A1ESW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C16 | C15 | sing | 1.51Å | 1.52Å | |
| O1 | C15 | doub | 1.21Å | 1.18Å | |
| C15 | N5 | sing | 1.35Å | 1.44Å | |
| N5 | C12 | sing | 1.40Å | 1.44Å | |
| C12 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C8 | sing | 1.39Å | 1.35Å | Aromatic |
| C13 | C14 | doub | 1.37Å | 1.39Å | Aromatic |
| C10 | N4 | sing | 1.46Å | 1.46Å | |
| C8 | N4 | sing | 1.38Å | 1.37Å | Aromatic |
| C8 | C9 | doub | 1.40Å | 1.45Å | Aromatic |
| N4 | C7 | sing | 1.36Å | 1.25Å | Aromatic |
| C14 | C9 | sing | 1.40Å | 1.39Å | Aromatic |
| C9 | C5 | sing | 1.47Å | 1.50Å | Aromatic |
| C7 | C5 | doub | 1.36Å | 1.33Å | Aromatic |
| C5 | C2 | sing | 1.48Å | 1.56Å | |
| C2 | C3 | doub | 1.40Å | 1.36Å | Aromatic |
| C2 | N2 | sing | 1.33Å | 1.31Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.35Å | Aromatic |
| N2 | C1 | doub | 1.32Å | 1.31Å | Aromatic |
| C4 | N1 | doub | 1.32Å | 1.28Å | Aromatic |
| C19 | N7 | doub | 1.31Å | 1.35Å | Aromatic |
| C19 | C6 | sing | 1.40Å | 1.44Å | Aromatic |
| N7 | N6 | sing | 1.40Å | 1.36Å | Aromatic |
| C1 | N1 | sing | 1.33Å | 1.29Å | Aromatic |
| C1 | N3 | sing | 1.38Å | 1.45Å | |
| C6 | N3 | sing | 1.41Å | 1.50Å | |
| C6 | C18 | doub | 1.36Å | 1.41Å | Aromatic |
| N6 | C18 | sing | 1.36Å | 1.40Å | Aromatic |
| N6 | C20 | sing | 1.46Å | 1.47Å | |
| C18 | C21 | sing | 1.51Å | 1.54Å | |
| C20 | C22 | sing | 1.53Å | 1.60Å | |
| C22 | N8 | sing | 1.47Å | 1.30Å | |
| C23 | N8 | sing | 1.47Å | 1.35Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| N8 | C26 | sing | 1.47Å | 1.29Å | |
| C24 | O2 | sing | 1.43Å | 1.42Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| O2 | C25 | sing | 1.43Å | 1.41Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.08Å | 1.08Å | |
| C11 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.08Å | 1.08Å | |
| C3 | H11 | sing | 1.08Å | 1.08Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.08Å | 1.08Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| N3 | H31 | sing | 0.97Å | 1.00Å | |
| N5 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C15 | 118.9° | 109.5° |
| C17 | C16 | H8 | 107.1° | 109.5° |
| C17 | C16 | H9 | 107.1° | 109.4° |
| C16 | C17 | H12 | 109.5° | 109.5° |
| C16 | C17 | H13 | 109.5° | 109.4° |
| C16 | C17 | H14 | 109.5° | 109.4° |
| C16 | C15 | O1 | 121.4° | 120.0° |
| C16 | C15 | N5 | 118.2° | 120.0° |
| C15 | C16 | H8 | 107.1° | 109.5° |
| C15 | C16 | H9 | 107.1° | 109.5° |
| O1 | C15 | N5 | 120.3° | 120.0° |
| C15 | N5 | C12 | 128.9° | 120.0° |
| C15 | N5 | H32 | 115.6° | 120.0° |
| N5 | C12 | C11 | 123.4° | 119.8° |
| N5 | C12 | C13 | 117.2° | 119.8° |
| C12 | N5 | H32 | 115.6° | 120.0° |
| C11 | C12 | C13 | 119.4° | 120.4° |
| C12 | C11 | C8 | 120.4° | 119.8° |
| C12 | C11 | H7 | 119.8° | 120.1° |
| C12 | C13 | C14 | 121.5° | 120.5° |
| C12 | C13 | H6 | 119.2° | 119.7° |
| C11 | C8 | N4 | 136.4° | 133.2° |
| C11 | C8 | C9 | 121.8° | 119.3° |
| C8 | C11 | H7 | 119.8° | 120.1° |
| C13 | C14 | C9 | 120.1° | 119.9° |
| C14 | C13 | H6 | 119.2° | 119.8° |
| C13 | C14 | H10 | 119.9° | 120.1° |
| C10 | N4 | C8 | 120.6° | 124.9° |
| C10 | N4 | C7 | 118.0° | 124.9° |
| N4 | C10 | H3 | 109.5° | 109.4° |
| N4 | C10 | H4 | 109.4° | 109.5° |
| N4 | C10 | H5 | 109.5° | 109.5° |
| N4 | C8 | C9 | 101.7° | 107.4° |
| C8 | N4 | C7 | 121.4° | 110.2° |
| C8 | C9 | C14 | 116.7° | 120.1° |
| C8 | C9 | C5 | 101.6° | 106.0° |
| N4 | C7 | C5 | 104.1° | 109.8° |
| N4 | C7 | H2 | 127.9° | 125.1° |
| C14 | C9 | C5 | 141.6° | 133.9° |
| C9 | C14 | H10 | 120.0° | 120.0° |
| C9 | C5 | C7 | 111.0° | 106.6° |
| C9 | C5 | C2 | 126.9° | 126.7° |
| C7 | C5 | C2 | 122.0° | 126.7° |
| C5 | C7 | H2 | 128.0° | 125.1° |
| C5 | C2 | C3 | 119.6° | 120.6° |
| C5 | C2 | N2 | 119.2° | 120.5° |
| C3 | C2 | N2 | 121.2° | 118.9° |
| C2 | C3 | C4 | 116.2° | 118.5° |
| C2 | C3 | H11 | 121.9° | 120.8° |
| C2 | N2 | C1 | 118.1° | 120.6° |
| C3 | C4 | N1 | 122.5° | 119.3° |
| C3 | C4 | H1 | 118.8° | 120.4° |
| C4 | C3 | H11 | 121.9° | 120.8° |
| N2 | C1 | N1 | 123.3° | 121.7° |
| N2 | C1 | N3 | 119.8° | 119.2° |
| C4 | N1 | C1 | 118.8° | 121.0° |
| N1 | C4 | H1 | 118.8° | 120.3° |
| N7 | C19 | C6 | 110.6° | 108.4° |
| C19 | N7 | N6 | 106.8° | 108.4° |
| N7 | C19 | H15 | 124.7° | 125.8° |
| C19 | C6 | N3 | 129.3° | 126.1° |
| C19 | C6 | C18 | 104.7° | 107.8° |
| C6 | C19 | H15 | 124.7° | 125.8° |
| N7 | N6 | C18 | 111.5° | 107.9° |
| N7 | N6 | C20 | 126.8° | 126.1° |
| N1 | C1 | N3 | 116.9° | 119.1° |
| C1 | N3 | C6 | 125.1° | 120.1° |
| C1 | N3 | H31 | 117.5° | 119.9° |
| N3 | C6 | C18 | 126.0° | 126.1° |
| C6 | N3 | H31 | 117.4° | 120.0° |
| C6 | C18 | N6 | 106.4° | 107.6° |
| C6 | C18 | C21 | 128.7° | 126.2° |
| C18 | N6 | C20 | 121.7° | 126.1° |
| N6 | C18 | C21 | 124.8° | 126.2° |
| N6 | C20 | C22 | 111.8° | 109.5° |
| N6 | C20 | H16 | 108.9° | 109.5° |
| N6 | C20 | H17 | 108.9° | 109.5° |
| C18 | C21 | H18 | 109.5° | 109.5° |
| C18 | C21 | H19 | 109.5° | 109.5° |
| C18 | C21 | H20 | 109.5° | 109.4° |
| C20 | C22 | N8 | 111.9° | 109.5° |
| C22 | C20 | H16 | 108.9° | 109.5° |
| C22 | C20 | H17 | 108.9° | 109.5° |
| C20 | C22 | H21 | 108.9° | 109.5° |
| C20 | C22 | H22 | 108.9° | 109.5° |
| C22 | N8 | C23 | 111.5° | 111.0° |
| C22 | N8 | C26 | 110.8° | 111.0° |
| N8 | C22 | H21 | 108.9° | 109.5° |
| N8 | C22 | H22 | 108.9° | 109.5° |
| N8 | C23 | C24 | 117.6° | 109.3° |
| C23 | N8 | C26 | 115.5° | 110.8° |
| N8 | C23 | H23 | 107.4° | 109.6° |
| N8 | C23 | H24 | 107.4° | 109.5° |
| C23 | C24 | O2 | 112.1° | 109.2° |
| C24 | C23 | H23 | 107.4° | 109.5° |
| C24 | C23 | H24 | 107.4° | 109.5° |
| C23 | C24 | H25 | 108.8° | 109.5° |
| C23 | C24 | H26 | 108.8° | 109.5° |
| N8 | C26 | C25 | 110.5° | 109.2° |
| N8 | C26 | H29 | 109.2° | 109.5° |
| N8 | C26 | H30 | 109.2° | 109.6° |
| C24 | O2 | C25 | 113.6° | 113.7° |
| O2 | C24 | H25 | 108.8° | 109.5° |
| O2 | C24 | H26 | 108.8° | 109.5° |
| C26 | C25 | O2 | 112.6° | 109.3° |
| C26 | C25 | H27 | 108.7° | 109.5° |
| C26 | C25 | H28 | 108.7° | 109.5° |
| C25 | C26 | H29 | 109.2° | 109.5° |
| C25 | C26 | H30 | 109.2° | 109.5° |
| O2 | C25 | H27 | 108.7° | 109.5° |
| O2 | C25 | H28 | 108.7° | 109.5° |
| H3 | C10 | H4 | 109.5° | 109.5° |
| H3 | C10 | H5 | 109.5° | 109.4° |
| H4 | C10 | H5 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.4° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H12 | C17 | H14 | 109.5° | 109.5° |
| H13 | C17 | H14 | 109.4° | 109.5° |
| H16 | C20 | H17 | 109.4° | 109.4° |
| H18 | C21 | H19 | 109.4° | 109.5° |
| H18 | C21 | H20 | 109.5° | 109.5° |
| H19 | C21 | H20 | 109.5° | 109.4° |
| H21 | C22 | H22 | 109.4° | 109.4° |
| H23 | C23 | H24 | 109.4° | 109.5° |
| H25 | C24 | H26 | 109.5° | 109.6° |
| H27 | C25 | H28 | 109.5° | 109.5° |
| H29 | C26 | H30 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C15 | H8 | 121.3° | 120.1° |
| C17 | C16 | C15 | H9 | 121.3° | 120.0° |
| C17 | C16 | C15 | O1 | 73.5° | 0.0° |
| C17 | C16 | C15 | N5 | 107.7° | 180.0° |
| C17 | C16 | H8 | H9 | 115.7° | 119.9° |
| C16 | C17 | H12 | H13 | 120.0° | 120.0° |
| C16 | C17 | H12 | H14 | 120.0° | 120.0° |
| C16 | C17 | H13 | H14 | 120.0° | 119.9° |
| C16 | C15 | O1 | N5 | 178.8° | 180.0° |
| C16 | C15 | N5 | C12 | 179.3° | 174.7° |
| C15 | C16 | H8 | H9 | 115.7° | 120.0° |
| C15 | C16 | C17 | H12 | 180.0° | 180.0° |
| C15 | C16 | C17 | H13 | 60.0° | 60.0° |
| C15 | C16 | C17 | H14 | 60.0° | 60.0° |
| C16 | C15 | N5 | H32 | 0.7° | 5.3° |
| O1 | C15 | N5 | C12 | 0.5° | 5.3° |
| O1 | C15 | C16 | H8 | 47.8° | 120.1° |
| O1 | C15 | C16 | H9 | 165.1° | 120.0° |
| O1 | C15 | N5 | H32 | 179.5° | 174.7° |
| C15 | N5 | C12 | H32 | 180.0° | 180.0° |
| C15 | N5 | C12 | C11 | 44.5° | 33.5° |
| C15 | N5 | C12 | C13 | 136.3° | 146.4° |
| N5 | C15 | C16 | H8 | 131.0° | 60.0° |
| N5 | C15 | C16 | H9 | 13.7° | 60.0° |
| N5 | C12 | C11 | C13 | 179.2° | 179.9° |
| N5 | C12 | C11 | C8 | 179.7° | 180.0° |
| N5 | C12 | C13 | C14 | 179.3° | 180.0° |
| N5 | C12 | C13 | H6 | 0.7° | 0.1° |
| N5 | C12 | C11 | H7 | 0.3° | 0.0° |
| C12 | C11 | C8 | H7 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 1.5° | 0.1° |
| C12 | C11 | C8 | N4 | 179.1° | 180.0° |
| C12 | C11 | C8 | C9 | 0.4° | 0.0° |
| C11 | C12 | C13 | H6 | 178.5° | 180.0° |
| C11 | C12 | N5 | H32 | 135.5° | 146.5° |
| C13 | C12 | C11 | C8 | 1.1° | 0.1° |
| C12 | C13 | C14 | H6 | 180.0° | 179.9° |
| C12 | C13 | C14 | C9 | 1.1° | 0.1° |
| C13 | C12 | C11 | H7 | 178.9° | 180.0° |
| C12 | C13 | C14 | H10 | 178.9° | 180.0° |
| C13 | C12 | N5 | H32 | 43.7° | 33.6° |
| C11 | C8 | N4 | C10 | 0.3° | 0.1° |
| C11 | C8 | N4 | C9 | 179.6° | 180.0° |
| C11 | C8 | N4 | C7 | 179.6° | 180.0° |
| C11 | C8 | C9 | C14 | 0.0° | 0.0° |
| C11 | C8 | C9 | C5 | 178.5° | 179.8° |
| C13 | C14 | C9 | C8 | 0.3° | 0.0° |
| C13 | C14 | C9 | H10 | 180.0° | 179.9° |
| C13 | C14 | C9 | C5 | 177.4° | 179.8° |
| C10 | N4 | C8 | C7 | 180.0° | 179.9° |
| C10 | N4 | C8 | C9 | 179.3° | 180.0° |
| C10 | N4 | C7 | C5 | 179.1° | 179.8° |
| C10 | N4 | C7 | H2 | 0.9° | 0.1° |
| N4 | C10 | H3 | H4 | 120.0° | 120.1° |
| N4 | C10 | H3 | H5 | 120.0° | 119.9° |
| N4 | C10 | H4 | H5 | 120.0° | 120.1° |
| N4 | C8 | C9 | C14 | 179.7° | 180.0° |
| N4 | C8 | C9 | C5 | 1.8° | 0.1° |
| C8 | N4 | C7 | C5 | 0.9° | 0.2° |
| C8 | N4 | C7 | H2 | 179.1° | 179.9° |
| C8 | N4 | C10 | H3 | 180.0° | 90.0° |
| C8 | N4 | C10 | H4 | 60.0° | 150.0° |
| C8 | N4 | C10 | H5 | 60.0° | 29.9° |
| N4 | C8 | C11 | H7 | 0.9° | 0.0° |
| C9 | C8 | N4 | C7 | 0.8° | 0.0° |
| C8 | C9 | C14 | C5 | 177.7° | 179.8° |
| C8 | C9 | C5 | C7 | 2.5° | 0.3° |
| C8 | C9 | C5 | C2 | 178.1° | 180.0° |
| C9 | C8 | C11 | H7 | 179.6° | 180.0° |
| C8 | C9 | C14 | H10 | 179.7° | 180.0° |
| N4 | C7 | C5 | C9 | 2.1° | 0.3° |
| N4 | C7 | C5 | H2 | 180.0° | 179.9° |
| N4 | C7 | C5 | C2 | 177.9° | 180.0° |
| C7 | N4 | C10 | H3 | 0.0° | 90.1° |
| C7 | N4 | C10 | H4 | 120.0° | 30.0° |
| C7 | N4 | C10 | H5 | 120.0° | 150.1° |
| C14 | C9 | C5 | C7 | 179.6° | 179.9° |
| C14 | C9 | C5 | C2 | 4.0° | 0.2° |
| C9 | C14 | C13 | H6 | 178.9° | 180.0° |
| C9 | C5 | C7 | C2 | 175.8° | 179.7° |
| C9 | C5 | C2 | C3 | 25.3° | 179.7° |
| C9 | C5 | C2 | N2 | 157.9° | 0.3° |
| C9 | C5 | C7 | H2 | 177.9° | 179.8° |
| C5 | C9 | C14 | H10 | 2.6° | 0.2° |
| C7 | C5 | C2 | C3 | 149.8° | 0.0° |
| C7 | C5 | C2 | N2 | 27.0° | 180.0° |
| C5 | C2 | C3 | N2 | 176.8° | 180.0° |
| C5 | C2 | C3 | C4 | 178.5° | 180.0° |
| C5 | C2 | N2 | C1 | 178.6° | 180.0° |
| C2 | C5 | C7 | H2 | 2.1° | 0.0° |
| C5 | C2 | C3 | H11 | 1.5° | 0.1° |
| C2 | C3 | C4 | H11 | 180.0° | 179.9° |
| C3 | C2 | N2 | C1 | 1.8° | 0.0° |
| C2 | C3 | C4 | N1 | 0.8° | 0.0° |
| C2 | C3 | C4 | H1 | 179.2° | 179.9° |
| N2 | C2 | C3 | C4 | 1.7° | 0.0° |
| C2 | N2 | C1 | N1 | 0.9° | 0.0° |
| C2 | N2 | C1 | N3 | 180.0° | 180.0° |
| N2 | C2 | C3 | H11 | 178.2° | 179.9° |
| C3 | C4 | N1 | H1 | 180.0° | 179.9° |
| C3 | C4 | N1 | C1 | 0.1° | 0.0° |
| N2 | C1 | N1 | C4 | 0.0° | 0.0° |
| N2 | C1 | N1 | N3 | 179.2° | 180.0° |
| N2 | C1 | N3 | C6 | 9.7° | 180.0° |
| N2 | C1 | N3 | H31 | 170.2° | 0.1° |
| C4 | N1 | C1 | N3 | 179.1° | 180.0° |
| N1 | C4 | C3 | H11 | 179.2° | 179.9° |
| N7 | C19 | C6 | H15 | 180.0° | 179.8° |
| N7 | C19 | C6 | N3 | 180.0° | 180.0° |
| N7 | C19 | C6 | C18 | 0.5° | 0.3° |
| C19 | N7 | N6 | C18 | 1.4° | 0.1° |
| C19 | N7 | N6 | C20 | 179.9° | 179.9° |
| C6 | C19 | N7 | N6 | 1.1° | 0.2° |
| C19 | C6 | N3 | C1 | 5.7° | 0.3° |
| C19 | C6 | N3 | C18 | 179.4° | 179.7° |
| C19 | C6 | C18 | N6 | 0.4° | 0.2° |
| C19 | C6 | C18 | C21 | 180.0° | 179.7° |
| C19 | C6 | N3 | H31 | 174.3° | 179.6° |
| N7 | N6 | C18 | C6 | 1.1° | 0.1° |
| N7 | N6 | C18 | C20 | 178.6° | 179.9° |
| N7 | N6 | C18 | C21 | 179.3° | 179.8° |
| N7 | N6 | C20 | C22 | 70.4° | 89.9° |
| N6 | N7 | C19 | H15 | 178.9° | 180.0° |
| N7 | N6 | C20 | H16 | 50.0° | 150.1° |
| N7 | N6 | C20 | H17 | 169.2° | 30.2° |
| N1 | C1 | N3 | C6 | 171.1° | 0.0° |
| C1 | N1 | C4 | H1 | 179.9° | 179.9° |
| N1 | C1 | N3 | H31 | 9.0° | 179.9° |
| C1 | N3 | C6 | H31 | 180.0° | 179.9° |
| C1 | N3 | C6 | C18 | 173.8° | 180.0° |
| N3 | C6 | C18 | N6 | 179.2° | 180.0° |
| N3 | C6 | C18 | C21 | 0.4° | 0.0° |
| N3 | C6 | C19 | H15 | 0.0° | 0.2° |
| C6 | C18 | N6 | C21 | 179.6° | 179.9° |
| C6 | C18 | N6 | C20 | 179.7° | 180.0° |
| C18 | C6 | C19 | H15 | 179.5° | 179.9° |
| C6 | C18 | C21 | H18 | 89.7° | 90.0° |
| C6 | C18 | C21 | H19 | 150.3° | 150.0° |
| C6 | C18 | C21 | H20 | 30.3° | 30.1° |
| C18 | C6 | N3 | H31 | 6.2° | 0.1° |
| C18 | N6 | C20 | C22 | 111.2° | 90.0° |
| C18 | N6 | C20 | H16 | 128.4° | 30.0° |
| C18 | N6 | C20 | H17 | 9.1° | 149.9° |
| N6 | C18 | C21 | H18 | 89.8° | 89.9° |
| N6 | C18 | C21 | H19 | 30.2° | 30.1° |
| N6 | C18 | C21 | H20 | 150.2° | 150.0° |
| C20 | N6 | C18 | C21 | 0.7° | 0.1° |
| N6 | C20 | C22 | H16 | 120.4° | 120.0° |
| N6 | C20 | C22 | H17 | 120.3° | 120.1° |
| N6 | C20 | C22 | N8 | 177.1° | 180.0° |
| N6 | C20 | H16 | H17 | 118.9° | 120.0° |
| N6 | C20 | C22 | H21 | 56.8° | 59.9° |
| N6 | C20 | C22 | H22 | 62.5° | 60.0° |
| C18 | C21 | H18 | H19 | 120.0° | 120.0° |
| C18 | C21 | H18 | H20 | 120.0° | 120.0° |
| C18 | C21 | H19 | H20 | 120.0° | 119.9° |
| C20 | C22 | N8 | H21 | 120.4° | 120.0° |
| C20 | C22 | N8 | H22 | 120.4° | 120.0° |
| C20 | C22 | N8 | C23 | 46.6° | 170.0° |
| C20 | C22 | N8 | C26 | 83.5° | 66.4° |
| C22 | C20 | H16 | H17 | 118.9° | 120.0° |
| C20 | C22 | H21 | H22 | 118.9° | 120.0° |
| C22 | N8 | C23 | C26 | 127.6° | 123.8° |
| C22 | N8 | C23 | C24 | 131.7° | 177.6° |
| C22 | N8 | C26 | C25 | 81.5° | 177.6° |
| N8 | C22 | C20 | H16 | 62.5° | 60.0° |
| N8 | C22 | C20 | H17 | 56.8° | 59.9° |
| N8 | C22 | H21 | H22 | 118.9° | 120.0° |
| C22 | N8 | C23 | H23 | 107.2° | 62.5° |
| C22 | N8 | C23 | H24 | 10.5° | 57.7° |
| C22 | N8 | C26 | H29 | 38.6° | 57.7° |
| C22 | N8 | C26 | H30 | 158.3° | 62.5° |
| N8 | C23 | C24 | H23 | 121.2° | 120.0° |
| N8 | C23 | C24 | H24 | 121.2° | 119.9° |
| N8 | C23 | C24 | O2 | 44.8° | 56.9° |
| C23 | N8 | C26 | C25 | 46.4° | 58.6° |
| C23 | N8 | C22 | H21 | 167.0° | 50.0° |
| C23 | N8 | C22 | H22 | 73.8° | 70.0° |
| N8 | C23 | H23 | H24 | 116.3° | 120.1° |
| N8 | C23 | C24 | H25 | 75.6° | 176.8° |
| N8 | C23 | C24 | H26 | 165.2° | 63.1° |
| C23 | N8 | C26 | H29 | 166.5° | 178.5° |
| C23 | N8 | C26 | H30 | 73.8° | 61.3° |
| C24 | C23 | N8 | C26 | 4.1° | 58.7° |
| C23 | C24 | O2 | H25 | 120.4° | 119.9° |
| C23 | C24 | O2 | H26 | 120.4° | 119.9° |
| C23 | C24 | O2 | C25 | 26.7° | 58.7° |
| C24 | C23 | H23 | H24 | 116.3° | 120.1° |
| C23 | C24 | H25 | H26 | 118.8° | 120.1° |
| N8 | C26 | C25 | H29 | 120.2° | 119.9° |
| N8 | C26 | C25 | H30 | 120.2° | 120.0° |
| N8 | C26 | C25 | O2 | 62.6° | 56.8° |
| C26 | N8 | C22 | H21 | 36.9° | 173.6° |
| C26 | N8 | C22 | H22 | 156.2° | 53.7° |
| C26 | N8 | C23 | H23 | 125.3° | 61.3° |
| C26 | N8 | C23 | H24 | 117.1° | 178.6° |
| N8 | C26 | C25 | H27 | 57.8° | 63.1° |
| N8 | C26 | C25 | H28 | 176.9° | 176.8° |
| N8 | C26 | H29 | H30 | 119.5° | 120.2° |
| C24 | O2 | C25 | C26 | 20.5° | 58.7° |
| O2 | C24 | C23 | H23 | 166.0° | 63.1° |
| O2 | C24 | C23 | H24 | 76.4° | 176.8° |
| O2 | C24 | H25 | H26 | 118.8° | 120.1° |
| C24 | O2 | C25 | H27 | 99.9° | 61.3° |
| C24 | O2 | C25 | H28 | 141.0° | 178.7° |
| C26 | C25 | O2 | H27 | 120.4° | 120.0° |
| C26 | C25 | O2 | H28 | 120.5° | 120.0° |
| C26 | C25 | H27 | H28 | 118.6° | 120.1° |
| C25 | C26 | H29 | H30 | 119.5° | 120.1° |
| C25 | O2 | C24 | H25 | 93.7° | 178.5° |
| C25 | O2 | C24 | H26 | 147.1° | 61.3° |
| O2 | C25 | H27 | H28 | 118.6° | 120.1° |
| O2 | C25 | C26 | H29 | 177.2° | 176.8° |
| O2 | C25 | C26 | H30 | 57.5° | 63.1° |
| H1 | C4 | C3 | H11 | 0.8° | 0.0° |
| H3 | C10 | H4 | H5 | 120.0° | 119.9° |
| H6 | C13 | C14 | H10 | 1.1° | 0.1° |
| H8 | C16 | C17 | H12 | 58.7° | 59.9° |
| H8 | C16 | C17 | H13 | 61.3° | 180.0° |
| H8 | C16 | C17 | H14 | 178.7° | 60.1° |
| H9 | C16 | C17 | H12 | 58.7° | 60.0° |
| H9 | C16 | C17 | H13 | 178.7° | 60.1° |
| H9 | C16 | C17 | H14 | 61.3° | 180.0° |
| H12 | C17 | H13 | H14 | 119.9° | 120.1° |
| H16 | C20 | C22 | H21 | 177.1° | 60.1° |
| H16 | C20 | C22 | H22 | 57.9° | 180.0° |
| H17 | C20 | C22 | H21 | 63.6° | 180.0° |
| H17 | C20 | C22 | H22 | 177.1° | 60.1° |
| H18 | C21 | H19 | H20 | 120.0° | 120.0° |
| H23 | C23 | C24 | H25 | 45.6° | 56.8° |
| H23 | C23 | C24 | H26 | 73.6° | 176.9° |
| H24 | C23 | C24 | H25 | 163.2° | 63.3° |
| H24 | C23 | C24 | H26 | 44.0° | 56.8° |
| H27 | C25 | C26 | H29 | 62.3° | 56.8° |
| H27 | C25 | C26 | H30 | 178.0° | 176.9° |
| H28 | C25 | C26 | H29 | 56.8° | 63.2° |
| H28 | C25 | C26 | H30 | 62.9° | 56.8° |
