C15 | C16 | C17 | H10 | 179.3° | 179.9° |
| C20 | C18 | C19 | C14 | 179.8° | 180.0° |
| C20 | C18 | C17 | H10 | 0.2° | 0.3° |
| C18 | C20 | H11 | H12 | 119.9° | 120.0° |
| C18 | C20 | C21 | H13 | 180.0° | 60.0° |
| C18 | C20 | C21 | H14 | 60.0° | 180.0° |
| C18 | C20 | C21 | H15 | 60.0° | 60.0° |
| C20 | C18 | C19 | H16 | 0.2° | 0.0° |
| C18 | C19 | C14 | C15 | 1.3° | 0.3° |
| C18 | C19 | C14 | H16 | 180.0° | 179.9° |
| C18 | C19 | C14 | C11 | 179.6° | 179.2° |
| C19 | C18 | C17 | H10 | 179.7° | 179.7° |
| C19 | C18 | C20 | H11 | 43.3° | 30.0° |
| C19 | C18 | C20 | H12 | 163.2° | 150.0° |
| O13 | C15 | C14 | C19 | 179.4° | 179.5° |
| C15 | O13 | C1 | C2 | 81.2° | 86.2° |
| O13 | C15 | C14 | C11 | 1.2° | 1.0° |
| C15 | O13 | C1 | C4 | 177.8° | 175.3° |
| C15 | O13 | C1 | C12 | 51.3° | 44.5° |
| O13 | C15 | C16 | H9 | 0.3° | 0.3° |
| C14 | C15 | O13 | C1 | 21.1° | 13.8° |
| C15 | C14 | C19 | C11 | 178.3° | 179.5° |
| C15 | C14 | C11 | C12 | 12.2° | 19.3° |
| C15 | C14 | C11 | N10 | 137.8° | 139.4° |
| C14 | C15 | C16 | H9 | 178.6° | 179.8° |
| C15 | C14 | C19 | H16 | 178.7° | 179.7° |
| C15 | C14 | C11 | H17 | 104.2° | 100.9° |
| O13 | C1 | C2 | C3 | 121.9° | 140.5° |
| O13 | C1 | C2 | C4 | 115.8° | 115.3° |
| O13 | C1 | C2 | C12 | 131.0° | 129.9° |
| O13 | C1 | C4 | C3 | 122.3° | 140.4° |
| O13 | C1 | C4 | C12 | 126.9° | 129.9° |
| O13 | C1 | C12 | C11 | 60.6° | 61.1° |
| O13 | C1 | C2 | H1 | 121.6° | 105.0° |
| O13 | C1 | C2 | H2 | 5.3° | 25.9° |
| O13 | C1 | C4 | H5 | 5.8° | 25.9° |
| O13 | C1 | C4 | H6 | 121.2° | 105.1° |
| O13 | C1 | C12 | H7 | 59.4° | 58.6° |
| O13 | C1 | C12 | H8 | 179.4° | 179.3° |
| C19 | C14 | C11 | C12 | 169.6° | 161.2° |
| C19 | C14 | C11 | N10 | 44.0° | 41.1° |
| C19 | C14 | C11 | H17 | 74.1° | 78.6° |
| C3 | C2 | C1 | H1 | 116.5° | 114.5° |
| C3 | C2 | C1 | H2 | 116.5° | 114.5° |
| C2 | C3 | C4 | H3 | 116.6° | 114.5° |
| C2 | C3 | C4 | H4 | 116.6° | 114.6° |
| C3 | C2 | C1 | C4 | 6.1° | 25.2° |
| C3 | C2 | C1 | C12 | 107.2° | 89.6° |
| C3 | C2 | H1 | H2 | 129.4° | 131.4° |
| C2 | C3 | H3 | H4 | 129.2° | 131.2° |
| C2 | C3 | C4 | H5 | 110.4° | 89.4° |
| C2 | C3 | C4 | H6 | 122.6° | 139.6° |
| C2 | C1 | C4 | C12 | 116.8° | 114.8° |
| C2 | C1 | C12 | C11 | 71.5° | 69.8° |
| C1 | C2 | H1 | H2 | 129.3° | 131.3° |
| C1 | C2 | C3 | H3 | 122.6° | 139.7° |
| C1 | C2 | C3 | H4 | 110.6° | 89.5° |
| C2 | C1 | C4 | H5 | 110.5° | 89.4° |
| C2 | C1 | C4 | H6 | 122.5° | 139.7° |
| C2 | C1 | C12 | H7 | 168.5° | 170.5° |
| C2 | C1 | C12 | H8 | 48.6° | 49.8° |
| C14 | C11 | C12 | C1 | 39.5° | 46.6° |
| C14 | C11 | C12 | N10 | 126.1° | 120.1° |
| C14 | C11 | C12 | H17 | 116.2° | 120.2° |
| C14 | C11 | N10 | H17 | 117.5° | 119.7° |
| C14 | C11 | N10 | C9 | 56.1° | 154.7° |
| C14 | C11 | C12 | H7 | 80.5° | 73.1° |
| C14 | C11 | C12 | H8 | 159.5° | 166.2° |
| C11 | C14 | C19 | H16 | 0.4° | 0.9° |
| C14 | C11 | N10 | H18 | 176.9° | 30.7° |
| C3 | C4 | C1 | H5 | 116.5° | 114.6° |
| C3 | C4 | C1 | H6 | 116.5° | 114.5° |
| C3 | C4 | C1 | C12 | 110.8° | 89.6° |
| C4 | C3 | C2 | H1 | 122.5° | 139.6° |
| C4 | C3 | C2 | H2 | 110.5° | 89.4° |
| C4 | C3 | H3 | H4 | 129.3° | 131.3° |
| C3 | C4 | H5 | H6 | 129.4° | 131.3° |
| C4 | C1 | C12 | C11 | 171.6° | 167.9° |
| C4 | C1 | C2 | H1 | 122.6° | 139.7° |
| C4 | C1 | C2 | H2 | 110.4° | 89.3° |
| C1 | C4 | C3 | H3 | 122.6° | 139.6° |
| C1 | C4 | C3 | H4 | 110.5° | 89.5° |
| C1 | C4 | H5 | H6 | 129.4° | 131.3° |
| C4 | C1 | C12 | H7 | 68.4° | 72.4° |
| C4 | C1 | C12 | H8 | 51.6° | 48.3° |
| C1 | C12 | C11 | H7 | 120.0° | 119.7° |
| C1 | C12 | C11 | H8 | 120.0° | 119.6° |
| C1 | C12 | C11 | N10 | 165.7° | 166.7° |
| C12 | C1 | C2 | H1 | 9.3° | 24.9° |
| C12 | C1 | C2 | H2 | 136.3° | 155.8° |
| C12 | C1 | C4 | H5 | 132.7° | 155.8° |
| C12 | C1 | C4 | H6 | 5.7° | 24.9° |
| C1 | C12 | H7 | H8 | 120.0° | 120.6° |
| C1 | C12 | C11 | H17 | 76.7° | 73.6° |
| C12 | C11 | N10 | H17 | 117.3° | 119.8° |
| C12 | C11 | N10 | C9 | 69.1° | 84.8° |
| C11 | C12 | H7 | H8 | 120.0° | 120.6° |
| C12 | C11 | N10 | H18 | 51.7° | 151.3° |
| C11 | N10 | C9 | H18 | 120.8° | 123.9° |
| C11 | N10 | C9 | C6 | 158.2° | 175.0° |
| N10 | C11 | C12 | H7 | 45.6° | 47.0° |
| N10 | C11 | C12 | H8 | 74.3° | 73.7° |
| C11 | N10 | C9 | H20 | 38.3° | 54.9° |
| C11 | N10 | C9 | H21 | 81.9° | 65.1° |
| N10 | C9 | C6 | O8 | 57.7° | 65.1° |
| N10 | C9 | C6 | H20 | 119.9° | 120.1° |
| N10 | C9 | C6 | H21 | 119.9° | 119.9° |
| N10 | C9 | C6 | C5 | 179.2° | 175.0° |
| C9 | N10 | C11 | H17 | 173.6° | 35.0° |
| N10 | C9 | H20 | H21 | 120.3° | 120.0° |
| N10 | C9 | C6 | H22 | 60.5° | 54.9° |
| O8 | C6 | C9 | C5 | 121.6° | 119.9° |
| O8 | C6 | C9 | H22 | 118.1° | 120.0° |
| O8 | C6 | C5 | H22 | 119.4° | 120.0° |
| O8 | C6 | C5 | C22 | 59.8° | 60.0° |
| O8 | C6 | C5 | N7 | 178.3° | 179.8° |
| O8 | C6 | C9 | H20 | 62.2° | 55.0° |
| O8 | C6 | C9 | H21 | 177.6° | 175.0° |
| O8 | C6 | C5 | H24 | 58.9° | 59.9° |
| C9 | C6 | C5 | H22 | 120.3° | 120.0° |
| C9 | C6 | C5 | C22 | 180.0° | 179.9° |
| C9 | C6 | C5 | N7 | 58.0° | 59.9° |
| C6 | C9 | N10 | H18 | 80.9° | 61.1° |
| C6 | C9 | H20 | H21 | 120.3° | 120.0° |
| C9 | C6 | O8 | H23 | 180.0° | 59.9° |
| C9 | C6 | C5 | H24 | 61.3° | 60.0° |
| O32 | C31 | N7 | C5 | 1.4° | 2.2° |
| O32 | C31 | N7 | C36 | 178.7° | 180.0° |
| O32 | C31 | C36 | C35 | 53.2° | 80.6° |
| O32 | C31 | C36 | H41 | 67.2° | 159.4° |
| O32 | C31 | C36 | H42 | 173.6° | 39.5° |
| O32 | C31 | N7 | H43 | 178.6° | 177.8° |
| C6 | C5 | C22 | N7 | 121.7° | 120.0° |
| C6 | C5 | C22 | H24 | 118.7° | 119.9° |
| C6 | C5 | N7 | H24 | 118.8° | 119.9° |
| C6 | C5 | N7 | C31 | 111.8° | 143.6° |
| C6 | C5 | C22 | C23 | 173.7° | 66.6° |
| C5 | C6 | C9 | H20 | 59.3° | 64.9° |
| C5 | C6 | C9 | H21 | 60.9° | 55.1° |
| C5 | C6 | O8 | H23 | 55.6° | 60.0° |
| C6 | C5 | C22 | H25 | 53.4° | 53.5° |
| C6 | C5 | C22 | H26 | 65.8° | 173.5° |
| C6 | C5 | N7 | H43 | 68.1° | 36.3° |
| C22 | C5 | N7 | H24 | 119.1° | 120.1° |
| C22 | C5 | N7 | C31 | 126.1° | 96.3° |
| C5 | C22 | C23 | C28 | 90.0° | 95.8° |
| C5 | C22 | C23 | H25 | 120.4° | 120.1° |
| C5 | C22 | C23 | H26 | 120.4° | 120.0° |
| C5 | C22 | C23 | C24 | 89.9° | 84.3° |
| C22 | C5 | C6 | H22 | 59.7° | 60.0° |
| C5 | C22 | H25 | H26 | 118.8° | 120.0° |
| C22 | C5 | N7 | H43 | 53.9° | 83.7° |
| C5 | N7 | C31 | H43 | 180.0° | 180.0° |
| C5 | N7 | C31 | C36 | 180.0° | 177.8° |
| N7 | C5 | C22 | C23 | 52.0° | 53.5° |
| N7 | C5 | C6 | H22 | 62.3° | 60.2° |
| N7 | C5 | C22 | H25 | 68.4° | 173.5° |
| N7 | C5 | C22 | H26 | 172.5° | 66.5° |
| N7 | C31 | C36 | C35 | 128.1° | 99.4° |
| C31 | N7 | C5 | H24 | 7.0° | 23.8° |
| N7 | C31 | C36 | H41 | 111.5° | 20.6° |
| N7 | C31 | C36 | H42 | 7.7° | 140.5° |
| C31 | C36 | C35 | H41 | 120.4° | 120.0° |
| C31 | C36 | C35 | H42 | 120.4° | 120.0° |
| C31 | C36 | C35 | C34 | 66.1° | 123.2° |
| C31 | C36 | C35 | H39 | 54.5° | 116.8° |
| C31 | C36 | C35 | H40 | 173.3° | 3.3° |
| C31 | C36 | H41 | H42 | 118.8° | 119.9° |
| C36 | C31 | N7 | H43 | 0.0° | 2.2° |
| C27 | C28 | C23 | H28 | 180.0° | 179.9° |
| C27 | C28 | C23 | C22 | 179.6° | 179.9° |
| C28 | C27 | C26 | H29 | 180.0° | 180.0° |
| C27 | C28 | C23 | C24 | 0.3° | 0.0° |
| C28 | C27 | C26 | C25 | 0.4° | 0.1° |
| C28 | C27 | C26 | H30 | 179.6° | 179.9° |
| C28 | C23 | C22 | C24 | 180.0° | 179.9° |
| C23 | C28 | C27 | C26 | 0.0° | 0.0° |
| C28 | C23 | C24 | C25 | 0.2° | 0.0° |
| C28 | C23 | C22 | H25 | 149.6° | 24.3° |
| C28 | C23 | C22 | H26 | 30.4° | 144.3° |
| C28 | C23 | C24 | H27 | 179.8° | 180.0° |
| C23 | C28 | C27 | H29 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 179.8° | 179.9° |
| C23 | C22 | C5 | H24 | 67.5° | 173.6° |
| C23 | C22 | H25 | H26 | 118.8° | 119.9° |
| C22 | C23 | C24 | H27 | 0.2° | 0.1° |
| C22 | C23 | C28 | H28 | 0.4° | 0.2° |
| C27 | C26 | C25 | H30 | 180.0° | 180.0° |
| C27 | C26 | C25 | C24 | 0.5° | 0.1° |
| C27 | C26 | C25 | C29 | 179.7° | 179.9° |
| C26 | C27 | C28 | H28 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.2° | 0.1° |
| C23 | C24 | C25 | H27 | 180.0° | 180.0° |
| C23 | C24 | C25 | C29 | 179.4° | 179.9° |
| C24 | C23 | C22 | H25 | 30.5° | 155.6° |
| C24 | C23 | C22 | H26 | 149.7° | 35.7° |
| C24 | C23 | C28 | H28 | 179.7° | 179.9° |
| C36 | C35 | C34 | H39 | 120.6° | 120.0° |
| C36 | C35 | C34 | H40 | 120.6° | 120.0° |
| C36 | C35 | C34 | C33 | 69.8° | 126.2° |
| C36 | C35 | C34 | H37 | 50.8° | 6.1° |
| C36 | C35 | C34 | H38 | 169.7° | 113.9° |
| C36 | C35 | H39 | H40 | 118.1° | 120.0° |
| C35 | C36 | H41 | H42 | 118.8° | 120.0° |
| C35 | C34 | C33 | H37 | 120.6° | 120.0° |
| C35 | C34 | C33 | H38 | 120.5° | 120.0° |
| C35 | C34 | C33 | C30 | 172.8° | 119.4° |
| C35 | C34 | C33 | H35 | 52.6° | 120.7° |
| C35 | C34 | C33 | H36 | 66.9° | 0.6° |
| C35 | C34 | H37 | H38 | 118.4° | 120.0° |
| C34 | C35 | H39 | H40 | 118.1° | 120.1° |
| C34 | C35 | C36 | H41 | 173.5° | 3.3° |
| C34 | C35 | C36 | H42 | 54.3° | 116.8° |
| C26 | C25 | C24 | C29 | 179.2° | 180.0° |
| C26 | C25 | C29 | C30 | 77.7° | 119.6° |
| C26 | C25 | C24 | H27 | 179.7° | 180.0° |
| C25 | C26 | C27 | H29 | 179.6° | 180.0° |
| C26 | C25 | C29 | H31 | 161.9° | 0.4° |
| C26 | C25 | C29 | H32 | 42.8° | 120.4° |
| C34 | C33 | C30 | H35 | 120.3° | 119.9° |
| C34 | C33 | C30 | H36 | 120.3° | 120.0° |
| C34 | C33 | C30 | C29 | 95.6° | 153.2° |
| C34 | C33 | C30 | H33 | 25.1° | 33.2° |
| C34 | C33 | C30 | H34 | 143.7° | 86.9° |
| C34 | C33 | H35 | H36 | 119.2° | 120.0° |
| C33 | C34 | H37 | H38 | 118.3° | 120.0° |
| C33 | C34 | C35 | H39 | 169.6° | 113.9° |
| C33 | C34 | C35 | H40 | 50.9° | 6.2° |
| C24 | C25 | C29 | C30 | 101.6° | 60.3° |
| C24 | C25 | C26 | H30 | 179.5° | 179.9° |
| C24 | C25 | C29 | H31 | 18.9° | 179.7° |
| C24 | C25 | C29 | H32 | 138.0° | 59.6° |
| C25 | C29 | C30 | C33 | 61.0° | 105.1° |
| C25 | C29 | C30 | H31 | 120.5° | 120.0° |
| C25 | C29 | C30 | H32 | 120.5° | 120.0° |
| C29 | C25 | C24 | H27 | 0.5° | 0.1° |
| C29 | C25 | C26 | H30 | 0.3° | 0.1° |
| C25 | C29 | H31 | H32 | 118.7° | 120.0° |
| C25 | C29 | C30 | H33 | 59.6° | 14.8° |
| C25 | C29 | C30 | H34 | 178.3° | 134.9° |
| C33 | C30 | C29 | H33 | 120.7° | 119.9° |
| C33 | C30 | C29 | H34 | 120.6° | 120.0° |
| C33 | C30 | C29 | H31 | 59.4° | 134.9° |
| C33 | C30 | C29 | H32 | 178.5° | 14.8° |
| C33 | C30 | H33 | H34 | 117.9° | 120.1° |
| C30 | C33 | H35 | H36 | 119.2° | 120.0° |
| C30 | C33 | C34 | H37 | 66.6° | 0.6° |
| C30 | C33 | C34 | H38 | 52.3° | 120.6° |
| C30 | C29 | H31 | H32 | 118.6° | 120.0° |
| C29 | C30 | H33 | H34 | 118.0° | 120.0° |
| C29 | C30 | C33 | H35 | 144.1° | 86.9° |
| C29 | C30 | C33 | H36 | 24.7° | 33.2° |
| H1 | C2 | C3 | H3 | 120.9° | 105.9° |
| H1 | C2 | C3 | H4 | 5.9° | 25.0° |
| H2 | C2 | C3 | H3 | 6.1° | 25.2° |
| H2 | C2 | C3 | H4 | 132.9° | 156.0° |
| H3 | C3 | C4 | H5 | 6.1° | 25.1° |
| H3 | C3 | C4 | H6 | 120.9° | 105.8° |
| H4 | C3 | C4 | H5 | 133.0° | 156.0° |
| H4 | C3 | C4 | H6 | 6.0° | 25.1° |
| H7 | C12 | C11 | H17 | 163.3° | 166.7° |
| H8 | C12 | C11 | H17 | 43.3° | 46.0° |
| H9 | C16 | C17 | H10 | 0.7° | 0.1° |
| H11 | C20 | C21 | H13 | 60.0° | 60.0° |
| H11 | C20 | C21 | H14 | 60.0° | 60.1° |
| H11 | C20 | C21 | H15 | 179.9° | 180.0° |
| H12 | C20 | C21 | H13 | 60.0° | 180.0° |
| H12 | C20 | C21 | H14 | 180.0° | 60.0° |
| H12 | C20 | C21 | H15 | 60.0° | 60.0° |
| H13 | C21 | H14 | H15 | 120.0° | 120.0° |
| H17 | C11 | N10 | H18 | 65.6° | 89.0° |
| H18 | N10 | C9 | H20 | 159.2° | 178.9° |
| H18 | N10 | C9 | H21 | 39.0° | 58.9° |
| H20 | C9 | C6 | H22 | 179.6° | 175.0° |
| H21 | C9 | C6 | H22 | 59.4° | 65.0° |
| H22 | C6 | O8 | H23 | 62.8° | 180.0° |
| H22 | C6 | C5 | H24 | 178.4° | 179.9° |
| H24 | C5 | C22 | H25 | 172.1° | 66.4° |
| H24 | C5 | C22 | H26 | 52.9° | 53.6° |
| H24 | C5 | N7 | H43 | 173.0° | 156.2° |
| H28 | C28 | C27 | H29 | 0.0° | 0.1° |
| H29 | C27 | C26 | H30 | 0.4° | 0.1° |
| H31 | C29 | C30 | H33 | 179.9° | 105.2° |
| H31 | C29 | C30 | H34 | 61.2° | 14.9° |
| H32 | C29 | C30 | H33 | 60.8° | 134.8° |
| H32 | C29 | C30 | H34 | 57.8° | 105.1° |
| H33 | C30 | C33 | H35 | 95.2° | 153.2° |
| H33 | C30 | C33 | H36 | 145.4° | 86.7° |
| H34 | C30 | C33 | H35 | 23.5° | 33.1° |
| H34 | C30 | C33 | H36 | 96.0° | 153.2° |
| H35 | C33 | C34 | H37 | 173.1° | 119.3° |
| H35 | C33 | C34 | H38 | 68.0° | 0.7° |
| H36 | C33 | C34 | H37 | 53.7° | 120.6° |
| H36 | C33 | C34 | H38 | 172.6° | 119.4° |
| H37 | C34 | C35 | H39 | 69.8° | 126.1° |
| H37 | C34 | C35 | H40 | 171.4° | 113.8° |
| H38 | C34 | C35 | H39 | 49.1° | 6.1° |
| H38 | C34 | C35 | H40 | 69.7° | 126.2° |
| H39 | C35 | C36 | H41 | 65.9° | 123.2° |
| H39 | C35 | C36 | H42 | 174.9° | 3.2° |
| H40 | C35 | C36 | H41 | 52.9° | 116.7° |
| H40 | C35 | C36 | H42 | 66.3° | 123.3° |
