F65
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C25 | N3 | sing | 1.47Å | 1.48Å | |
| C26 | N3 | sing | 1.47Å | 1.47Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C24 | N3 | sing | 1.47Å | 1.47Å | |
| C24 | C23 | sing | 1.53Å | 1.51Å | |
| C22 | C27 | sing | 1.53Å | 1.51Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.50Å | |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.50Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| O3 | S | doub | 1.42Å | 1.42Å | |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C14 | S | sing | 1.76Å | 1.65Å | |
| S | O4 | doub | 1.42Å | 1.47Å | |
| S | N2 | sing | 1.66Å | 1.51Å | |
| N2 | C13 | sing | 1.40Å | 1.37Å | |
| C13 | C30 | doub | 1.38Å | 1.42Å | Aromatic |
| C13 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
| C30 | C3 | sing | 1.40Å | 1.36Å | Aromatic |
| O1 | C1 | sing | 1.45Å | 1.43Å | |
| O1 | C2 | sing | 1.35Å | 1.43Å | |
| C12 | N1 | sing | 1.44Å | 1.47Å | |
| C12 | C11 | sing | 1.54Å | 1.54Å | |
| N1 | C6 | sing | 1.39Å | 1.43Å | |
| N1 | C7 | sing | 1.48Å | 1.44Å | |
| C6 | C5 | doub | 1.39Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.47Å | 1.51Å | |
| C3 | C4 | doub | 1.40Å | 1.38Å | Aromatic |
| C2 | O2 | doub | 1.22Å | 1.23Å | |
| C11 | C10 | sing | 1.46Å | 1.55Å | |
| C7 | C8 | sing | 1.54Å | 1.53Å | |
| C5 | C4 | sing | 1.38Å | 1.41Å | Aromatic |
| C10 | C9 | sing | 1.55Å | 1.51Å | |
| C8 | C9 | sing | 1.51Å | 1.51Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| N2 | H15 | sing | 0.97Å | 1.00Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| C1 | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C15 | H21 | sing | 1.08Å | 1.08Å | |
| C16 | H22 | sing | 1.08Å | 1.08Å | |
| C28 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | H24 | sing | 1.08Å | 1.08Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C20 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H33 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C23 | H35 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C24 | H37 | sing | 1.09Å | 1.10Å | |
| C25 | H38 | sing | 1.09Å | 1.10Å | |
| C25 | H39 | sing | 1.09Å | 1.10Å | |
| C25 | H40 | sing | 1.09Å | 1.10Å | |
| C26 | H41 | sing | 1.09Å | 1.10Å | |
| C26 | H42 | sing | 1.09Å | 1.10Å | |
| C27 | H43 | sing | 1.09Å | 1.10Å | |
| C27 | H44 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | N3 | C26 | 113.8° | 111.0° |
| C25 | N3 | C24 | 111.2° | 111.1° |
| N3 | C25 | H38 | 109.5° | 109.4° |
| N3 | C25 | H39 | 109.4° | 109.5° |
| N3 | C25 | H40 | 109.4° | 109.4° |
| N3 | C26 | C27 | 111.2° | 109.6° |
| C26 | N3 | C24 | 112.9° | 111.2° |
| N3 | C26 | H41 | 109.0° | 109.5° |
| N3 | C26 | H42 | 109.0° | 109.4° |
| C26 | C27 | C22 | 111.8° | 109.3° |
| C27 | C26 | H41 | 109.0° | 109.5° |
| C27 | C26 | H42 | 109.1° | 109.5° |
| C26 | C27 | H43 | 108.9° | 109.6° |
| C26 | C27 | H44 | 108.8° | 109.5° |
| N3 | C24 | C23 | 112.8° | 109.6° |
| N3 | C24 | H36 | 108.6° | 109.4° |
| N3 | C24 | H37 | 108.6° | 109.5° |
| C24 | C23 | C22 | 110.2° | 109.3° |
| C24 | C23 | H34 | 109.3° | 109.5° |
| C24 | C23 | H35 | 109.3° | 109.6° |
| C23 | C24 | H36 | 108.6° | 109.5° |
| C23 | C24 | H37 | 108.6° | 109.5° |
| C27 | C22 | C23 | 110.0° | 109.2° |
| C27 | C22 | C21 | 110.2° | 109.5° |
| C27 | C22 | H33 | 109.4° | 109.5° |
| C22 | C27 | H43 | 108.9° | 109.5° |
| C22 | C27 | H44 | 108.9° | 109.5° |
| C23 | C22 | C21 | 108.6° | 109.5° |
| C23 | C22 | H33 | 109.2° | 109.5° |
| C22 | C23 | H34 | 109.3° | 109.5° |
| C22 | C23 | H35 | 109.3° | 109.5° |
| C22 | C21 | C20 | 111.0° | 109.5° |
| C22 | C21 | H31 | 109.1° | 109.5° |
| C22 | C21 | H32 | 109.1° | 109.4° |
| C21 | C22 | H33 | 109.4° | 109.5° |
| C21 | C20 | C19 | 109.8° | 109.5° |
| C21 | C20 | H29 | 109.4° | 109.4° |
| C21 | C20 | H30 | 109.4° | 109.4° |
| C20 | C21 | H31 | 109.1° | 109.5° |
| C20 | C21 | H32 | 109.1° | 109.5° |
| C20 | C19 | C18 | 108.6° | 109.5° |
| C20 | C19 | H27 | 109.7° | 109.5° |
| C20 | C19 | H28 | 109.7° | 109.5° |
| C19 | C20 | H29 | 109.4° | 109.5° |
| C19 | C20 | H30 | 109.4° | 109.5° |
| C19 | C18 | C17 | 112.8° | 109.5° |
| C19 | C18 | H25 | 108.6° | 109.4° |
| C19 | C18 | H26 | 108.6° | 109.4° |
| C18 | C19 | H27 | 109.7° | 109.4° |
| C18 | C19 | H28 | 109.7° | 109.5° |
| C18 | C17 | C16 | 119.3° | 120.0° |
| C18 | C17 | C28 | 119.8° | 120.1° |
| C17 | C18 | H25 | 108.6° | 109.4° |
| C17 | C18 | H26 | 108.6° | 109.5° |
| C16 | C17 | C28 | 120.9° | 120.0° |
| C17 | C16 | C15 | 119.8° | 120.0° |
| C17 | C16 | H22 | 120.1° | 120.0° |
| C17 | C28 | C29 | 119.0° | 120.0° |
| C17 | C28 | H23 | 120.5° | 119.9° |
| C16 | C15 | C14 | 120.4° | 120.0° |
| C16 | C15 | H21 | 119.8° | 120.1° |
| C15 | C16 | H22 | 120.1° | 119.9° |
| C28 | C29 | C14 | 120.8° | 120.0° |
| C29 | C28 | H23 | 120.5° | 120.0° |
| C28 | C29 | H24 | 119.6° | 120.0° |
| O3 | S | C14 | 119.7° | 106.4° |
| O3 | S | O4 | 108.7° | 123.2° |
| O3 | S | N2 | 123.6° | 106.4° |
| C15 | C14 | C29 | 119.0° | 120.0° |
| C15 | C14 | S | 119.4° | 120.0° |
| C14 | C15 | H21 | 119.8° | 120.0° |
| C29 | C14 | S | 121.3° | 120.0° |
| C14 | C29 | H24 | 119.6° | 120.0° |
| C14 | S | O4 | 99.3° | 106.4° |
| C14 | S | N2 | 111.2° | 107.2° |
| O4 | S | N2 | 84.3° | 106.4° |
| S | N2 | C13 | 137.6° | 120.0° |
| S | N2 | H15 | 102.1° | 120.0° |
| N2 | C13 | C30 | 125.5° | 120.0° |
| N2 | C13 | C6 | 113.8° | 120.0° |
| C13 | N2 | H15 | 102.0° | 120.0° |
| C30 | C13 | C6 | 120.3° | 120.0° |
| C13 | C30 | C3 | 122.5° | 119.8° |
| C13 | C30 | H20 | 118.8° | 120.0° |
| C13 | C6 | N1 | 121.5° | 120.0° |
| C13 | C6 | C5 | 116.3° | 120.1° |
| C30 | C3 | C2 | 120.1° | 120.0° |
| C30 | C3 | C4 | 118.2° | 120.0° |
| C3 | C30 | H20 | 118.8° | 120.2° |
| C1 | O1 | C2 | 116.5° | 117.0° |
| O1 | C1 | H17 | 109.5° | 109.5° |
| O1 | C1 | H18 | 109.4° | 109.5° |
| O1 | C1 | H19 | 109.5° | 109.5° |
| O1 | C2 | C3 | 117.1° | 120.0° |
| O1 | C2 | O2 | 118.3° | 120.0° |
| N1 | C12 | C11 | 111.7° | 108.3° |
| C12 | N1 | C6 | 120.4° | 111.0° |
| C12 | N1 | C7 | 120.8° | 113.7° |
| N1 | C12 | H13 | 108.9° | 109.7° |
| N1 | C12 | H14 | 108.9° | 109.7° |
| C12 | C11 | C10 | 117.8° | 112.7° |
| C12 | C11 | H3 | 107.3° | 108.8° |
| C12 | C11 | H4 | 107.3° | 108.8° |
| C11 | C12 | H13 | 108.9° | 109.7° |
| C11 | C12 | H14 | 108.9° | 109.7° |
| C6 | N1 | C7 | 118.8° | 111.0° |
| N1 | C6 | C5 | 122.2° | 119.9° |
| N1 | C7 | C8 | 107.7° | 113.3° |
| N1 | C7 | H5 | 109.9° | 108.7° |
| N1 | C7 | H6 | 109.9° | 108.6° |
| C6 | C5 | C4 | 122.3° | 120.1° |
| C6 | C5 | H2 | 118.8° | 120.0° |
| C2 | C3 | C4 | 121.4° | 120.0° |
| C3 | C2 | O2 | 124.5° | 120.0° |
| C3 | C4 | C5 | 120.2° | 120.1° |
| C3 | C4 | H1 | 119.9° | 120.0° |
| C11 | C10 | C9 | 115.5° | 111.7° |
| C10 | C11 | H3 | 107.4° | 108.9° |
| C10 | C11 | H4 | 107.3° | 108.9° |
| C11 | C10 | H11 | 107.9° | 109.1° |
| C11 | C10 | H12 | 107.9° | 109.1° |
| C7 | C8 | C9 | 116.8° | 112.9° |
| C8 | C7 | H5 | 109.9° | 108.7° |
| C8 | C7 | H6 | 109.9° | 108.7° |
| C7 | C8 | H7 | 107.6° | 108.8° |
| C7 | C8 | H8 | 107.6° | 108.8° |
| C5 | C4 | H1 | 119.9° | 119.9° |
| C4 | C5 | H2 | 118.8° | 120.0° |
| C10 | C9 | C8 | 111.2° | 108.9° |
| C10 | C9 | H9 | 109.0° | 109.6° |
| C10 | C9 | H10 | 109.0° | 109.7° |
| C9 | C10 | H11 | 108.0° | 109.0° |
| C9 | C10 | H12 | 108.0° | 109.0° |
| C9 | C8 | H7 | 107.6° | 108.8° |
| C9 | C8 | H8 | 107.6° | 108.8° |
| C8 | C9 | H9 | 109.0° | 109.6° |
| C8 | C9 | H10 | 109.0° | 109.6° |
| H3 | C11 | H4 | 109.5° | 108.7° |
| H5 | C7 | H6 | 109.5° | 108.6° |
| H7 | C8 | H8 | 109.5° | 108.7° |
| H9 | C9 | H10 | 109.5° | 109.6° |
| H11 | C10 | H12 | 109.5° | 108.9° |
| H13 | C12 | H14 | 109.5° | 109.7° |
| H17 | C1 | H18 | 109.5° | 109.5° |
| H17 | C1 | H19 | 109.5° | 109.4° |
| H18 | C1 | H19 | 109.5° | 109.5° |
| H25 | C18 | H26 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.5° | 109.5° |
| H29 | C20 | H30 | 109.4° | 109.5° |
| H31 | C21 | H32 | 109.5° | 109.5° |
| H34 | C23 | H35 | 109.4° | 109.4° |
| H36 | C24 | H37 | 109.5° | 109.4° |
| H38 | C25 | H39 | 109.5° | 109.5° |
| H38 | C25 | H40 | 109.5° | 109.5° |
| H39 | C25 | H40 | 109.5° | 109.5° |
| H41 | C26 | H42 | 109.5° | 109.4° |
| H43 | C27 | H44 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | N3 | C26 | C24 | 128.0° | 124.2° |
| C25 | N3 | C26 | C27 | 179.4° | 174.2° |
| C25 | N3 | C24 | C23 | 175.7° | 174.2° |
| C25 | N3 | C24 | H36 | 63.8° | 65.8° |
| C25 | N3 | C24 | H37 | 55.2° | 54.1° |
| N3 | C25 | H38 | H39 | 120.0° | 120.0° |
| N3 | C25 | H38 | H40 | 120.0° | 120.0° |
| N3 | C25 | H39 | H40 | 119.9° | 120.0° |
| C25 | N3 | C26 | H41 | 59.1° | 54.0° |
| C25 | N3 | C26 | H42 | 60.3° | 65.8° |
| N3 | C26 | C27 | H41 | 120.3° | 120.1° |
| N3 | C26 | C27 | H42 | 120.3° | 120.0° |
| C26 | N3 | C24 | C23 | 55.0° | 61.7° |
| N3 | C26 | C27 | C22 | 53.6° | 59.1° |
| C26 | N3 | C24 | H36 | 65.5° | 58.4° |
| C26 | N3 | C24 | H37 | 175.5° | 178.2° |
| C26 | N3 | C25 | H38 | 180.0° | 64.3° |
| C26 | N3 | C25 | H39 | 60.0° | 55.7° |
| C26 | N3 | C25 | H40 | 60.0° | 175.8° |
| N3 | C26 | H41 | H42 | 119.2° | 119.9° |
| N3 | C26 | C27 | H43 | 66.8° | 179.1° |
| N3 | C26 | C27 | H44 | 173.9° | 60.8° |
| C27 | C26 | N3 | C24 | 52.6° | 61.7° |
| C26 | C27 | C22 | H43 | 120.4° | 120.0° |
| C26 | C27 | C22 | H44 | 120.3° | 119.9° |
| C26 | C27 | C22 | C23 | 55.2° | 57.6° |
| C26 | C27 | C22 | C21 | 175.0° | 177.6° |
| C26 | C27 | C22 | H33 | 64.6° | 62.3° |
| C27 | C26 | H41 | H42 | 119.2° | 119.9° |
| C26 | C27 | H43 | H44 | 118.9° | 120.1° |
| N3 | C24 | C23 | H36 | 120.5° | 120.0° |
| N3 | C24 | C23 | H37 | 120.5° | 120.1° |
| N3 | C24 | C23 | C22 | 55.9° | 59.2° |
| N3 | C24 | C23 | H34 | 176.0° | 60.8° |
| N3 | C24 | C23 | H35 | 64.3° | 179.2° |
| N3 | C24 | H36 | H37 | 118.5° | 119.9° |
| C24 | N3 | C25 | H38 | 51.1° | 60.0° |
| C24 | N3 | C25 | H39 | 68.9° | 180.0° |
| C24 | N3 | C25 | H40 | 171.2° | 60.0° |
| C24 | N3 | C26 | H41 | 172.9° | 178.2° |
| C24 | N3 | C26 | H42 | 67.7° | 58.3° |
| C24 | C23 | C22 | C27 | 55.8° | 57.6° |
| C24 | C23 | C22 | H34 | 120.1° | 120.0° |
| C24 | C23 | C22 | H35 | 120.1° | 120.0° |
| C24 | C23 | C22 | C21 | 176.5° | 177.6° |
| C24 | C23 | C22 | H33 | 64.2° | 62.3° |
| C24 | C23 | H34 | H35 | 119.7° | 120.1° |
| C23 | C24 | H36 | H37 | 118.5° | 120.0° |
| C27 | C22 | C23 | C21 | 120.7° | 120.0° |
| C27 | C22 | C23 | H33 | 120.0° | 119.9° |
| C27 | C22 | C21 | H33 | 120.4° | 120.1° |
| C27 | C22 | C21 | C20 | 166.2° | 175.0° |
| C27 | C22 | C21 | H31 | 73.6° | 54.9° |
| C27 | C22 | C21 | H32 | 46.0° | 65.0° |
| C27 | C22 | C23 | H34 | 175.9° | 62.3° |
| C27 | C22 | C23 | H35 | 64.4° | 177.7° |
| C22 | C27 | C26 | H41 | 173.8° | 179.2° |
| C22 | C27 | C26 | H42 | 66.7° | 60.9° |
| C22 | C27 | H43 | H44 | 119.0° | 120.1° |
| C23 | C22 | C21 | H33 | 119.1° | 120.1° |
| C23 | C22 | C21 | C20 | 73.2° | 65.3° |
| C23 | C22 | C21 | H31 | 47.0° | 174.7° |
| C23 | C22 | C21 | H32 | 166.6° | 54.7° |
| C22 | C23 | H34 | H35 | 119.7° | 120.1° |
| C22 | C23 | C24 | H36 | 64.6° | 60.8° |
| C22 | C23 | C24 | H37 | 176.4° | 179.2° |
| C23 | C22 | C27 | H43 | 65.1° | 177.6° |
| C23 | C22 | C27 | H44 | 175.5° | 62.3° |
| C22 | C21 | C20 | H31 | 120.2° | 120.0° |
| C22 | C21 | C20 | H32 | 120.2° | 120.0° |
| C22 | C21 | C20 | C19 | 168.4° | 180.0° |
| C22 | C21 | C20 | H29 | 48.3° | 60.0° |
| C22 | C21 | C20 | H30 | 71.6° | 60.0° |
| C22 | C21 | H31 | H32 | 119.3° | 120.0° |
| C21 | C22 | C23 | H34 | 63.4° | 57.6° |
| C21 | C22 | C23 | H35 | 56.4° | 62.4° |
| C21 | C22 | C27 | H43 | 54.6° | 62.4° |
| C21 | C22 | C27 | H44 | 64.7° | 57.7° |
| C21 | C20 | C19 | H29 | 120.1° | 120.0° |
| C21 | C20 | C19 | H30 | 120.1° | 120.0° |
| C21 | C20 | C19 | C18 | 76.6° | 180.0° |
| C21 | C20 | C19 | H27 | 43.3° | 60.0° |
| C21 | C20 | C19 | H28 | 163.6° | 60.0° |
| C21 | C20 | H29 | H30 | 119.8° | 120.0° |
| C20 | C21 | H31 | H32 | 119.3° | 120.0° |
| C20 | C21 | C22 | H33 | 45.9° | 54.9° |
| C20 | C19 | C18 | H27 | 119.9° | 120.0° |
| C20 | C19 | C18 | H28 | 119.9° | 120.0° |
| C20 | C19 | C18 | C17 | 104.2° | 180.0° |
| C20 | C19 | C18 | H25 | 16.3° | 60.0° |
| C20 | C19 | C18 | H26 | 135.3° | 59.9° |
| C20 | C19 | H27 | H28 | 120.4° | 120.0° |
| C19 | C20 | H29 | H30 | 119.8° | 120.1° |
| C19 | C20 | C21 | H31 | 71.4° | 60.0° |
| C19 | C20 | C21 | H32 | 48.2° | 60.0° |
| C19 | C18 | C17 | H25 | 120.5° | 120.0° |
| C19 | C18 | C17 | H26 | 120.5° | 120.0° |
| C19 | C18 | C17 | C16 | 82.5° | 90.0° |
| C19 | C18 | C17 | C28 | 99.2° | 90.0° |
| C19 | C18 | H25 | H26 | 118.5° | 119.9° |
| C18 | C19 | H27 | H28 | 120.4° | 120.0° |
| C18 | C19 | C20 | H29 | 163.3° | 60.0° |
| C18 | C19 | C20 | H30 | 43.5° | 60.0° |
| C18 | C17 | C16 | C28 | 178.3° | 180.0° |
| C18 | C17 | C16 | C15 | 178.3° | 179.9° |
| C18 | C17 | C28 | C29 | 179.2° | 179.8° |
| C18 | C17 | C16 | H22 | 1.7° | 0.0° |
| C18 | C17 | C28 | H23 | 0.8° | 0.0° |
| C17 | C18 | H25 | H26 | 118.5° | 120.1° |
| C17 | C18 | C19 | H27 | 135.9° | 60.0° |
| C17 | C18 | C19 | H28 | 15.7° | 60.0° |
| C17 | C16 | C15 | H22 | 180.0° | 180.0° |
| C16 | C17 | C28 | C29 | 2.5° | 0.2° |
| C17 | C16 | C15 | C14 | 2.9° | 0.0° |
| C17 | C16 | C15 | H21 | 177.1° | 180.0° |
| C16 | C17 | C28 | H23 | 177.5° | 180.0° |
| C16 | C17 | C18 | H25 | 157.0° | 150.0° |
| C16 | C17 | C18 | H26 | 38.0° | 30.0° |
| C28 | C17 | C16 | C15 | 0.1° | 0.0° |
| C17 | C28 | C29 | H23 | 180.0° | 179.8° |
| C17 | C28 | C29 | C14 | 2.1° | 0.5° |
| C28 | C17 | C16 | H22 | 179.9° | 180.0° |
| C17 | C28 | C29 | H24 | 177.9° | 180.0° |
| C28 | C17 | C18 | H25 | 21.3° | 30.0° |
| C28 | C17 | C18 | H26 | 140.3° | 150.0° |
| C16 | C15 | C14 | H21 | 180.0° | 180.0° |
| C16 | C15 | C14 | C29 | 3.3° | 0.3° |
| C16 | C15 | C14 | S | 177.1° | 180.0° |
| C28 | C29 | C14 | C15 | 0.8° | 0.5° |
| C28 | C29 | C14 | H24 | 180.0° | 179.5° |
| C28 | C29 | C14 | S | 174.5° | 179.7° |
| O3 | S | C14 | C15 | 61.0° | 23.6° |
| O3 | S | C14 | C29 | 125.4° | 156.2° |
| O3 | S | C14 | O4 | 117.9° | 132.9° |
| O3 | S | C14 | N2 | 154.6° | 113.5° |
| O3 | S | O4 | N2 | 123.6° | 122.9° |
| O3 | S | N2 | C13 | 174.1° | 174.2° |
| O3 | S | N2 | H15 | 50.7° | 5.8° |
| C15 | C14 | C29 | S | 173.7° | 179.8° |
| C15 | C14 | S | O4 | 178.9° | 156.5° |
| C15 | C14 | S | N2 | 93.7° | 90.0° |
| C14 | C15 | C16 | H22 | 177.1° | 180.0° |
| C15 | C14 | C29 | H24 | 179.2° | 180.0° |
| C29 | C14 | S | O4 | 7.5° | 23.2° |
| C29 | C14 | S | N2 | 80.0° | 90.3° |
| C29 | C14 | C15 | H21 | 176.7° | 179.7° |
| C14 | C29 | C28 | H23 | 177.9° | 179.7° |
| C14 | S | O4 | N2 | 110.6° | 114.1° |
| C14 | S | N2 | C13 | 20.6° | 60.6° |
| C14 | S | N2 | H15 | 102.8° | 119.3° |
| S | C14 | C15 | H21 | 2.9° | 0.0° |
| S | C14 | C29 | H24 | 5.5° | 0.3° |
| O4 | S | N2 | C13 | 77.2° | 52.9° |
| O4 | S | N2 | H15 | 159.4° | 127.1° |
| S | N2 | C13 | H15 | 123.4° | 180.0° |
| S | N2 | C13 | C30 | 32.8° | 35.6° |
| S | N2 | C13 | C6 | 154.4° | 144.3° |
| N2 | C13 | C30 | C6 | 172.4° | 179.8° |
| N2 | C13 | C30 | C3 | 177.7° | 180.0° |
| N2 | C13 | C6 | N1 | 5.1° | 0.2° |
| N2 | C13 | C6 | C5 | 175.2° | 179.8° |
| N2 | C13 | C30 | H20 | 2.3° | 0.2° |
| C13 | C30 | C3 | H20 | 180.0° | 179.8° |
| C30 | C13 | C6 | N1 | 178.3° | 180.0° |
| C30 | C13 | C6 | C5 | 2.0° | 0.1° |
| C13 | C30 | C3 | C2 | 179.7° | 179.8° |
| C13 | C30 | C3 | C4 | 5.2° | 0.5° |
| C30 | C13 | N2 | H15 | 90.6° | 144.5° |
| C6 | C13 | C30 | C3 | 5.4° | 0.2° |
| C13 | C6 | N1 | C12 | 51.4° | 65.9° |
| C13 | C6 | N1 | C5 | 179.7° | 179.9° |
| C13 | C6 | N1 | C7 | 130.3° | 166.7° |
| C13 | C6 | C5 | C4 | 1.2° | 0.0° |
| C13 | C6 | C5 | H2 | 178.8° | 179.9° |
| C6 | C13 | N2 | H15 | 82.2° | 35.7° |
| C6 | C13 | C30 | H20 | 174.6° | 180.0° |
| C30 | C3 | C2 | O1 | 15.1° | 179.7° |
| C30 | C3 | C2 | C4 | 174.3° | 179.7° |
| C30 | C3 | C2 | O2 | 168.1° | 0.4° |
| C30 | C3 | C4 | C5 | 1.9° | 0.5° |
| C30 | C3 | C4 | H1 | 178.1° | 179.7° |
| C1 | O1 | C2 | C3 | 179.7° | 180.0° |
| C1 | O1 | C2 | O2 | 3.3° | 0.1° |
| O1 | C1 | H17 | H18 | 120.0° | 120.0° |
| O1 | C1 | H17 | H19 | 120.0° | 120.0° |
| O1 | C1 | H18 | H19 | 120.0° | 120.0° |
| O1 | C2 | C3 | O2 | 176.8° | 179.9° |
| O1 | C2 | C3 | C4 | 159.3° | 0.0° |
| C2 | O1 | C1 | H17 | 180.0° | 60.0° |
| C2 | O1 | C1 | H18 | 60.0° | 180.0° |
| C2 | O1 | C1 | H19 | 60.0° | 59.9° |
| N1 | C12 | C11 | H13 | 120.3° | 119.7° |
| N1 | C12 | C11 | H14 | 120.3° | 119.7° |
| C12 | N1 | C6 | C7 | 178.3° | 127.4° |
| C12 | N1 | C6 | C5 | 128.9° | 114.0° |
| N1 | C12 | C11 | C10 | 56.1° | 81.4° |
| C12 | N1 | C7 | C8 | 84.1° | 41.9° |
| N1 | C12 | C11 | H3 | 177.3° | 157.8° |
| N1 | C12 | C11 | H4 | 65.1° | 39.5° |
| C12 | N1 | C7 | H5 | 35.7° | 162.9° |
| C12 | N1 | C7 | H6 | 156.2° | 79.1° |
| N1 | C12 | H13 | H14 | 119.0° | 120.6° |
| C11 | C12 | N1 | C6 | 156.5° | 138.6° |
| C11 | C12 | N1 | C7 | 21.8° | 95.4° |
| C12 | C11 | C10 | H3 | 121.2° | 120.8° |
| C12 | C11 | C10 | H4 | 121.2° | 120.8° |
| C12 | C11 | C10 | C9 | 26.4° | 61.5° |
| C12 | C11 | H3 | H4 | 116.2° | 118.3° |
| C12 | C11 | C10 | H11 | 94.5° | 177.9° |
| C12 | C11 | C10 | H12 | 147.2° | 59.0° |
| C11 | C12 | H13 | H14 | 119.0° | 120.6° |
| C6 | N1 | C7 | C8 | 94.2° | 167.8° |
| N1 | C6 | C5 | C4 | 178.5° | 180.0° |
| N1 | C6 | C5 | H2 | 1.5° | 0.0° |
| C6 | N1 | C7 | H5 | 146.0° | 71.2° |
| C6 | N1 | C7 | H6 | 25.5° | 46.9° |
| C6 | N1 | C12 | H13 | 36.1° | 101.7° |
| C6 | N1 | C12 | H14 | 83.2° | 18.9° |
| C7 | N1 | C6 | C5 | 49.4° | 13.4° |
| N1 | C7 | C8 | H5 | 119.7° | 121.0° |
| N1 | C7 | C8 | H6 | 119.7° | 120.9° |
| N1 | C7 | C8 | C9 | 27.4° | 42.2° |
| N1 | C7 | H5 | H6 | 120.8° | 118.0° |
| N1 | C7 | C8 | H7 | 148.4° | 78.6° |
| N1 | C7 | C8 | H8 | 93.7° | 163.1° |
| C7 | N1 | C12 | H13 | 142.1° | 24.3° |
| C7 | N1 | C12 | H14 | 98.5° | 144.9° |
| C6 | C5 | C4 | C3 | 1.3° | 0.3° |
| C6 | C5 | C4 | H2 | 180.0° | 180.0° |
| C6 | C5 | C4 | H1 | 178.7° | 179.9° |
| C2 | C3 | C4 | C5 | 176.3° | 179.8° |
| C2 | C3 | C4 | H1 | 3.7° | 0.0° |
| C2 | C3 | C30 | H20 | 0.3° | 0.0° |
| C4 | C3 | C2 | O2 | 17.6° | 180.0° |
| C3 | C4 | C5 | H1 | 180.0° | 179.8° |
| C3 | C4 | C5 | H2 | 178.7° | 179.8° |
| C4 | C3 | C30 | H20 | 174.8° | 179.7° |
| C11 | C10 | C9 | H11 | 120.9° | 120.6° |
| C11 | C10 | C9 | H12 | 120.9° | 120.6° |
| C11 | C10 | C9 | C8 | 59.1° | 77.3° |
| C10 | C11 | H3 | H4 | 116.2° | 118.5° |
| C11 | C10 | C9 | H9 | 61.2° | 162.9° |
| C11 | C10 | C9 | H10 | 179.4° | 42.6° |
| C11 | C10 | H11 | H12 | 117.3° | 119.0° |
| C10 | C11 | C12 | H13 | 64.2° | 38.3° |
| C10 | C11 | C12 | H14 | 176.5° | 158.9° |
| C7 | C8 | C9 | C10 | 60.5° | 91.7° |
| C7 | C8 | C9 | H7 | 121.1° | 120.9° |
| C7 | C8 | C9 | H8 | 121.0° | 120.9° |
| C8 | C7 | H5 | H6 | 120.8° | 118.2° |
| C7 | C8 | H7 | H8 | 116.6° | 118.3° |
| C7 | C8 | C9 | H9 | 59.8° | 148.4° |
| C7 | C8 | C9 | H10 | 179.2° | 28.2° |
| C10 | C9 | C8 | H9 | 120.3° | 119.8° |
| C10 | C9 | C8 | H10 | 120.3° | 119.9° |
| C9 | C10 | C11 | H3 | 147.6° | 177.7° |
| C9 | C10 | C11 | H4 | 94.8° | 59.3° |
| C10 | C9 | C8 | H7 | 60.6° | 29.1° |
| C10 | C9 | C8 | H8 | 178.5° | 147.4° |
| C10 | C9 | H9 | H10 | 119.2° | 120.4° |
| C9 | C10 | H11 | H12 | 117.3° | 118.8° |
| C9 | C8 | C7 | H5 | 92.4° | 78.8° |
| C9 | C8 | C7 | H6 | 147.1° | 163.1° |
| C9 | C8 | H7 | H8 | 116.7° | 118.3° |
| C8 | C9 | H9 | H10 | 119.2° | 120.2° |
| C8 | C9 | C10 | H11 | 179.9° | 162.1° |
| C8 | C9 | C10 | H12 | 61.8° | 43.4° |
| H1 | C4 | C5 | H2 | 1.3° | 0.0° |
| H3 | C11 | C10 | H11 | 26.7° | 57.1° |
| H3 | C11 | C10 | H12 | 91.6° | 61.8° |
| H3 | C11 | C12 | H13 | 57.0° | 82.6° |
| H3 | C11 | C12 | H14 | 62.3° | 38.0° |
| H4 | C11 | C10 | H11 | 144.3° | 61.3° |
| H4 | C11 | C10 | H12 | 26.1° | 179.8° |
| H4 | C11 | C12 | H13 | 174.6° | 159.1° |
| H4 | C11 | C12 | H14 | 55.3° | 80.3° |
| H5 | C7 | C8 | H7 | 28.7° | 160.4° |
| H5 | C7 | C8 | H8 | 146.6° | 42.1° |
| H6 | C7 | C8 | H7 | 91.9° | 42.3° |
| H6 | C7 | C8 | H8 | 26.0° | 76.0° |
| H7 | C8 | C9 | H9 | 179.1° | 90.7° |
| H7 | C8 | C9 | H10 | 59.7° | 149.1° |
| H8 | C8 | C9 | H9 | 61.2° | 27.6° |
| H8 | C8 | C9 | H10 | 58.2° | 92.7° |
| H9 | C9 | C10 | H11 | 59.7° | 42.3° |
| H9 | C9 | C10 | H12 | 177.9° | 76.4° |
| H10 | C9 | C10 | H11 | 59.8° | 78.0° |
| H10 | C9 | C10 | H12 | 58.5° | 163.2° |
| H17 | C1 | H18 | H19 | 120.0° | 120.0° |
| H21 | C15 | C16 | H22 | 2.9° | 0.0° |
| H23 | C28 | C29 | H24 | 2.1° | 0.2° |
| H25 | C18 | C19 | H27 | 103.6° | 180.0° |
| H25 | C18 | C19 | H28 | 136.1° | 60.0° |
| H26 | C18 | C19 | H27 | 15.4° | 60.1° |
| H26 | C18 | C19 | H28 | 104.8° | 179.9° |
| H27 | C19 | C20 | H29 | 76.8° | 180.0° |
| H27 | C19 | C20 | H30 | 163.4° | 60.0° |
| H28 | C19 | C20 | H29 | 43.5° | 60.0° |
| H28 | C19 | C20 | H30 | 76.4° | 180.0° |
| H29 | C20 | C21 | H31 | 168.5° | 180.0° |
| H29 | C20 | C21 | H32 | 71.9° | 60.0° |
| H30 | C20 | C21 | H31 | 48.7° | 60.0° |
| H30 | C20 | C21 | H32 | 168.2° | 180.0° |
| H31 | C21 | C22 | H33 | 166.1° | 65.2° |
| H32 | C21 | C22 | H33 | 74.4° | 174.9° |
| H33 | C22 | C23 | H34 | 55.9° | 177.8° |
| H33 | C22 | C23 | H35 | 175.6° | 57.7° |
| H33 | C22 | C27 | H43 | 175.0° | 57.7° |
| H33 | C22 | C27 | H44 | 55.7° | 177.8° |
| H34 | C23 | C24 | H36 | 55.5° | 179.2° |
| H34 | C23 | C24 | H37 | 63.5° | 59.3° |
| H35 | C23 | C24 | H36 | 175.2° | 59.2° |
| H35 | C23 | C24 | H37 | 56.2° | 60.8° |
| H38 | C25 | H39 | H40 | 120.0° | 120.0° |
| H41 | C26 | C27 | H43 | 53.4° | 60.8° |
| H41 | C26 | C27 | H44 | 65.8° | 59.3° |
| H42 | C26 | C27 | H43 | 172.9° | 59.1° |
| H42 | C26 | C27 | H44 | 53.6° | 179.2° |
