6N3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C12 | sing | 1.53Å | 1.52Å | |
| C20 | C18 | sing | 1.53Å | 1.52Å | |
| O2 | C18 | sing | 1.43Å | 1.43Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C11 | N1 | sing | 1.46Å | 1.45Å | |
| C11 | C16 | sing | 1.53Å | 1.52Å | |
| C19 | C14 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.52Å | |
| O1 | C10 | doub | 1.22Å | 1.22Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| N1 | C10 | sing | 1.35Å | 1.33Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.47Å | 1.50Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| O | C4 | sing | 1.43Å | 1.43Å | |
| O | C5 | sing | 1.35Å | 1.37Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C9 | C5 | doub | 1.40Å | 1.48Å | Aromatic |
| C9 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | N | sing | 1.32Å | 1.35Å | Aromatic |
| C8 | C7 | doub | 1.37Å | 1.39Å | Aromatic |
| N | C6 | doub | 1.33Å | 1.35Å | Aromatic |
| C7 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | N2 | sing | 1.38Å | 1.40Å | |
| C24 | N2 | sing | 1.48Å | 1.45Å | |
| C24 | C23 | sing | 1.54Å | 1.53Å | |
| N2 | C21 | sing | 1.49Å | 1.45Å | |
| C23 | C22 | sing | 1.54Å | 1.53Å | |
| C23 | C25 | sing | 1.53Å | 1.52Å | |
| O4 | C26 | doub | 1.21Å | 1.25Å | |
| C22 | C21 | sing | 1.54Å | 1.52Å | |
| C22 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | C26 | sing | 1.51Å | 1.50Å | |
| C26 | O3 | sing | 1.34Å | 1.25Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| O3 | H11 | sing | 0.97Å | 0.95Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C8 | H19 | sing | 1.08Å | 1.08Å | |
| C | H20 | sing | 1.09Å | 1.10Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C | H22 | sing | 1.09Å | 1.10Å | |
| N1 | H23 | sing | 0.97Å | 1.00Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C15 | H26 | sing | 1.09Å | 1.10Å | |
| C15 | H27 | sing | 1.09Å | 1.10Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| C17 | H29 | sing | 1.09Å | 1.10Å | |
| O2 | H30 | sing | 0.97Å | 0.95Å | |
| C20 | H31 | sing | 1.09Å | 1.10Å | |
| C20 | H32 | sing | 1.09Å | 1.10Å | |
| C19 | H33 | sing | 1.09Å | 1.10Å | |
| C19 | H34 | sing | 1.09Å | 1.10Å | |
| C14 | H35 | sing | 1.09Å | 1.10Å | |
| C13 | H36 | sing | 1.09Å | 1.10Å | |
| C13 | H37 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C20 | C18 | 109.6° | 109.5° |
| C20 | C12 | C13 | 108.5° | 109.4° |
| C20 | C12 | C11 | 110.3° | 109.5° |
| C20 | C12 | H7 | 109.4° | 109.5° |
| C12 | C20 | H31 | 109.4° | 109.4° |
| C12 | C20 | H32 | 109.4° | 109.4° |
| C20 | C18 | O2 | 109.6° | 109.5° |
| C20 | C18 | C19 | 109.5° | 109.5° |
| C20 | C18 | C17 | 109.0° | 109.5° |
| C18 | C20 | H31 | 109.4° | 109.5° |
| C18 | C20 | H32 | 109.4° | 109.5° |
| O2 | C18 | C19 | 109.5° | 109.5° |
| O2 | C18 | C17 | 109.5° | 109.5° |
| C18 | O2 | H30 | 109.5° | 114.0° |
| C13 | C12 | C11 | 109.8° | 109.4° |
| C12 | C13 | C14 | 110.3° | 109.5° |
| C13 | C12 | H7 | 109.4° | 109.5° |
| C12 | C13 | H36 | 109.3° | 109.5° |
| C12 | C13 | H37 | 109.3° | 109.5° |
| C12 | C11 | N1 | 109.8° | 109.5° |
| C12 | C11 | C16 | 108.6° | 109.5° |
| C11 | C12 | H7 | 109.4° | 109.5° |
| C12 | C11 | H24 | 109.2° | 109.4° |
| C19 | C18 | C17 | 109.8° | 109.5° |
| C18 | C19 | C14 | 109.6° | 109.5° |
| C18 | C19 | H33 | 109.4° | 109.5° |
| C18 | C19 | H34 | 109.4° | 109.4° |
| C18 | C17 | C16 | 109.5° | 109.5° |
| C18 | C17 | H28 | 109.4° | 109.5° |
| C18 | C17 | H29 | 109.5° | 109.5° |
| C13 | C14 | C19 | 108.9° | 109.4° |
| C13 | C14 | C15 | 109.1° | 109.5° |
| C13 | C14 | H35 | 110.0° | 109.5° |
| C14 | C13 | H36 | 109.3° | 109.4° |
| C14 | C13 | H37 | 109.3° | 109.5° |
| N1 | C11 | C16 | 110.0° | 109.5° |
| C11 | N1 | C10 | 123.1° | 120.0° |
| C11 | N1 | H23 | 118.5° | 120.0° |
| N1 | C11 | H24 | 110.1° | 109.5° |
| C11 | C16 | C17 | 110.3° | 109.5° |
| C11 | C16 | C15 | 110.0° | 109.4° |
| C16 | C11 | H24 | 109.2° | 109.5° |
| C11 | C16 | H25 | 109.3° | 109.5° |
| C19 | C14 | C15 | 108.9° | 109.5° |
| C14 | C19 | H33 | 109.4° | 109.5° |
| C14 | C19 | H34 | 109.4° | 109.5° |
| C19 | C14 | H35 | 110.0° | 109.5° |
| C17 | C16 | C15 | 108.6° | 109.5° |
| C17 | C16 | H25 | 109.3° | 109.5° |
| C16 | C17 | H28 | 109.5° | 109.5° |
| C16 | C17 | H29 | 109.5° | 109.5° |
| O1 | C10 | N1 | 122.2° | 120.0° |
| O1 | C10 | C9 | 119.6° | 120.0° |
| C2 | C1 | C3 | 111.0° | 109.5° |
| C2 | C1 | C | 110.6° | 109.5° |
| C2 | C1 | H1 | 107.9° | 109.5° |
| C1 | C2 | H8 | 109.5° | 109.5° |
| C1 | C2 | H9 | 109.5° | 109.5° |
| C1 | C2 | H10 | 109.5° | 109.5° |
| N1 | C10 | C9 | 118.2° | 120.0° |
| C10 | N1 | H23 | 118.5° | 120.0° |
| C14 | C15 | C16 | 110.2° | 109.5° |
| C14 | C15 | H26 | 109.3° | 109.5° |
| C14 | C15 | H27 | 109.3° | 109.5° |
| C15 | C14 | H35 | 110.0° | 109.5° |
| C10 | C9 | C5 | 120.2° | 120.5° |
| C10 | C9 | C8 | 121.4° | 120.6° |
| C15 | C16 | H25 | 109.3° | 109.5° |
| C16 | C15 | H26 | 109.3° | 109.4° |
| C16 | C15 | H27 | 109.3° | 109.5° |
| C4 | O | C5 | 119.6° | 117.0° |
| O | C4 | C3 | 110.0° | 109.4° |
| O | C4 | H3 | 109.4° | 109.5° |
| O | C4 | H4 | 109.3° | 109.5° |
| O | C5 | C9 | 121.2° | 119.8° |
| O | C5 | N | 119.7° | 119.9° |
| C4 | C3 | C1 | 111.3° | 109.5° |
| C3 | C4 | H3 | 109.3° | 109.5° |
| C3 | C4 | H4 | 109.4° | 109.4° |
| C4 | C3 | H5 | 109.0° | 109.5° |
| C4 | C3 | H6 | 109.0° | 109.5° |
| C3 | C1 | C | 111.4° | 109.4° |
| C3 | C1 | H1 | 107.9° | 109.4° |
| C1 | C3 | H5 | 109.0° | 109.5° |
| C1 | C3 | H6 | 109.0° | 109.4° |
| C | C1 | H1 | 108.0° | 109.5° |
| C1 | C | H20 | 109.5° | 109.5° |
| C1 | C | H21 | 109.4° | 109.4° |
| C1 | C | H22 | 109.4° | 109.5° |
| C5 | C9 | C8 | 118.5° | 118.9° |
| C9 | C5 | N | 119.2° | 120.3° |
| C9 | C8 | C7 | 119.2° | 118.6° |
| C9 | C8 | H19 | 120.4° | 120.7° |
| C5 | N | C6 | 121.4° | 121.6° |
| C8 | C7 | C6 | 120.4° | 119.5° |
| C8 | C7 | H2 | 119.8° | 120.3° |
| C7 | C8 | H19 | 120.4° | 120.7° |
| N | C6 | C7 | 121.4° | 121.0° |
| N | C6 | N2 | 117.3° | 119.5° |
| C7 | C6 | N2 | 121.4° | 119.5° |
| C6 | C7 | H2 | 119.8° | 120.2° |
| C6 | N2 | C24 | 122.8° | 111.0° |
| C6 | N2 | C21 | 120.3° | 111.0° |
| N2 | C24 | C23 | 101.0° | 104.6° |
| C24 | N2 | C21 | 116.9° | 104.2° |
| N2 | C24 | H17 | 111.5° | 110.4° |
| N2 | C24 | H18 | 111.5° | 110.4° |
| C24 | C23 | C22 | 108.0° | 105.1° |
| C24 | C23 | C25 | 113.0° | 118.2° |
| C24 | C23 | H16 | 120.3° | 118.2° |
| C23 | C24 | H17 | 111.5° | 110.4° |
| C23 | C24 | H18 | 111.6° | 110.4° |
| N2 | C21 | C22 | 101.0° | 104.6° |
| N2 | C21 | H14 | 111.5° | 110.4° |
| N2 | C21 | H15 | 111.6° | 110.5° |
| C22 | C23 | C25 | 59.8° | 59.7° |
| C23 | C22 | C21 | 108.1° | 105.0° |
| C23 | C22 | C25 | 60.0° | 59.8° |
| C23 | C22 | H13 | 120.7° | 123.0° |
| C22 | C23 | H16 | 120.3° | 121.8° |
| C23 | C25 | C22 | 60.2° | 60.5° |
| C23 | C25 | C26 | 109.4° | 117.5° |
| C23 | C25 | H12 | 121.2° | 117.4° |
| C25 | C23 | H16 | 120.4° | 119.5° |
| O4 | C26 | C25 | 118.5° | 120.0° |
| O4 | C26 | O3 | 123.3° | 120.0° |
| C21 | C22 | C25 | 111.2° | 118.1° |
| C21 | C22 | H13 | 120.8° | 117.6° |
| C22 | C21 | H14 | 111.5° | 110.4° |
| C22 | C21 | H15 | 111.6° | 110.4° |
| C22 | C25 | C26 | 107.2° | 117.4° |
| C22 | C25 | H12 | 121.3° | 117.5° |
| C25 | C22 | H13 | 120.9° | 119.6° |
| C25 | C26 | O3 | 118.3° | 120.0° |
| C26 | C25 | H12 | 121.8° | 115.5° |
| C26 | O3 | H11 | 109.5° | 117.0° |
| H3 | C4 | H4 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H8 | C2 | H9 | 109.5° | 109.5° |
| H8 | C2 | H10 | 109.4° | 109.5° |
| H9 | C2 | H10 | 109.5° | 109.5° |
| H14 | C21 | H15 | 109.5° | 110.4° |
| H17 | C24 | H18 | 109.5° | 110.5° |
| H20 | C | H21 | 109.5° | 109.4° |
| H20 | C | H22 | 109.5° | 109.5° |
| H21 | C | H22 | 109.5° | 109.5° |
| H26 | C15 | H27 | 109.5° | 109.5° |
| H28 | C17 | H29 | 109.5° | 109.4° |
| H31 | C20 | H32 | 109.5° | 109.5° |
| H33 | C19 | H34 | 109.5° | 109.4° |
| H36 | C13 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C20 | C18 | H31 | 120.0° | 120.0° |
| C12 | C20 | C18 | H32 | 120.0° | 119.9° |
| C12 | C20 | C18 | O2 | 179.5° | 180.0° |
| C20 | C12 | C13 | C11 | 120.7° | 120.0° |
| C20 | C12 | C13 | H7 | 119.3° | 120.0° |
| C20 | C12 | C11 | H7 | 120.4° | 120.1° |
| C12 | C20 | C18 | C19 | 60.5° | 60.0° |
| C12 | C20 | C18 | C17 | 59.7° | 60.0° |
| C20 | C12 | C13 | C14 | 60.6° | 60.0° |
| C20 | C12 | C11 | N1 | 179.6° | 180.0° |
| C20 | C12 | C11 | C16 | 59.3° | 59.9° |
| C20 | C12 | C11 | H24 | 59.7° | 60.0° |
| C12 | C20 | H31 | H32 | 120.0° | 119.9° |
| C20 | C12 | C13 | H36 | 179.3° | 180.0° |
| C20 | C12 | C13 | H37 | 59.5° | 60.0° |
| C20 | C18 | O2 | C19 | 120.1° | 120.0° |
| C20 | C18 | O2 | C17 | 119.4° | 120.0° |
| C18 | C20 | C12 | C13 | 60.3° | 60.0° |
| C18 | C20 | C12 | C11 | 60.1° | 59.9° |
| C20 | C18 | C19 | C17 | 119.6° | 120.0° |
| C20 | C18 | C19 | C14 | 60.0° | 60.0° |
| C20 | C18 | C17 | C16 | 59.8° | 60.0° |
| C18 | C20 | C12 | H7 | 179.5° | 180.0° |
| C20 | C18 | C17 | H28 | 179.8° | 60.0° |
| C20 | C18 | C17 | H29 | 60.2° | 180.0° |
| C20 | C18 | O2 | H30 | 180.0° | 60.0° |
| C18 | C20 | H31 | H32 | 119.9° | 120.1° |
| C20 | C18 | C19 | H33 | 60.1° | 60.0° |
| C20 | C18 | C19 | H34 | 180.0° | 179.9° |
| O2 | C18 | C19 | C17 | 120.2° | 120.0° |
| O2 | C18 | C19 | C14 | 179.9° | 180.0° |
| O2 | C18 | C17 | C16 | 179.6° | 180.0° |
| O2 | C18 | C17 | H28 | 60.4° | 60.0° |
| O2 | C18 | C17 | H29 | 59.6° | 60.0° |
| O2 | C18 | C20 | H31 | 60.5° | 60.0° |
| O2 | C18 | C20 | H32 | 59.4° | 60.1° |
| O2 | C18 | C19 | H33 | 60.1° | 60.0° |
| O2 | C18 | C19 | H34 | 59.9° | 59.9° |
| C13 | C12 | C11 | H7 | 120.0° | 120.0° |
| C12 | C13 | C14 | H36 | 120.2° | 120.0° |
| C12 | C13 | C14 | H37 | 120.1° | 120.0° |
| C13 | C12 | C11 | N1 | 60.0° | 60.0° |
| C13 | C12 | C11 | C16 | 60.3° | 60.0° |
| C12 | C13 | C14 | C19 | 60.3° | 60.0° |
| C12 | C13 | C14 | C15 | 58.4° | 60.0° |
| C13 | C12 | C11 | H24 | 179.2° | 180.0° |
| C13 | C12 | C20 | H31 | 59.8° | 60.0° |
| C13 | C12 | C20 | H32 | 179.7° | 179.9° |
| C12 | C13 | C14 | H35 | 179.1° | 180.0° |
| C12 | C13 | H36 | H37 | 119.6° | 120.0° |
| C11 | C12 | C13 | C14 | 60.1° | 60.0° |
| C12 | C11 | N1 | C16 | 119.5° | 120.0° |
| C12 | C11 | N1 | H24 | 120.2° | 120.0° |
| C12 | C11 | C16 | H24 | 118.9° | 120.0° |
| C12 | C11 | C16 | C17 | 59.5° | 60.0° |
| C12 | C11 | N1 | C10 | 126.3° | 154.9° |
| C12 | C11 | C16 | C15 | 60.3° | 60.0° |
| C12 | C11 | N1 | H23 | 53.7° | 25.0° |
| C12 | C11 | C16 | H25 | 179.7° | 180.0° |
| C11 | C12 | C20 | H31 | 179.9° | 180.0° |
| C11 | C12 | C20 | H32 | 59.9° | 60.0° |
| C11 | C12 | C13 | H36 | 60.0° | 60.0° |
| C11 | C12 | C13 | H37 | 179.8° | 180.0° |
| C18 | C19 | C14 | C13 | 59.5° | 60.0° |
| C18 | C19 | C14 | H33 | 120.0° | 120.0° |
| C18 | C19 | C14 | H34 | 120.0° | 120.0° |
| C19 | C18 | C17 | C16 | 60.1° | 60.0° |
| C18 | C19 | C14 | C15 | 59.4° | 60.0° |
| C19 | C18 | C17 | H28 | 59.8° | 180.0° |
| C19 | C18 | C17 | H29 | 179.8° | 60.0° |
| C19 | C18 | O2 | H30 | 59.9° | 60.0° |
| C19 | C18 | C20 | H31 | 59.6° | 60.0° |
| C19 | C18 | C20 | H32 | 179.5° | 179.9° |
| C18 | C19 | H33 | H34 | 119.9° | 119.9° |
| C18 | C19 | C14 | H35 | 180.0° | 180.0° |
| C18 | C17 | C16 | C11 | 60.4° | 60.0° |
| C17 | C18 | C19 | C14 | 59.7° | 60.0° |
| C18 | C17 | C16 | H28 | 120.0° | 120.0° |
| C18 | C17 | C16 | H29 | 120.0° | 120.0° |
| C18 | C17 | C16 | C15 | 60.2° | 60.0° |
| C18 | C17 | C16 | H25 | 179.3° | 180.0° |
| C18 | C17 | H28 | H29 | 120.0° | 120.0° |
| C17 | C18 | O2 | H30 | 60.5° | 180.0° |
| C17 | C18 | C20 | H31 | 179.7° | 180.0° |
| C17 | C18 | C20 | H32 | 60.3° | 59.9° |
| C17 | C18 | C19 | H33 | 179.7° | 179.9° |
| C17 | C18 | C19 | H34 | 60.3° | 60.0° |
| C13 | C14 | C19 | C15 | 118.8° | 120.0° |
| C13 | C14 | C19 | H35 | 120.6° | 120.0° |
| C13 | C14 | C15 | H35 | 120.7° | 120.0° |
| C13 | C14 | C15 | C16 | 58.1° | 60.0° |
| C14 | C13 | C12 | H7 | 179.8° | 180.0° |
| C13 | C14 | C15 | H26 | 62.0° | 180.0° |
| C13 | C14 | C15 | H27 | 178.2° | 60.0° |
| C13 | C14 | C19 | H33 | 60.6° | 60.0° |
| C13 | C14 | C19 | H34 | 179.4° | 180.0° |
| C14 | C13 | H36 | H37 | 119.6° | 120.0° |
| N1 | C11 | C16 | H24 | 120.9° | 120.0° |
| N1 | C11 | C16 | C17 | 179.7° | 180.0° |
| C11 | N1 | C10 | O1 | 5.2° | 0.0° |
| C11 | N1 | C10 | H23 | 180.0° | 179.9° |
| C11 | N1 | C10 | C9 | 174.7° | 180.0° |
| N1 | C11 | C16 | C15 | 60.0° | 60.0° |
| N1 | C11 | C12 | H7 | 60.0° | 60.0° |
| N1 | C11 | C16 | H25 | 60.1° | 60.0° |
| C11 | C16 | C17 | C15 | 120.6° | 120.0° |
| C11 | C16 | C17 | H25 | 120.2° | 120.0° |
| C16 | C11 | N1 | C10 | 114.2° | 85.0° |
| C11 | C16 | C15 | C14 | 59.9° | 60.0° |
| C11 | C16 | C15 | H25 | 120.1° | 120.0° |
| C16 | C11 | C12 | H7 | 179.7° | 180.0° |
| C16 | C11 | N1 | H23 | 65.8° | 95.0° |
| C11 | C16 | C15 | H26 | 60.2° | 180.0° |
| C11 | C16 | C15 | H27 | 180.0° | 60.0° |
| C11 | C16 | C17 | H28 | 179.6° | 60.0° |
| C11 | C16 | C17 | H29 | 59.6° | 180.0° |
| C19 | C14 | C15 | H35 | 120.6° | 120.0° |
| C19 | C14 | C15 | C16 | 60.5° | 60.0° |
| C19 | C14 | C15 | H26 | 179.3° | 60.0° |
| C19 | C14 | C15 | H27 | 59.6° | 180.0° |
| C14 | C19 | H33 | H34 | 120.0° | 120.0° |
| C19 | C14 | C13 | H36 | 179.6° | 180.0° |
| C19 | C14 | C13 | H37 | 59.8° | 60.0° |
| C17 | C16 | C15 | C14 | 60.9° | 60.0° |
| C17 | C16 | C15 | H25 | 119.2° | 120.0° |
| C17 | C16 | C11 | H24 | 59.5° | 60.0° |
| C17 | C16 | C15 | H26 | 179.0° | 60.0° |
| C17 | C16 | C15 | H27 | 59.2° | 180.0° |
| C16 | C17 | H28 | H29 | 120.0° | 120.0° |
| O1 | C10 | N1 | C9 | 179.9° | 179.9° |
| O1 | C10 | C9 | C5 | 161.1° | 0.1° |
| O1 | C10 | C9 | C8 | 19.3° | 179.7° |
| O1 | C10 | N1 | H23 | 174.8° | 180.0° |
| C2 | C1 | C3 | C4 | 60.5° | 65.0° |
| C2 | C1 | C3 | C | 123.6° | 120.0° |
| C2 | C1 | C3 | H1 | 118.1° | 120.1° |
| C2 | C1 | C | H1 | 117.9° | 120.1° |
| C2 | C1 | C3 | H5 | 59.8° | 175.0° |
| C2 | C1 | C3 | H6 | 179.2° | 55.0° |
| C1 | C2 | H8 | H9 | 120.0° | 120.0° |
| C1 | C2 | H8 | H10 | 120.0° | 120.0° |
| C1 | C2 | H9 | H10 | 120.0° | 120.0° |
| C2 | C1 | C | H20 | 180.0° | 180.0° |
| C2 | C1 | C | H21 | 60.0° | 60.0° |
| C2 | C1 | C | H22 | 60.0° | 60.0° |
| N1 | C10 | C9 | C5 | 18.8° | 180.0° |
| N1 | C10 | C9 | C8 | 160.7° | 0.2° |
| C10 | N1 | C11 | H24 | 6.1° | 35.0° |
| C14 | C15 | C16 | H26 | 120.1° | 120.0° |
| C14 | C15 | C16 | H27 | 120.1° | 120.0° |
| C14 | C15 | C16 | H25 | 180.0° | 180.0° |
| C14 | C15 | H26 | H27 | 119.7° | 120.0° |
| C15 | C14 | C19 | H33 | 179.4° | 180.0° |
| C15 | C14 | C19 | H34 | 60.6° | 60.0° |
| C15 | C14 | C13 | H36 | 61.8° | 60.0° |
| C15 | C14 | C13 | H37 | 178.5° | 180.0° |
| C10 | C9 | C5 | O | 0.1° | 0.2° |
| C10 | C9 | C5 | C8 | 179.6° | 179.8° |
| C10 | C9 | C5 | N | 179.8° | 180.0° |
| C10 | C9 | C8 | C7 | 179.8° | 180.0° |
| C10 | C9 | C8 | H19 | 0.2° | 0.3° |
| C9 | C10 | N1 | H23 | 5.3° | 0.1° |
| C15 | C16 | C11 | H24 | 179.2° | 180.0° |
| C16 | C15 | H26 | H27 | 119.7° | 120.0° |
| C15 | C16 | C17 | H28 | 59.8° | 180.0° |
| C15 | C16 | C17 | H29 | 179.8° | 60.0° |
| C16 | C15 | C14 | H35 | 178.9° | 180.0° |
| O | C4 | C3 | H3 | 120.1° | 120.0° |
| O | C4 | C3 | H4 | 120.1° | 120.0° |
| O | C4 | C3 | C1 | 179.2° | 180.0° |
| C4 | O | C5 | C9 | 177.7° | 180.0° |
| C4 | O | C5 | N | 2.2° | 0.3° |
| O | C4 | H3 | H4 | 119.8° | 120.0° |
| O | C4 | C3 | H5 | 58.9° | 60.0° |
| O | C4 | C3 | H6 | 60.6° | 60.1° |
| C5 | O | C4 | C3 | 163.6° | 180.0° |
| O | C5 | C9 | N | 179.9° | 179.8° |
| O | C5 | C9 | C8 | 179.7° | 180.0° |
| O | C5 | N | C6 | 179.9° | 179.7° |
| C5 | O | C4 | H3 | 43.5° | 60.0° |
| C5 | O | C4 | H4 | 76.4° | 60.1° |
| C4 | C3 | C1 | H5 | 120.3° | 120.0° |
| C4 | C3 | C1 | H6 | 120.3° | 120.0° |
| C4 | C3 | C1 | C | 63.1° | 175.0° |
| C4 | C3 | C1 | H1 | 178.5° | 55.0° |
| C3 | C4 | H3 | H4 | 119.8° | 120.0° |
| C4 | C3 | H5 | H6 | 119.2° | 120.1° |
| C3 | C1 | C | H1 | 118.3° | 119.9° |
| C1 | C3 | C4 | H3 | 60.7° | 60.0° |
| C1 | C3 | C4 | H4 | 59.1° | 60.0° |
| C1 | C3 | H5 | H6 | 119.2° | 120.0° |
| C3 | C1 | C2 | H8 | 180.0° | 180.0° |
| C3 | C1 | C2 | H9 | 60.0° | 60.0° |
| C3 | C1 | C2 | H10 | 60.0° | 60.0° |
| C3 | C1 | C | H20 | 56.2° | 60.0° |
| C3 | C1 | C | H21 | 63.9° | 180.0° |
| C3 | C1 | C | H22 | 176.2° | 60.0° |
| C | C1 | C3 | H5 | 176.6° | 55.0° |
| C | C1 | C3 | H6 | 57.1° | 65.0° |
| C | C1 | C2 | H8 | 55.9° | 60.0° |
| C | C1 | C2 | H9 | 64.1° | 180.0° |
| C | C1 | C2 | H10 | 175.9° | 60.0° |
| C1 | C | H20 | H21 | 120.0° | 120.0° |
| C1 | C | H20 | H22 | 120.0° | 120.0° |
| C1 | C | H21 | H22 | 119.9° | 120.0° |
| C5 | C9 | C8 | C7 | 0.2° | 0.3° |
| C9 | C5 | N | C6 | 0.1° | 0.1° |
| C5 | C9 | C8 | H19 | 179.8° | 179.9° |
| C8 | C9 | C5 | N | 0.2° | 0.2° |
| C9 | C8 | C7 | H19 | 180.0° | 179.7° |
| C9 | C8 | C7 | C6 | 0.1° | 0.0° |
| C9 | C8 | C7 | H2 | 179.9° | 180.0° |
| C5 | N | C6 | C7 | 0.1° | 0.3° |
| C5 | N | C6 | N2 | 179.7° | 180.0° |
| C8 | C7 | C6 | N | 0.1° | 0.3° |
| C8 | C7 | C6 | H2 | 180.0° | 180.0° |
| C8 | C7 | C6 | N2 | 179.7° | 180.0° |
| N | C6 | C7 | N2 | 179.6° | 179.7° |
| N | C6 | N2 | C24 | 120.0° | 0.3° |
| N | C6 | N2 | C21 | 58.3° | 115.1° |
| N | C6 | C7 | H2 | 179.9° | 179.7° |
| C7 | C6 | N2 | C24 | 60.4° | 180.0° |
| C7 | C6 | N2 | C21 | 121.3° | 64.5° |
| C6 | C7 | C8 | H19 | 179.9° | 179.7° |
| C6 | N2 | C24 | C21 | 178.4° | 119.6° |
| C6 | N2 | C24 | C23 | 156.0° | 159.0° |
| C6 | N2 | C21 | C22 | 154.7° | 159.0° |
| N2 | C6 | C7 | H2 | 0.3° | 0.0° |
| C6 | N2 | C21 | H14 | 36.1° | 40.2° |
| C6 | N2 | C21 | H15 | 86.7° | 82.2° |
| C6 | N2 | C24 | H17 | 85.4° | 82.1° |
| C6 | N2 | C24 | H18 | 37.3° | 40.3° |
| N2 | C24 | C23 | H17 | 118.6° | 118.9° |
| N2 | C24 | C23 | H18 | 118.6° | 118.7° |
| N2 | C24 | C23 | C22 | 10.8° | 23.8° |
| N2 | C24 | C23 | C25 | 74.8° | 87.3° |
| C24 | N2 | C21 | C22 | 23.7° | 39.4° |
| C24 | N2 | C21 | H14 | 142.3° | 79.4° |
| C24 | N2 | C21 | H15 | 94.9° | 158.2° |
| N2 | C24 | C23 | H16 | 132.9° | 115.9° |
| N2 | C24 | H17 | H18 | 123.9° | 122.4° |
| C23 | C24 | N2 | C21 | 22.4° | 39.4° |
| C24 | C23 | C22 | C25 | 106.7° | 114.1° |
| C24 | C23 | C22 | H16 | 143.6° | 137.9° |
| C24 | C23 | C25 | H16 | 152.3° | 156.5° |
| C24 | C23 | C22 | C21 | 2.2° | 0.0° |
| C24 | C23 | C25 | C26 | 162.7° | 160.7° |
| C24 | C23 | C25 | H12 | 12.6° | 16.0° |
| C24 | C23 | C22 | H13 | 143.0° | 138.3° |
| C23 | C24 | H17 | H18 | 123.9° | 122.4° |
| N2 | C21 | C22 | C23 | 14.1° | 23.8° |
| N2 | C21 | C22 | H14 | 118.6° | 118.8° |
| N2 | C21 | C22 | H15 | 118.6° | 118.9° |
| N2 | C21 | C22 | C25 | 78.2° | 87.2° |
| N2 | C21 | C22 | H13 | 131.0° | 117.2° |
| N2 | C21 | H14 | H15 | 123.9° | 122.5° |
| C21 | N2 | C24 | H17 | 96.2° | 158.3° |
| C21 | N2 | C24 | H18 | 141.0° | 79.3° |
| C22 | C23 | C25 | H16 | 109.6° | 111.7° |
| C23 | C22 | C21 | C25 | 64.1° | 63.4° |
| C23 | C22 | C21 | H13 | 145.2° | 141.0° |
| C23 | C22 | C25 | H13 | 110.0° | 113.3° |
| C22 | C23 | C25 | C26 | 99.2° | 107.6° |
| C22 | C23 | C25 | H12 | 110.7° | 107.7° |
| C23 | C22 | C21 | H14 | 132.8° | 95.0° |
| C23 | C22 | C21 | H15 | 104.5° | 142.7° |
| C22 | C23 | C24 | H17 | 107.8° | 142.7° |
| C22 | C23 | C24 | H18 | 129.4° | 94.9° |
| C23 | C25 | C26 | O4 | 3.5° | 69.0° |
| C23 | C25 | C26 | H12 | 149.9° | 145.4° |
| C23 | C25 | C26 | O3 | 176.2° | 111.0° |
| C25 | C23 | C24 | H17 | 43.8° | 153.9° |
| C25 | C23 | C24 | H18 | 166.5° | 31.5° |
| O4 | C26 | C25 | C22 | 67.3° | 0.2° |
| O4 | C26 | C25 | O3 | 179.7° | 180.0° |
| O4 | C26 | O3 | H11 | 0.0° | 0.0° |
| O4 | C26 | C25 | H12 | 146.3° | 145.6° |
| C21 | C22 | C25 | H13 | 150.7° | 155.1° |
| C21 | C22 | C25 | C26 | 157.8° | 160.7° |
| C21 | C22 | C25 | H12 | 11.2° | 16.0° |
| C22 | C21 | H14 | H15 | 124.0° | 122.3° |
| C21 | C22 | C23 | H16 | 145.8° | 137.9° |
| C22 | C25 | C26 | H12 | 146.4° | 145.4° |
| C22 | C25 | C26 | O3 | 112.4° | 179.8° |
| C25 | C22 | C21 | H14 | 163.2° | 31.6° |
| C25 | C22 | C21 | H15 | 40.4° | 153.9° |
| C25 | C26 | O3 | H11 | 179.7° | 180.0° |
| C26 | C25 | C22 | H13 | 7.1° | 5.6° |
| C26 | C25 | C23 | H16 | 10.4° | 4.1° |
| O3 | C26 | C25 | H12 | 34.0° | 34.4° |
| H1 | C1 | C3 | H5 | 58.3° | 65.0° |
| H1 | C1 | C3 | H6 | 61.2° | 175.0° |
| H1 | C1 | C2 | H8 | 61.9° | 60.0° |
| H1 | C1 | C2 | H9 | 178.0° | 60.0° |
| H1 | C1 | C2 | H10 | 58.1° | 180.0° |
| H1 | C1 | C | H20 | 62.1° | 59.9° |
| H1 | C1 | C | H21 | 177.8° | 60.0° |
| H1 | C1 | C | H22 | 57.9° | 180.0° |
| H2 | C7 | C8 | H19 | 0.1° | 0.3° |
| H3 | C4 | C3 | H5 | 179.0° | 180.0° |
| H3 | C4 | C3 | H6 | 59.5° | 59.9° |
| H4 | C4 | C3 | H5 | 61.2° | 60.0° |
| H4 | C4 | C3 | H6 | 179.4° | 179.9° |
| H7 | C12 | C11 | H24 | 60.7° | 60.0° |
| H7 | C12 | C20 | H31 | 59.5° | 60.0° |
| H7 | C12 | C20 | H32 | 60.5° | 60.0° |
| H7 | C12 | C13 | H36 | 60.0° | 60.0° |
| H7 | C12 | C13 | H37 | 59.7° | 60.0° |
| H8 | C2 | H9 | H10 | 119.9° | 120.0° |
| H12 | C25 | C22 | H13 | 139.5° | 139.1° |
| H12 | C25 | C23 | H16 | 139.7° | 140.6° |
| H13 | C22 | C21 | H14 | 12.4° | 124.0° |
| H13 | C22 | C21 | H15 | 110.3° | 1.7° |
| H13 | C22 | C23 | H16 | 0.6° | 0.4° |
| H16 | C23 | C24 | H17 | 108.5° | 3.0° |
| H16 | C23 | C24 | H18 | 14.2° | 125.4° |
| H20 | C | H21 | H22 | 120.0° | 120.0° |
| H23 | N1 | C11 | H24 | 173.9° | 144.9° |
| H24 | C11 | C16 | H25 | 60.8° | 60.0° |
| H25 | C16 | C15 | H26 | 59.8° | 60.0° |
| H25 | C16 | C15 | H27 | 60.0° | 60.0° |
| H25 | C16 | C17 | H28 | 59.3° | 60.0° |
| H25 | C16 | C17 | H29 | 60.6° | 60.0° |
| H26 | C15 | C14 | H35 | 58.7° | 60.0° |
| H27 | C15 | C14 | H35 | 61.1° | 60.0° |
| H33 | C19 | C14 | H35 | 60.0° | 60.0° |
| H34 | C19 | C14 | H35 | 60.0° | 60.0° |
| H35 | C14 | C13 | H36 | 59.0° | 60.0° |
| H35 | C14 | C13 | H37 | 60.8° | 60.0° |
