0SD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.53Å | 1.52Å | |
| O1 | C1 | sing | 1.43Å | 1.44Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | C3 | sing | 1.53Å | 1.55Å | |
| C3 | C7 | sing | 1.53Å | 1.52Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.36Å | 1.38Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | N | sing | 1.47Å | 1.47Å | |
| C19 | C20 | sing | 1.41Å | 1.39Å | Aromatic |
| C5 | N | sing | 1.47Å | 1.46Å | |
| C11 | C10 | doub | 1.37Å | 1.35Å | Aromatic |
| C11 | C12 | sing | 1.41Å | 1.41Å | Aromatic |
| N3 | C12 | doub | 1.34Å | 1.37Å | Aromatic |
| N3 | C15 | sing | 1.32Å | 1.32Å | Aromatic |
| C16 | C15 | sing | 1.48Å | 1.48Å | |
| C16 | C21 | sing | 1.46Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.38Å | Aromatic |
| N | C8 | sing | 1.47Å | 1.47Å | |
| C12 | C13 | sing | 1.42Å | 1.42Å | Aromatic |
| C15 | N2 | doub | 1.33Å | 1.34Å | Aromatic |
| C20 | C21 | sing | 1.47Å | 1.41Å | Aromatic |
| C20 | N5 | doub | 1.32Å | 1.35Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.41Å | Aromatic |
| C9 | N1 | doub | 1.31Å | 1.32Å | Aromatic |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C13 | N1 | sing | 1.33Å | 1.38Å | Aromatic |
| C13 | C14 | doub | 1.46Å | 1.41Å | Aromatic |
| N2 | C14 | sing | 1.32Å | 1.32Å | Aromatic |
| C14 | N6 | sing | 1.38Å | 1.39Å | |
| N5 | N4 | sing | 1.40Å | 1.36Å | Aromatic |
| C26 | N6 | sing | 1.47Å | 1.46Å | |
| C26 | C25 | sing | 1.53Å | 1.50Å | |
| C22 | N4 | sing | 1.34Å | 1.32Å | Aromatic |
| N6 | C23 | sing | 1.47Å | 1.46Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C25 | O | sing | 1.43Å | 1.42Å | |
| O | C24 | sing | 1.43Å | 1.42Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| O1 | H5 | sing | 0.97Å | 0.95Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C4 | H11 | sing | 1.09Å | 1.10Å | |
| N4 | H12 | sing | 0.97Å | 1.00Å | |
| C5 | H13 | sing | 1.09Å | 1.10Å | |
| C5 | H14 | sing | 1.09Å | 1.10Å | |
| C6 | H15 | sing | 1.09Å | 1.10Å | |
| C6 | H16 | sing | 1.09Å | 1.10Å | |
| C7 | H17 | sing | 1.09Å | 1.10Å | |
| C7 | H18 | sing | 1.09Å | 1.10Å | |
| C8 | H19 | sing | 1.09Å | 1.10Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C10 | H21 | sing | 1.08Å | 1.08Å | |
| C11 | H22 | sing | 1.08Å | 1.08Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C18 | H24 | sing | 1.08Å | 1.08Å | |
| C19 | H25 | sing | 1.08Å | 1.08Å | |
| C22 | H26 | sing | 1.08Å | 1.08Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| C24 | H30 | sing | 1.09Å | 1.10Å | |
| C25 | H31 | sing | 1.09Å | 1.10Å | |
| C25 | H32 | sing | 1.09Å | 1.10Å | |
| C26 | H33 | sing | 1.09Å | 1.10Å | |
| C26 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | O1 | 107.0° | 109.5° |
| C | C1 | C2 | 110.4° | 109.4° |
| C | C1 | C3 | 111.8° | 109.5° |
| C1 | C | H2 | 109.5° | 109.5° |
| C1 | C | H3 | 109.5° | 109.5° |
| C1 | C | H4 | 109.5° | 109.5° |
| O1 | C1 | C2 | 107.8° | 109.5° |
| O1 | C1 | C3 | 107.6° | 109.5° |
| C1 | O1 | H5 | 109.5° | 114.0° |
| C2 | C1 | C3 | 112.0° | 109.5° |
| C1 | C2 | H6 | 109.5° | 109.5° |
| C1 | C2 | H7 | 109.5° | 109.5° |
| C1 | C2 | H8 | 109.5° | 109.5° |
| C1 | C3 | C7 | 113.5° | 109.5° |
| C1 | C3 | C4 | 113.4° | 109.5° |
| C1 | C3 | H9 | 107.2° | 109.6° |
| C7 | C3 | C4 | 107.6° | 109.1° |
| C3 | C7 | C6 | 109.4° | 109.2° |
| C7 | C3 | H9 | 107.4° | 109.5° |
| C3 | C7 | H17 | 109.5° | 109.5° |
| C3 | C7 | H18 | 109.5° | 109.5° |
| C3 | C4 | C5 | 109.6° | 109.3° |
| C4 | C3 | H9 | 107.4° | 109.6° |
| C3 | C4 | H10 | 109.4° | 109.5° |
| C3 | C4 | H11 | 109.4° | 109.5° |
| C7 | C6 | N | 111.5° | 109.6° |
| C7 | C6 | H15 | 108.9° | 109.5° |
| C7 | C6 | H16 | 108.9° | 109.4° |
| C6 | C7 | H17 | 109.5° | 109.5° |
| C6 | C7 | H18 | 109.5° | 109.5° |
| C4 | C5 | N | 111.4° | 109.5° |
| C5 | C4 | H10 | 109.4° | 109.5° |
| C5 | C4 | H11 | 109.4° | 109.5° |
| C4 | C5 | H13 | 109.0° | 109.4° |
| C4 | C5 | H14 | 109.0° | 109.5° |
| C17 | C18 | C19 | 120.3° | 122.7° |
| C18 | C17 | C16 | 120.4° | 121.3° |
| C18 | C17 | H23 | 119.8° | 119.4° |
| C17 | C18 | H24 | 119.8° | 118.6° |
| C18 | C19 | C20 | 118.9° | 120.5° |
| C19 | C18 | H24 | 119.9° | 118.7° |
| C18 | C19 | H25 | 120.6° | 119.7° |
| C17 | C16 | C15 | 119.4° | 120.7° |
| C17 | C16 | C21 | 120.7° | 118.5° |
| C16 | C17 | H23 | 119.8° | 119.3° |
| C6 | N | C5 | 109.7° | 111.2° |
| C6 | N | C8 | 110.8° | 111.1° |
| N | C6 | H15 | 109.0° | 109.4° |
| N | C6 | H16 | 109.0° | 109.4° |
| C19 | C20 | C21 | 121.6° | 118.6° |
| C19 | C20 | N5 | 131.6° | 134.7° |
| C20 | C19 | H25 | 120.6° | 119.7° |
| C5 | N | C8 | 110.7° | 111.0° |
| N | C5 | H13 | 109.0° | 109.5° |
| N | C5 | H14 | 109.0° | 109.5° |
| C10 | C11 | C12 | 120.1° | 118.0° |
| C11 | C10 | C9 | 118.7° | 120.0° |
| C11 | C10 | H21 | 120.6° | 120.0° |
| C10 | C11 | H22 | 119.9° | 121.0° |
| C11 | C12 | N3 | 119.1° | 122.2° |
| C11 | C12 | C13 | 119.5° | 118.9° |
| C12 | C11 | H22 | 119.9° | 121.0° |
| C12 | N3 | C15 | 116.6° | 121.0° |
| N3 | C12 | C13 | 121.3° | 119.0° |
| N3 | C15 | C16 | 113.2° | 118.4° |
| N3 | C15 | N2 | 126.1° | 123.2° |
| C15 | C16 | C21 | 119.9° | 120.7° |
| C16 | C15 | N2 | 120.7° | 118.4° |
| C16 | C21 | C20 | 118.2° | 118.3° |
| C16 | C21 | C22 | 137.7° | 135.0° |
| C10 | C9 | N1 | 122.6° | 121.6° |
| C10 | C9 | C8 | 120.6° | 119.2° |
| C9 | C10 | H21 | 120.6° | 120.0° |
| N | C8 | C9 | 113.1° | 109.5° |
| N | C8 | H19 | 108.5° | 109.5° |
| N | C8 | H20 | 108.5° | 109.5° |
| C12 | C13 | N1 | 117.3° | 120.3° |
| C12 | C13 | C14 | 115.8° | 117.7° |
| C15 | N2 | C14 | 118.8° | 121.4° |
| C21 | C20 | N5 | 106.8° | 106.7° |
| C20 | C21 | C22 | 104.1° | 106.6° |
| C20 | N5 | N4 | 111.5° | 108.9° |
| C21 | C22 | N4 | 111.6° | 107.9° |
| C21 | C22 | H26 | 124.2° | 126.1° |
| N1 | C9 | C8 | 116.7° | 119.1° |
| C9 | N1 | C13 | 121.6° | 121.2° |
| C9 | C8 | H19 | 108.6° | 109.4° |
| C9 | C8 | H20 | 108.6° | 109.5° |
| N1 | C13 | C14 | 126.8° | 122.1° |
| C13 | C14 | N2 | 121.4° | 117.7° |
| C13 | C14 | N6 | 116.1° | 121.1° |
| N2 | C14 | N6 | 122.5° | 121.2° |
| C14 | N6 | C26 | 120.8° | 111.0° |
| C14 | N6 | C23 | 121.2° | 111.0° |
| N5 | N4 | C22 | 105.9° | 109.9° |
| N5 | N4 | H12 | 127.0° | 125.1° |
| N6 | C26 | C25 | 109.1° | 109.2° |
| C26 | N6 | C23 | 111.6° | 110.7° |
| N6 | C26 | H33 | 109.6° | 109.5° |
| N6 | C26 | H34 | 109.6° | 109.6° |
| C26 | C25 | O | 111.5° | 109.2° |
| C26 | C25 | H31 | 109.0° | 109.5° |
| C26 | C25 | H32 | 109.0° | 109.6° |
| C25 | C26 | H33 | 109.6° | 109.4° |
| C25 | C26 | H34 | 109.6° | 109.5° |
| C22 | N4 | H12 | 127.0° | 125.0° |
| N4 | C22 | H26 | 124.2° | 126.0° |
| N6 | C23 | C24 | 109.2° | 109.3° |
| N6 | C23 | H27 | 109.5° | 109.5° |
| N6 | C23 | H28 | 109.6° | 109.5° |
| C23 | C24 | O | 111.6° | 109.2° |
| C24 | C23 | H27 | 109.5° | 109.5° |
| C24 | C23 | H28 | 109.5° | 109.5° |
| C23 | C24 | H29 | 109.0° | 109.5° |
| C23 | C24 | H30 | 108.9° | 109.5° |
| C25 | O | C24 | 109.9° | 113.7° |
| O | C25 | H31 | 109.0° | 109.5° |
| O | C25 | H32 | 109.0° | 109.5° |
| O | C24 | H29 | 108.9° | 109.5° |
| O | C24 | H30 | 108.9° | 109.5° |
| H2 | C | H3 | 109.4° | 109.4° |
| H2 | C | H4 | 109.5° | 109.5° |
| H3 | C | H4 | 109.4° | 109.5° |
| H6 | C2 | H7 | 109.5° | 109.5° |
| H6 | C2 | H8 | 109.5° | 109.5° |
| H7 | C2 | H8 | 109.4° | 109.4° |
| H10 | C4 | H11 | 109.5° | 109.5° |
| H13 | C5 | H14 | 109.5° | 109.5° |
| H15 | C6 | H16 | 109.5° | 109.4° |
| H17 | C7 | H18 | 109.5° | 109.6° |
| H19 | C8 | H20 | 109.5° | 109.5° |
| H27 | C23 | H28 | 109.4° | 109.5° |
| H29 | C24 | H30 | 109.5° | 109.6° |
| H31 | C25 | H32 | 109.5° | 109.5° |
| H33 | C26 | H34 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | O1 | C2 | 118.7° | 119.9° |
| C | C1 | O1 | C3 | 120.3° | 120.1° |
| C | C1 | C2 | C3 | 125.3° | 120.0° |
| C | C1 | C3 | C7 | 171.4° | 180.0° |
| C | C1 | C3 | C4 | 65.4° | 60.4° |
| C1 | C | H2 | H3 | 120.0° | 120.0° |
| C1 | C | H2 | H4 | 120.0° | 120.1° |
| C1 | C | H3 | H4 | 120.0° | 120.0° |
| C | C1 | O1 | H5 | 180.0° | 180.0° |
| C | C1 | C2 | H6 | 180.0° | 60.0° |
| C | C1 | C2 | H7 | 60.0° | 180.0° |
| C | C1 | C2 | H8 | 60.0° | 60.0° |
| C | C1 | C3 | H9 | 53.0° | 59.8° |
| O1 | C1 | C2 | C3 | 118.2° | 120.1° |
| O1 | C1 | C3 | C7 | 54.2° | 60.0° |
| O1 | C1 | C3 | C4 | 177.4° | 59.7° |
| O1 | C1 | C | H2 | 180.0° | 59.9° |
| O1 | C1 | C | H3 | 60.0° | 60.0° |
| O1 | C1 | C | H4 | 60.0° | 180.0° |
| O1 | C1 | C2 | H6 | 63.5° | 180.0° |
| O1 | C1 | C2 | H7 | 176.5° | 60.0° |
| O1 | C1 | C2 | H8 | 56.5° | 59.9° |
| O1 | C1 | C3 | H9 | 64.2° | 179.9° |
| C2 | C1 | C3 | C7 | 64.0° | 60.1° |
| C2 | C1 | C3 | C4 | 59.1° | 179.7° |
| C2 | C1 | C | H2 | 63.0° | 60.0° |
| C2 | C1 | C | H3 | 177.0° | 180.0° |
| C2 | C1 | C | H4 | 57.0° | 60.0° |
| C2 | C1 | O1 | H5 | 61.3° | 60.1° |
| C1 | C2 | H6 | H7 | 120.0° | 120.0° |
| C1 | C2 | H6 | H8 | 120.0° | 120.1° |
| C1 | C2 | H7 | H8 | 120.0° | 120.0° |
| C2 | C1 | C3 | H9 | 177.6° | 60.1° |
| C1 | C3 | C7 | C4 | 126.3° | 119.9° |
| C1 | C3 | C7 | H9 | 118.3° | 120.2° |
| C1 | C3 | C4 | H9 | 118.2° | 120.2° |
| C1 | C3 | C7 | C6 | 175.0° | 177.5° |
| C1 | C3 | C4 | C5 | 175.1° | 177.6° |
| C3 | C1 | C | H2 | 62.4° | 180.0° |
| C3 | C1 | C | H3 | 57.6° | 60.1° |
| C3 | C1 | C | H4 | 177.6° | 59.9° |
| C3 | C1 | O1 | H5 | 59.7° | 60.0° |
| C3 | C1 | C2 | H6 | 54.7° | 60.0° |
| C3 | C1 | C2 | H7 | 65.3° | 60.1° |
| C3 | C1 | C2 | H8 | 174.7° | 180.0° |
| C1 | C3 | C4 | H10 | 55.1° | 62.5° |
| C1 | C3 | C4 | H11 | 64.9° | 57.6° |
| C1 | C3 | C7 | H17 | 65.0° | 57.6° |
| C1 | C3 | C7 | H18 | 55.0° | 62.6° |
| C7 | C3 | C4 | H9 | 115.4° | 119.9° |
| C3 | C7 | C6 | H17 | 120.0° | 119.9° |
| C3 | C7 | C6 | H18 | 120.0° | 119.9° |
| C7 | C3 | C4 | C5 | 58.6° | 57.7° |
| C3 | C7 | C6 | N | 59.9° | 59.2° |
| C7 | C3 | C4 | H10 | 178.6° | 177.6° |
| C7 | C3 | C4 | H11 | 61.4° | 62.3° |
| C3 | C7 | C6 | H15 | 179.8° | 60.8° |
| C3 | C7 | C6 | H16 | 60.4° | 179.2° |
| C3 | C7 | H17 | H18 | 120.0° | 120.1° |
| C4 | C3 | C7 | C6 | 58.6° | 57.6° |
| C3 | C4 | C5 | H10 | 120.0° | 119.9° |
| C3 | C4 | C5 | H11 | 120.0° | 120.0° |
| C3 | C4 | C5 | N | 59.6° | 59.2° |
| C3 | C4 | H10 | H11 | 120.0° | 120.1° |
| C3 | C4 | C5 | H13 | 60.6° | 179.2° |
| C3 | C4 | C5 | H14 | 179.9° | 60.8° |
| C4 | C3 | C7 | H17 | 61.3° | 62.3° |
| C4 | C3 | C7 | H18 | 178.6° | 177.6° |
| C7 | C6 | N | H15 | 120.3° | 120.1° |
| C7 | C6 | N | H16 | 120.3° | 120.0° |
| C7 | C6 | N | C5 | 58.7° | 61.8° |
| C7 | C6 | N | C8 | 178.7° | 174.1° |
| C6 | C7 | C3 | H9 | 56.8° | 62.3° |
| C7 | C6 | H15 | H16 | 119.0° | 120.0° |
| C6 | C7 | H17 | H18 | 120.0° | 120.2° |
| C4 | C5 | N | C6 | 58.5° | 61.7° |
| C4 | C5 | N | H13 | 120.3° | 120.0° |
| C4 | C5 | N | H14 | 120.3° | 120.0° |
| C4 | C5 | N | C8 | 178.9° | 174.1° |
| C5 | C4 | C3 | H9 | 56.8° | 62.2° |
| C5 | C4 | H10 | H11 | 119.9° | 120.1° |
| C4 | C5 | H13 | H14 | 119.1° | 120.0° |
| C17 | C18 | C19 | H24 | 180.0° | 180.0° |
| C18 | C17 | C16 | H23 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.0° |
| C18 | C17 | C16 | C15 | 178.8° | 180.0° |
| C18 | C17 | C16 | C21 | 0.1° | 0.0° |
| C17 | C18 | C19 | H25 | 179.9° | 180.0° |
| C19 | C18 | C17 | C16 | 0.1° | 0.0° |
| C18 | C19 | C20 | H25 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.0° | 0.0° |
| C18 | C19 | C20 | N5 | 179.9° | 180.0° |
| C19 | C18 | C17 | H23 | 180.0° | 180.0° |
| C17 | C16 | C15 | N3 | 25.7° | 179.9° |
| C17 | C16 | C15 | C21 | 179.0° | 180.0° |
| C17 | C16 | C15 | N2 | 154.0° | 0.0° |
| C17 | C16 | C21 | C20 | 0.2° | 0.0° |
| C17 | C16 | C21 | C22 | 180.0° | 179.6° |
| C16 | C17 | C18 | H24 | 180.0° | 180.0° |
| C6 | N | C5 | C8 | 122.6° | 124.1° |
| C6 | N | C8 | C9 | 67.2° | 65.8° |
| C6 | N | C5 | H13 | 61.8° | 178.3° |
| C6 | N | C5 | H14 | 178.8° | 58.3° |
| N | C6 | H15 | H16 | 119.1° | 119.9° |
| N | C6 | C7 | H17 | 60.1° | 60.7° |
| N | C6 | C7 | H18 | 179.9° | 179.1° |
| C6 | N | C8 | H19 | 172.2° | 54.2° |
| C6 | N | C8 | H20 | 53.3° | 174.2° |
| C19 | C20 | C21 | C16 | 0.2° | 0.0° |
| C19 | C20 | C21 | N5 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 179.9° | 179.7° |
| C19 | C20 | N5 | N4 | 180.0° | 179.9° |
| C20 | C19 | C18 | H24 | 179.9° | 180.0° |
| C5 | N | C8 | C9 | 54.7° | 170.0° |
| N | C5 | C4 | H10 | 179.6° | 179.1° |
| N | C5 | C4 | H11 | 60.4° | 60.7° |
| N | C5 | H13 | H14 | 119.1° | 120.0° |
| C5 | N | C6 | H15 | 179.1° | 58.3° |
| C5 | N | C6 | H16 | 61.6° | 178.2° |
| C5 | N | C8 | H19 | 65.9° | 70.0° |
| C5 | N | C8 | H20 | 175.2° | 50.0° |
| C10 | C11 | C12 | H22 | 180.0° | 179.9° |
| C10 | C11 | C12 | N3 | 177.8° | 180.0° |
| C11 | C10 | C9 | H21 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 0.9° | 0.0° |
| C11 | C10 | C9 | N1 | 1.6° | 0.0° |
| C11 | C10 | C9 | C8 | 174.7° | 180.0° |
| C11 | C12 | N3 | C13 | 178.7° | 179.9° |
| C11 | C12 | N3 | C15 | 178.9° | 179.9° |
| C12 | C11 | C10 | C9 | 0.0° | 0.0° |
| C11 | C12 | C13 | N1 | 0.5° | 0.0° |
| C11 | C12 | C13 | C14 | 179.0° | 180.0° |
| C12 | C11 | C10 | H21 | 179.9° | 180.0° |
| C12 | N3 | C15 | C16 | 180.0° | 180.0° |
| C12 | N3 | C15 | N2 | 0.3° | 0.0° |
| N3 | C12 | C13 | N1 | 178.3° | 180.0° |
| N3 | C12 | C13 | C14 | 0.3° | 0.0° |
| N3 | C12 | C11 | H22 | 2.2° | 0.1° |
| N3 | C15 | C16 | N2 | 179.7° | 180.0° |
| N3 | C15 | C16 | C21 | 153.3° | 0.1° |
| C15 | N3 | C12 | C13 | 0.2° | 0.0° |
| N3 | C15 | N2 | C14 | 0.7° | 0.0° |
| C15 | C16 | C21 | C20 | 178.7° | 180.0° |
| C15 | C16 | C21 | C22 | 1.1° | 0.4° |
| C16 | C15 | N2 | C14 | 179.6° | 180.0° |
| C15 | C16 | C17 | H23 | 1.2° | 0.0° |
| C21 | C16 | C15 | N2 | 27.0° | 180.0° |
| C16 | C21 | C20 | C22 | 179.9° | 179.7° |
| C16 | C21 | C20 | N5 | 179.8° | 180.0° |
| C16 | C21 | C22 | N4 | 179.7° | 180.0° |
| C21 | C16 | C17 | H23 | 179.9° | 180.0° |
| C16 | C21 | C22 | H26 | 0.3° | 0.0° |
| C10 | C9 | C8 | N | 56.5° | 95.0° |
| C10 | C9 | N1 | C8 | 176.4° | 179.9° |
| C10 | C9 | N1 | C13 | 2.0° | 0.0° |
| C10 | C9 | C8 | H19 | 64.1° | 25.0° |
| C10 | C9 | C8 | H20 | 177.0° | 145.0° |
| C9 | C10 | C11 | H22 | 180.0° | 180.0° |
| N | C8 | C9 | N1 | 127.1° | 85.0° |
| N | C8 | C9 | H19 | 120.5° | 120.0° |
| N | C8 | C9 | H20 | 120.5° | 120.1° |
| C8 | N | C5 | H13 | 60.8° | 54.2° |
| C8 | N | C5 | H14 | 58.6° | 65.9° |
| C8 | N | C6 | H15 | 58.4° | 65.8° |
| C8 | N | C6 | H16 | 61.0° | 54.1° |
| N | C8 | H19 | H20 | 118.3° | 120.1° |
| C12 | C13 | N1 | C9 | 1.0° | 0.0° |
| C12 | C13 | N1 | C14 | 178.4° | 180.0° |
| C12 | C13 | C14 | N2 | 0.1° | 0.0° |
| C12 | C13 | C14 | N6 | 177.6° | 180.0° |
| C13 | C12 | C11 | H22 | 179.1° | 180.0° |
| C15 | N2 | C14 | C13 | 0.5° | 0.0° |
| C15 | N2 | C14 | N6 | 177.0° | 179.9° |
| C21 | C20 | N5 | N4 | 0.1° | 0.1° |
| C20 | C21 | C22 | N4 | 0.1° | 0.4° |
| C21 | C20 | C19 | H25 | 179.9° | 180.0° |
| C20 | C21 | C22 | H26 | 179.9° | 179.7° |
| N5 | C20 | C21 | C22 | 0.1° | 0.3° |
| C20 | N5 | N4 | C22 | 0.0° | 0.2° |
| C20 | N5 | N4 | H12 | 180.0° | 180.0° |
| N5 | C20 | C19 | H25 | 0.1° | 0.0° |
| C21 | C22 | N4 | N5 | 0.1° | 0.4° |
| C21 | C22 | N4 | H26 | 180.0° | 179.9° |
| C21 | C22 | N4 | H12 | 179.9° | 179.8° |
| C9 | N1 | C13 | C14 | 177.4° | 180.0° |
| N1 | C9 | C8 | H19 | 112.4° | 155.0° |
| N1 | C9 | C8 | H20 | 6.6° | 35.1° |
| N1 | C9 | C10 | H21 | 178.4° | 180.0° |
| C8 | C9 | N1 | C13 | 174.3° | 180.0° |
| C9 | C8 | H19 | H20 | 118.4° | 120.0° |
| C8 | C9 | C10 | H21 | 5.3° | 0.0° |
| N1 | C13 | C14 | N2 | 178.5° | 180.0° |
| N1 | C13 | C14 | N6 | 0.8° | 0.0° |
| C13 | C14 | N2 | N6 | 177.5° | 180.0° |
| C13 | C14 | N6 | C26 | 34.8° | 56.5° |
| C13 | C14 | N6 | C23 | 175.7° | 180.0° |
| N2 | C14 | N6 | C26 | 147.6° | 123.6° |
| N2 | C14 | N6 | C23 | 2.0° | 0.0° |
| C14 | N6 | C26 | C23 | 152.2° | 123.7° |
| C14 | N6 | C26 | C25 | 152.7° | 177.6° |
| C14 | N6 | C23 | C24 | 153.0° | 177.6° |
| C14 | N6 | C23 | H27 | 87.0° | 62.4° |
| C14 | N6 | C23 | H28 | 33.0° | 57.7° |
| C14 | N6 | C26 | H33 | 32.8° | 57.8° |
| C14 | N6 | C26 | H34 | 87.4° | 62.4° |
| N5 | N4 | C22 | H12 | 180.0° | 179.8° |
| N5 | N4 | C22 | H26 | 179.9° | 179.7° |
| N6 | C26 | C25 | H33 | 119.9° | 119.8° |
| N6 | C26 | C25 | H34 | 119.9° | 120.0° |
| C26 | N6 | C23 | C24 | 54.9° | 58.7° |
| N6 | C26 | C25 | O | 57.6° | 56.9° |
| C26 | N6 | C23 | H27 | 65.1° | 61.3° |
| C26 | N6 | C23 | H28 | 174.9° | 178.6° |
| N6 | C26 | C25 | H31 | 62.7° | 176.8° |
| N6 | C26 | C25 | H32 | 177.9° | 63.1° |
| N6 | C26 | H33 | H34 | 120.2° | 120.2° |
| C25 | C26 | N6 | C23 | 55.1° | 58.7° |
| C26 | C25 | O | H31 | 120.3° | 119.9° |
| C26 | C25 | O | H32 | 120.3° | 120.1° |
| C26 | C25 | O | C24 | 60.1° | 58.8° |
| C26 | C25 | H31 | H32 | 119.1° | 120.2° |
| C25 | C26 | H33 | H34 | 120.2° | 120.1° |
| N6 | C23 | C24 | H27 | 120.0° | 120.0° |
| N6 | C23 | C24 | H28 | 120.0° | 119.9° |
| N6 | C23 | C24 | O | 57.0° | 56.9° |
| N6 | C23 | H27 | H28 | 120.1° | 120.1° |
| N6 | C23 | C24 | H29 | 177.3° | 63.1° |
| N6 | C23 | C24 | H30 | 63.3° | 176.8° |
| C23 | N6 | C26 | H33 | 175.0° | 178.5° |
| C23 | N6 | C26 | H34 | 64.8° | 61.3° |
| C23 | C24 | O | C25 | 59.8° | 58.7° |
| C23 | C24 | O | H29 | 120.3° | 119.9° |
| C23 | C24 | O | H30 | 120.3° | 119.9° |
| C24 | C23 | H27 | H28 | 120.1° | 120.1° |
| C23 | C24 | H29 | H30 | 119.0° | 120.1° |
| C25 | O | C24 | H29 | 179.8° | 61.2° |
| C25 | O | C24 | H30 | 60.5° | 178.6° |
| O | C25 | H31 | H32 | 119.1° | 120.1° |
| O | C25 | C26 | H33 | 177.5° | 176.8° |
| O | C25 | C26 | H34 | 62.4° | 63.1° |
| O | C24 | C23 | H27 | 63.0° | 63.1° |
| O | C24 | C23 | H28 | 177.0° | 176.8° |
| O | C24 | H29 | H30 | 119.0° | 120.2° |
| C24 | O | C25 | H31 | 60.2° | 178.7° |
| C24 | O | C25 | H32 | 179.6° | 61.3° |
| H2 | C | H3 | H4 | 120.0° | 120.0° |
| H6 | C2 | H7 | H8 | 120.0° | 120.0° |
| H9 | C3 | C4 | H10 | 63.2° | 57.7° |
| H9 | C3 | C4 | H11 | 176.8° | 177.8° |
| H9 | C3 | C7 | H17 | 176.7° | 177.8° |
| H9 | C3 | C7 | H18 | 63.2° | 57.6° |
| H10 | C4 | C5 | H13 | 59.4° | 60.9° |
| H10 | C4 | C5 | H14 | 60.1° | 59.1° |
| H11 | C4 | C5 | H13 | 179.4° | 59.2° |
| H11 | C4 | C5 | H14 | 59.9° | 179.2° |
| H12 | N4 | C22 | H26 | 0.1° | 0.1° |
| H15 | C6 | C7 | H17 | 60.2° | 179.3° |
| H15 | C6 | C7 | H18 | 59.8° | 59.1° |
| H16 | C6 | C7 | H17 | 179.6° | 59.3° |
| H16 | C6 | C7 | H18 | 59.6° | 60.9° |
| H21 | C10 | C11 | H22 | 0.1° | 0.1° |
| H23 | C17 | C18 | H24 | 0.0° | 0.0° |
| H24 | C18 | C19 | H25 | 0.1° | 0.0° |
| H27 | C23 | C24 | H29 | 57.3° | 177.0° |
| H27 | C23 | C24 | H30 | 176.7° | 56.8° |
| H28 | C23 | C24 | H29 | 62.7° | 56.9° |
| H28 | C23 | C24 | H30 | 56.7° | 63.3° |
| H31 | C25 | C26 | H33 | 57.2° | 63.3° |
| H31 | C25 | C26 | H34 | 177.3° | 56.8° |
| H32 | C25 | C26 | H33 | 62.2° | 56.8° |
| H32 | C25 | C26 | H34 | 57.9° | 176.9° |
