A1LWS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C25 | C23 | sing | 1.53Å | 1.51Å | |
| C23 | C19 | sing | 1.53Å | 1.53Å | |
| C23 | O36 | sing | 1.43Å | 1.44Å | |
| C19 | N31 | sing | 1.47Å | 1.46Å | |
| O36 | C24 | sing | 1.43Å | 1.43Å | |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| N31 | C9 | sing | 1.40Å | 1.41Å | |
| N31 | C20 | sing | 1.47Å | 1.46Å | |
| C24 | C26 | sing | 1.53Å | 1.50Å | |
| C24 | C20 | sing | 1.53Å | 1.52Å | |
| C2 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C17 | C15 | sing | 1.53Å | 1.52Å | |
| C17 | C21 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C4 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C10 | sing | 1.39Å | 1.38Å | Aromatic |
| C10 | N33 | sing | 1.40Å | 1.40Å | |
| C16 | C18 | sing | 1.53Å | 1.53Å | |
| C21 | N32 | sing | 1.47Å | 1.47Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| N33 | C12 | sing | 1.38Å | 1.39Å | |
| C22 | C18 | sing | 1.53Å | 1.54Å | |
| C22 | N34 | sing | 1.46Å | 1.49Å | |
| N28 | C12 | doub | 1.32Å | 1.34Å | Aromatic |
| N28 | C11 | sing | 1.32Å | 1.36Å | Aromatic |
| C12 | C8 | sing | 1.41Å | 1.39Å | Aromatic |
| N34 | C11 | sing | 1.38Å | 1.41Å | |
| O35 | C14 | doub | 1.22Å | 1.24Å | |
| C11 | C6 | doub | 1.41Å | 1.38Å | Aromatic |
| C8 | C14 | sing | 1.46Å | 1.48Å | |
| C8 | C7 | doub | 1.41Å | 1.38Å | Aromatic |
| C14 | N30 | sing | 1.35Å | 1.37Å | |
| C6 | C7 | sing | 1.41Å | 1.39Å | Aromatic |
| C6 | C1 | sing | 1.43Å | 1.42Å | |
| C7 | C13 | sing | 1.46Å | 1.47Å | |
| N30 | N29 | sing | 1.40Å | 1.36Å | |
| C1 | N27 | trip | 1.14Å | 1.16Å | |
| C13 | N29 | doub | 1.30Å | 1.29Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| N30 | H28 | sing | 0.97Å | 1.00Å | |
| N32 | H29 | sing | 1.01Å | 1.00Å | |
| N32 | H30 | sing | 1.01Å | 1.00Å | |
| N33 | H32 | sing | 0.97Å | 1.00Å | |
| N34 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C23 | C19 | 109.3° | 109.6° |
| C25 | C23 | O36 | 111.1° | 109.5° |
| C25 | C23 | H20 | 108.9° | 109.5° |
| C23 | C25 | H22 | 109.5° | 109.5° |
| C23 | C25 | H23 | 109.5° | 109.5° |
| C23 | C25 | H24 | 109.5° | 109.4° |
| C19 | C23 | O36 | 109.1° | 109.3° |
| C23 | C19 | N31 | 110.2° | 109.3° |
| C23 | C19 | H14 | 109.3° | 109.5° |
| C23 | C19 | H15 | 109.3° | 109.5° |
| C19 | C23 | H20 | 108.6° | 109.5° |
| C23 | O36 | C24 | 102.5° | 113.7° |
| O36 | C23 | H20 | 109.8° | 109.5° |
| C19 | N31 | C9 | 117.0° | 111.0° |
| C19 | N31 | C20 | 121.2° | 110.8° |
| N31 | C19 | H14 | 109.3° | 109.5° |
| N31 | C19 | H15 | 109.3° | 109.5° |
| O36 | C24 | C26 | 112.1° | 109.5° |
| O36 | C24 | C20 | 106.5° | 109.3° |
| O36 | C24 | H21 | 109.1° | 109.6° |
| C2 | C3 | C9 | 119.6° | 120.1° |
| C3 | C2 | C4 | 120.9° | 120.2° |
| C2 | C3 | H3 | 120.2° | 120.0° |
| C3 | C2 | H4 | 119.5° | 119.9° |
| C3 | C9 | N31 | 123.2° | 120.1° |
| C3 | C9 | C5 | 118.8° | 119.9° |
| C9 | C3 | H3 | 120.2° | 119.9° |
| C9 | N31 | C20 | 116.6° | 111.0° |
| N31 | C9 | C5 | 118.0° | 120.0° |
| N31 | C20 | C24 | 106.8° | 109.3° |
| N31 | C20 | H16 | 110.1° | 109.5° |
| N31 | C20 | H17 | 110.1° | 109.5° |
| C26 | C24 | C20 | 113.1° | 109.5° |
| C26 | C24 | H21 | 108.1° | 109.5° |
| C24 | C26 | H25 | 109.5° | 109.5° |
| C24 | C26 | H26 | 109.5° | 109.4° |
| C24 | C26 | H27 | 109.4° | 109.5° |
| C24 | C20 | H16 | 110.1° | 109.5° |
| C24 | C20 | H17 | 110.1° | 109.5° |
| C20 | C24 | H21 | 107.8° | 109.5° |
| C2 | C4 | C10 | 119.5° | 120.1° |
| C2 | C4 | H1 | 120.3° | 120.0° |
| C4 | C2 | H4 | 119.5° | 119.9° |
| C9 | C5 | C10 | 122.2° | 119.9° |
| C9 | C5 | H2 | 118.9° | 120.0° |
| C15 | C17 | C21 | 112.5° | 109.5° |
| C17 | C15 | C16 | 110.3° | 109.5° |
| C17 | C15 | H6 | 109.3° | 109.5° |
| C17 | C15 | H7 | 109.3° | 109.5° |
| C15 | C17 | H10 | 108.7° | 109.5° |
| C15 | C17 | H11 | 108.7° | 109.5° |
| C17 | C21 | N32 | 109.9° | 109.5° |
| C17 | C21 | C22 | 110.0° | 109.5° |
| C21 | C17 | H10 | 108.7° | 109.4° |
| C21 | C17 | H11 | 108.7° | 109.4° |
| C17 | C21 | H18 | 107.8° | 109.5° |
| C15 | C16 | C18 | 110.8° | 109.5° |
| C16 | C15 | H6 | 109.3° | 109.4° |
| C16 | C15 | H7 | 109.3° | 109.4° |
| C15 | C16 | H8 | 109.1° | 109.5° |
| C15 | C16 | H9 | 109.1° | 109.5° |
| C4 | C10 | C5 | 119.0° | 119.9° |
| C4 | C10 | N33 | 126.6° | 120.0° |
| C10 | C4 | H1 | 120.3° | 120.0° |
| C5 | C10 | N33 | 114.4° | 120.1° |
| C10 | C5 | H2 | 118.9° | 120.1° |
| C10 | N33 | C12 | 127.2° | 120.0° |
| C10 | N33 | H32 | 116.4° | 120.0° |
| C16 | C18 | C22 | 114.4° | 109.5° |
| C18 | C16 | H8 | 109.2° | 109.4° |
| C18 | C16 | H9 | 109.1° | 109.4° |
| C16 | C18 | H12 | 108.2° | 109.5° |
| C16 | C18 | H13 | 108.2° | 109.5° |
| N32 | C21 | C22 | 112.8° | 109.5° |
| N32 | C21 | H18 | 108.4° | 109.5° |
| C21 | N32 | H29 | 109.5° | 111.1° |
| C21 | N32 | H30 | 109.5° | 111.0° |
| C21 | C22 | C18 | 108.6° | 109.5° |
| C21 | C22 | N34 | 111.9° | 109.4° |
| C22 | C21 | H18 | 107.8° | 109.4° |
| C21 | C22 | H19 | 108.9° | 109.5° |
| N33 | C12 | N28 | 118.8° | 119.9° |
| N33 | C12 | C8 | 118.7° | 119.8° |
| C12 | N33 | H32 | 116.4° | 120.0° |
| C18 | C22 | N34 | 109.5° | 109.5° |
| C22 | C18 | H12 | 108.2° | 109.5° |
| C22 | C18 | H13 | 108.3° | 109.4° |
| C18 | C22 | H19 | 108.6° | 109.5° |
| C22 | N34 | C11 | 114.8° | 120.0° |
| N34 | C22 | H19 | 109.3° | 109.5° |
| C22 | N34 | H33 | 108.1° | 120.0° |
| C12 | N28 | C11 | 119.1° | 122.6° |
| N28 | C12 | C8 | 122.4° | 120.3° |
| N28 | C11 | N34 | 121.2° | 119.4° |
| N28 | C11 | C6 | 121.6° | 121.2° |
| C12 | C8 | C14 | 123.6° | 122.6° |
| C12 | C8 | C7 | 118.1° | 119.2° |
| N34 | C11 | C6 | 117.1° | 119.4° |
| C11 | N34 | H33 | 108.1° | 120.0° |
| O35 | C14 | C8 | 122.7° | 120.6° |
| O35 | C14 | N30 | 123.5° | 120.6° |
| C11 | C6 | C7 | 118.6° | 118.3° |
| C11 | C6 | C1 | 123.4° | 120.9° |
| C14 | C8 | C7 | 118.3° | 118.2° |
| C8 | C14 | N30 | 113.8° | 118.8° |
| C8 | C7 | C6 | 120.1° | 118.4° |
| C8 | C7 | C13 | 120.3° | 118.9° |
| C14 | N30 | N29 | 128.5° | 121.8° |
| C14 | N30 | H28 | 115.7° | 119.1° |
| C7 | C6 | C1 | 117.9° | 120.9° |
| C6 | C7 | C13 | 119.5° | 122.7° |
| C6 | C1 | N27 | 176.0° | 179.9° |
| C7 | C13 | N29 | 120.8° | 119.8° |
| C7 | C13 | H5 | 119.6° | 120.1° |
| N30 | N29 | C13 | 118.2° | 122.6° |
| N29 | N30 | H28 | 115.8° | 119.1° |
| N29 | C13 | H5 | 119.6° | 120.1° |
| H6 | C15 | H7 | 109.5° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.4° |
| H10 | C17 | H11 | 109.5° | 109.5° |
| H12 | C18 | H13 | 109.5° | 109.4° |
| H14 | C19 | H15 | 109.5° | 109.5° |
| H16 | C20 | H17 | 109.4° | 109.5° |
| H22 | C25 | H23 | 109.5° | 109.4° |
| H22 | C25 | H24 | 109.4° | 109.4° |
| H23 | C25 | H24 | 109.5° | 109.5° |
| H25 | C26 | H26 | 109.5° | 109.5° |
| H25 | C26 | H27 | 109.5° | 109.5° |
| H26 | C26 | H27 | 109.5° | 109.4° |
| H29 | N32 | H30 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C23 | C19 | O36 | 121.6° | 120.0° |
| C25 | C23 | C19 | H20 | 118.7° | 120.1° |
| C25 | C23 | O36 | H20 | 120.5° | 120.1° |
| C25 | C23 | C19 | N31 | 169.4° | 176.8° |
| C25 | C23 | O36 | C24 | 166.9° | 178.7° |
| C25 | C23 | C19 | H14 | 49.3° | 56.8° |
| C25 | C23 | C19 | H15 | 70.5° | 63.2° |
| C23 | C25 | H22 | H23 | 120.0° | 120.1° |
| C23 | C25 | H22 | H24 | 120.0° | 119.9° |
| C23 | C25 | H23 | H24 | 120.0° | 120.0° |
| C19 | C23 | O36 | H20 | 119.0° | 119.9° |
| C23 | C19 | N31 | H14 | 120.1° | 119.9° |
| C23 | C19 | N31 | H15 | 120.1° | 120.0° |
| C19 | C23 | O36 | C24 | 72.6° | 58.7° |
| C23 | C19 | N31 | C9 | 173.8° | 177.6° |
| C23 | C19 | N31 | C20 | 32.6° | 58.6° |
| C23 | C19 | H14 | H15 | 119.7° | 120.1° |
| C19 | C23 | C25 | H22 | 180.0° | 60.0° |
| C19 | C23 | C25 | H23 | 60.0° | 180.0° |
| C19 | C23 | C25 | H24 | 60.0° | 59.9° |
| O36 | C23 | C19 | N31 | 47.8° | 56.8° |
| C23 | O36 | C24 | C26 | 155.9° | 178.6° |
| C23 | O36 | C24 | C20 | 79.8° | 58.7° |
| O36 | C23 | C19 | H14 | 72.3° | 63.1° |
| O36 | C23 | C19 | H15 | 167.9° | 176.8° |
| C23 | O36 | C24 | H21 | 36.3° | 61.3° |
| O36 | C23 | C25 | H22 | 59.5° | 59.8° |
| O36 | C23 | C25 | H23 | 179.6° | 60.2° |
| O36 | C23 | C25 | H24 | 60.4° | 179.7° |
| C19 | N31 | C9 | C3 | 11.0° | 0.0° |
| C19 | N31 | C9 | C20 | 154.8° | 123.7° |
| C19 | N31 | C20 | C24 | 38.4° | 58.6° |
| C19 | N31 | C9 | C5 | 170.7° | 179.3° |
| N31 | C19 | H14 | H15 | 119.7° | 120.2° |
| C19 | N31 | C20 | H16 | 81.2° | 178.6° |
| C19 | N31 | C20 | H17 | 158.0° | 61.3° |
| N31 | C19 | C23 | H20 | 71.9° | 63.1° |
| O36 | C24 | C20 | N31 | 60.7° | 56.9° |
| O36 | C24 | C26 | C20 | 120.4° | 119.8° |
| O36 | C24 | C26 | H21 | 120.2° | 120.1° |
| O36 | C24 | C20 | H21 | 116.9° | 120.0° |
| O36 | C24 | C20 | H16 | 58.9° | 176.8° |
| O36 | C24 | C20 | H17 | 179.7° | 63.1° |
| C24 | O36 | C23 | H20 | 46.4° | 61.2° |
| O36 | C24 | C26 | H25 | 180.0° | 179.8° |
| O36 | C24 | C26 | H26 | 60.0° | 60.2° |
| O36 | C24 | C26 | H27 | 60.0° | 59.7° |
| C2 | C3 | C9 | H3 | 180.0° | 179.6° |
| C2 | C3 | C9 | N31 | 178.1° | 180.0° |
| C3 | C2 | C4 | H4 | 180.0° | 179.9° |
| C2 | C3 | C9 | C5 | 0.2° | 0.7° |
| C3 | C2 | C4 | C10 | 0.6° | 0.0° |
| C3 | C2 | C4 | H1 | 179.4° | 179.8° |
| C3 | C9 | N31 | C5 | 178.3° | 179.2° |
| C3 | C9 | N31 | C20 | 165.8° | 123.7° |
| C9 | C3 | C2 | C4 | 1.0° | 0.5° |
| C3 | C9 | C5 | C10 | 0.9° | 0.5° |
| C3 | C9 | C5 | H2 | 179.1° | 179.6° |
| C9 | C3 | C2 | H4 | 179.0° | 179.6° |
| C9 | N31 | C20 | C24 | 167.9° | 177.6° |
| N31 | C9 | C5 | C10 | 179.3° | 179.7° |
| N31 | C9 | C5 | H2 | 0.7° | 0.3° |
| N31 | C9 | C3 | H3 | 1.9° | 0.5° |
| C9 | N31 | C19 | H14 | 66.1° | 62.5° |
| C9 | N31 | C19 | H15 | 53.7° | 57.6° |
| C9 | N31 | C20 | H16 | 72.5° | 57.6° |
| C9 | N31 | C20 | H17 | 48.3° | 62.4° |
| N31 | C20 | C24 | C26 | 175.7° | 176.8° |
| N31 | C20 | C24 | H16 | 119.6° | 119.9° |
| N31 | C20 | C24 | H17 | 119.6° | 120.0° |
| C20 | N31 | C9 | C5 | 15.8° | 55.6° |
| C20 | N31 | C19 | H14 | 87.4° | 61.3° |
| C20 | N31 | C19 | H15 | 152.7° | 178.6° |
| N31 | C20 | H16 | H17 | 121.2° | 120.1° |
| N31 | C20 | C24 | H21 | 56.3° | 63.2° |
| C26 | C24 | C20 | H21 | 119.5° | 120.1° |
| C26 | C24 | C20 | H16 | 64.7° | 63.3° |
| C26 | C24 | C20 | H17 | 56.1° | 56.8° |
| C24 | C26 | H25 | H26 | 120.0° | 120.0° |
| C24 | C26 | H25 | H27 | 120.0° | 120.1° |
| C24 | C26 | H26 | H27 | 120.0° | 119.9° |
| C24 | C20 | H16 | H17 | 121.2° | 120.1° |
| C20 | C24 | C26 | H25 | 59.5° | 60.0° |
| C20 | C24 | C26 | H26 | 179.6° | 180.0° |
| C20 | C24 | C26 | H27 | 60.5° | 60.1° |
| C2 | C4 | C10 | H1 | 180.0° | 179.8° |
| C2 | C4 | C10 | C5 | 0.5° | 0.2° |
| C2 | C4 | C10 | N33 | 179.5° | 179.7° |
| C4 | C2 | C3 | H3 | 179.0° | 180.0° |
| C9 | C5 | C10 | C4 | 1.3° | 0.0° |
| C9 | C5 | C10 | H2 | 180.0° | 179.9° |
| C9 | C5 | C10 | N33 | 178.7° | 179.9° |
| C5 | C9 | C3 | H3 | 179.8° | 179.7° |
| C15 | C17 | C21 | H10 | 120.4° | 120.0° |
| C15 | C17 | C21 | H11 | 120.5° | 120.0° |
| C17 | C15 | C16 | H6 | 120.1° | 120.0° |
| C17 | C15 | C16 | H7 | 120.1° | 120.0° |
| C17 | C15 | C16 | C18 | 51.9° | 60.0° |
| C15 | C17 | C21 | N32 | 64.3° | 180.0° |
| C15 | C17 | C21 | C22 | 60.5° | 60.0° |
| C17 | C15 | H6 | H7 | 119.7° | 120.1° |
| C17 | C15 | C16 | H8 | 68.3° | 180.0° |
| C17 | C15 | C16 | H9 | 172.1° | 60.0° |
| C15 | C17 | H10 | H11 | 118.6° | 120.0° |
| C15 | C17 | C21 | H18 | 177.7° | 60.0° |
| C21 | C17 | C15 | C16 | 57.4° | 60.0° |
| C17 | C21 | N32 | C22 | 123.2° | 120.0° |
| C17 | C21 | N32 | H18 | 117.6° | 120.0° |
| C17 | C21 | C22 | H18 | 117.3° | 120.0° |
| C17 | C21 | C22 | C18 | 56.8° | 60.0° |
| C17 | C21 | C22 | N34 | 177.7° | 60.0° |
| C21 | C17 | C15 | H6 | 177.5° | 180.0° |
| C21 | C17 | C15 | H7 | 62.7° | 59.9° |
| C21 | C17 | H10 | H11 | 118.6° | 120.0° |
| C17 | C21 | C22 | H19 | 61.3° | 180.0° |
| C17 | C21 | N32 | H29 | 180.0° | 60.0° |
| C17 | C21 | N32 | H30 | 60.0° | 176.0° |
| C15 | C16 | C18 | H8 | 120.2° | 120.0° |
| C15 | C16 | C18 | H9 | 120.2° | 120.0° |
| C15 | C16 | C18 | C22 | 52.9° | 60.0° |
| C16 | C15 | H6 | H7 | 119.6° | 119.9° |
| C15 | C16 | H8 | H9 | 119.4° | 120.1° |
| C16 | C15 | C17 | H10 | 177.9° | 60.0° |
| C16 | C15 | C17 | H11 | 63.0° | 180.0° |
| C15 | C16 | C18 | H12 | 173.6° | 60.0° |
| C15 | C16 | C18 | H13 | 67.9° | 180.0° |
| C4 | C10 | C5 | N33 | 179.9° | 179.9° |
| C4 | C10 | N33 | C12 | 14.4° | 31.5° |
| C4 | C10 | C5 | H2 | 178.7° | 180.0° |
| C10 | C4 | C2 | H4 | 179.4° | 180.0° |
| C4 | C10 | N33 | H32 | 165.6° | 148.5° |
| C5 | C10 | N33 | C12 | 165.7° | 148.4° |
| C5 | C10 | C4 | H1 | 179.4° | 180.0° |
| C5 | C10 | N33 | H32 | 14.3° | 31.6° |
| C10 | N33 | C12 | H32 | 180.0° | 180.0° |
| C10 | N33 | C12 | N28 | 3.0° | 5.8° |
| C10 | N33 | C12 | C8 | 176.6° | 174.3° |
| N33 | C10 | C4 | H1 | 0.5° | 0.1° |
| N33 | C10 | C5 | H2 | 1.3° | 0.1° |
| C16 | C18 | C22 | C21 | 54.8° | 60.0° |
| C16 | C18 | C22 | H12 | 120.7° | 120.1° |
| C16 | C18 | C22 | H13 | 120.7° | 120.0° |
| C16 | C18 | C22 | N34 | 177.3° | 60.0° |
| C18 | C16 | C15 | H6 | 172.1° | 180.0° |
| C18 | C16 | C15 | H7 | 68.2° | 60.0° |
| C18 | C16 | H8 | H9 | 119.4° | 119.9° |
| C16 | C18 | H12 | H13 | 117.7° | 120.0° |
| C16 | C18 | C22 | H19 | 63.5° | 180.0° |
| N32 | C21 | C22 | H18 | 119.6° | 120.0° |
| N32 | C21 | C22 | C18 | 66.3° | 180.0° |
| N32 | C21 | C22 | N34 | 54.6° | 60.0° |
| N32 | C21 | C17 | H10 | 56.1° | 60.0° |
| N32 | C21 | C17 | H11 | 175.2° | 60.0° |
| N32 | C21 | C22 | H19 | 175.5° | 60.0° |
| C21 | N32 | H29 | H30 | 120.0° | 124.0° |
| C21 | C22 | C18 | N34 | 122.4° | 119.9° |
| C21 | C22 | C18 | H19 | 118.3° | 120.0° |
| C21 | C22 | N34 | H19 | 120.7° | 119.9° |
| C21 | C22 | N34 | C11 | 85.7° | 155.0° |
| C22 | C21 | C17 | H10 | 179.1° | 60.0° |
| C22 | C21 | C17 | H11 | 60.0° | 180.0° |
| C21 | C22 | C18 | H12 | 175.5° | 60.1° |
| C21 | C22 | C18 | H13 | 65.9° | 180.0° |
| C22 | C21 | N32 | H29 | 56.8° | 180.0° |
| C22 | C21 | N32 | H30 | 63.2° | 56.0° |
| C21 | C22 | N34 | H33 | 153.5° | 25.1° |
| N33 | C12 | N28 | C8 | 179.6° | 179.9° |
| N33 | C12 | N28 | C11 | 179.5° | 179.7° |
| N33 | C12 | C8 | C14 | 0.1° | 0.1° |
| N33 | C12 | C8 | C7 | 179.4° | 180.0° |
| C18 | C22 | N34 | H19 | 118.9° | 120.1° |
| C18 | C22 | N34 | C11 | 153.8° | 85.0° |
| C22 | C18 | C16 | H8 | 67.3° | 179.9° |
| C22 | C18 | C16 | H9 | 173.1° | 60.0° |
| C22 | C18 | H12 | H13 | 117.8° | 119.9° |
| C18 | C22 | C21 | H18 | 174.1° | 60.0° |
| C18 | C22 | N34 | H33 | 33.1° | 94.9° |
| C22 | N34 | C11 | N28 | 1.7° | 0.1° |
| C22 | N34 | C11 | H33 | 120.8° | 179.9° |
| C22 | N34 | C11 | C6 | 178.1° | 180.0° |
| N34 | C22 | C18 | H12 | 62.0° | 180.0° |
| N34 | C22 | C18 | H13 | 56.5° | 60.1° |
| N34 | C22 | C21 | H18 | 65.0° | 180.0° |
| C12 | N28 | C11 | N34 | 179.5° | 179.6° |
| C12 | N28 | C11 | C6 | 0.2° | 0.3° |
| N28 | C12 | C8 | C14 | 179.5° | 180.0° |
| N28 | C12 | C8 | C7 | 0.2° | 0.1° |
| N28 | C12 | N33 | H32 | 177.0° | 174.2° |
| C11 | N28 | C12 | C8 | 0.1° | 0.4° |
| N28 | C11 | N34 | C6 | 179.8° | 179.9° |
| N28 | C11 | C6 | C7 | 0.4° | 0.0° |
| N28 | C11 | C6 | C1 | 178.3° | 180.0° |
| N28 | C11 | N34 | H33 | 119.1° | 180.0° |
| C12 | C8 | C14 | O35 | 0.3° | 0.0° |
| C12 | C8 | C14 | C7 | 179.2° | 179.9° |
| C12 | C8 | C14 | N30 | 178.9° | 180.0° |
| C12 | C8 | C7 | C6 | 0.4° | 0.2° |
| C12 | C8 | C7 | C13 | 179.3° | 180.0° |
| C8 | C12 | N33 | H32 | 3.3° | 5.7° |
| N34 | C11 | C6 | C7 | 179.3° | 179.9° |
| N34 | C11 | C6 | C1 | 1.5° | 0.0° |
| C11 | N34 | C22 | H19 | 34.9° | 35.1° |
| O35 | C14 | C8 | N30 | 179.2° | 180.0° |
| O35 | C14 | C8 | C7 | 179.0° | 180.0° |
| O35 | C14 | N30 | N29 | 177.2° | 179.7° |
| O35 | C14 | N30 | H28 | 2.8° | 0.1° |
| C11 | C6 | C7 | C8 | 0.5° | 0.2° |
| C11 | C6 | C7 | C1 | 178.0° | 180.0° |
| C11 | C6 | C7 | C13 | 179.2° | 180.0° |
| C11 | C6 | C1 | N27 | 124.8° | 15.5° |
| C6 | C11 | N34 | H33 | 61.2° | 0.1° |
| C14 | C8 | C7 | C6 | 179.7° | 179.8° |
| C14 | C8 | C7 | C13 | 0.0° | 0.0° |
| C8 | C14 | N30 | N29 | 3.6° | 0.2° |
| C8 | C14 | N30 | H28 | 176.4° | 180.0° |
| C7 | C8 | C14 | N30 | 1.8° | 0.1° |
| C8 | C7 | C6 | C13 | 179.7° | 179.8° |
| C8 | C7 | C6 | C1 | 178.5° | 179.7° |
| C8 | C7 | C13 | N29 | 0.6° | 0.3° |
| C8 | C7 | C13 | H5 | 179.4° | 179.8° |
| C14 | N30 | N29 | H28 | 180.0° | 179.8° |
| C14 | N30 | N29 | C13 | 3.1° | 0.6° |
| C7 | C6 | C1 | N27 | 53.0° | 164.6° |
| C6 | C7 | C13 | N29 | 179.7° | 179.9° |
| C6 | C7 | C13 | H5 | 0.3° | 0.0° |
| C1 | C6 | C7 | C13 | 1.2° | 0.1° |
| C7 | C13 | N29 | N30 | 0.7° | 0.6° |
| C7 | C13 | N29 | H5 | 180.0° | 179.9° |
| N30 | N29 | C13 | H5 | 179.2° | 179.5° |
| C13 | N29 | N30 | H28 | 176.9° | 179.6° |
| H1 | C4 | C2 | H4 | 0.6° | 0.2° |
| H3 | C3 | C2 | H4 | 1.0° | 0.0° |
| H6 | C15 | C16 | H8 | 51.9° | 60.0° |
| H6 | C15 | C16 | H9 | 67.8° | 60.0° |
| H6 | C15 | C17 | H10 | 62.1° | 60.0° |
| H6 | C15 | C17 | H11 | 57.1° | 60.1° |
| H7 | C15 | C16 | H8 | 171.6° | 60.0° |
| H7 | C15 | C16 | H9 | 52.0° | 180.0° |
| H7 | C15 | C17 | H10 | 57.7° | 179.9° |
| H7 | C15 | C17 | H11 | 176.9° | 60.0° |
| H8 | C16 | C18 | H12 | 53.4° | 60.0° |
| H8 | C16 | C18 | H13 | 172.0° | 59.9° |
| H9 | C16 | C18 | H12 | 66.2° | 179.9° |
| H9 | C16 | C18 | H13 | 52.3° | 60.0° |
| H10 | C17 | C21 | H18 | 61.8° | 180.0° |
| H11 | C17 | C21 | H18 | 57.3° | 60.0° |
| H12 | C18 | C22 | H19 | 57.3° | 59.9° |
| H13 | C18 | C22 | H19 | 175.8° | 60.0° |
| H14 | C19 | C23 | H20 | 168.0° | 177.0° |
| H15 | C19 | C23 | H20 | 48.2° | 56.9° |
| H16 | C20 | C24 | H21 | 175.9° | 56.8° |
| H17 | C20 | C24 | H21 | 63.3° | 176.9° |
| H18 | C21 | C22 | H19 | 55.9° | 60.0° |
| H18 | C21 | N32 | H29 | 62.4° | 60.0° |
| H18 | C21 | N32 | H30 | 177.5° | 64.0° |
| H19 | C22 | N34 | H33 | 85.8° | 145.0° |
| H20 | C23 | C25 | H22 | 61.5° | 179.9° |
| H20 | C23 | C25 | H23 | 58.5° | 59.9° |
| H20 | C23 | C25 | H24 | 178.5° | 60.2° |
| H21 | C24 | C26 | H25 | 59.8° | 60.1° |
| H21 | C24 | C26 | H26 | 60.2° | 59.9° |
| H21 | C24 | C26 | H27 | 179.8° | 179.9° |
| H22 | C25 | H23 | H24 | 119.9° | 119.9° |
| H25 | C26 | H26 | H27 | 120.0° | 120.0° |
