5Z4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | N3 | sing | 1.46Å | 1.46Å | |
| C | C1 | sing | 1.53Å | 1.48Å | |
| N3 | C18 | sing | 1.35Å | 1.36Å | |
| N3 | C16 | sing | 1.35Å | 1.40Å | |
| O3 | C16 | doub | 1.22Å | 1.23Å | |
| C18 | C12 | doub | 1.38Å | 1.35Å | |
| C16 | C14 | sing | 1.41Å | 1.44Å | |
| N2 | C10 | sing | 1.36Å | 1.40Å | Aromatic |
| N2 | C11 | doub | 1.31Å | 1.32Å | Aromatic |
| C9 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | O | sing | 1.45Å | 1.46Å | |
| O | C2 | sing | 1.34Å | 1.34Å | |
| C14 | C15 | sing | 1.51Å | 1.50Å | |
| C14 | C13 | doub | 1.36Å | 1.35Å | |
| C10 | C25 | sing | 1.41Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.48Å | 1.48Å | |
| C12 | C13 | sing | 1.41Å | 1.43Å | |
| C8 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | N4 | sing | 1.37Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C3 | N | sing | 1.47Å | 1.45Å | |
| C2 | O1 | doub | 1.21Å | 1.20Å | |
| C25 | N4 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| N4 | C19 | sing | 1.46Å | 1.47Å | |
| C7 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| N | C4 | sing | 1.35Å | 1.33Å | |
| C4 | O2 | doub | 1.21Å | 1.23Å | |
| C4 | C5 | sing | 1.51Å | 1.52Å | |
| C5 | N1 | sing | 1.46Å | 1.45Å | |
| C6 | N1 | sing | 1.47Å | 1.47Å | |
| C19 | C20 | sing | 1.53Å | 1.51Å | |
| N1 | C27 | sing | 1.35Å | 1.35Å | |
| C21 | C20 | sing | 1.53Å | 1.52Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C20 | C24 | sing | 1.53Å | 1.52Å | |
| C27 | O5 | doub | 1.22Å | 1.22Å | |
| C27 | C28 | sing | 1.48Å | 1.51Å | |
| C22 | O4 | sing | 1.43Å | 1.43Å | |
| C24 | C23 | sing | 1.53Å | 1.51Å | |
| F | C29 | sing | 1.35Å | 1.34Å | |
| C28 | C29 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | C33 | sing | 1.40Å | 1.39Å | Aromatic |
| F3 | C33 | sing | 1.35Å | 1.35Å | |
| C29 | C30 | sing | 1.36Å | 1.38Å | Aromatic |
| C33 | C32 | doub | 1.36Å | 1.38Å | Aromatic |
| O4 | C23 | sing | 1.43Å | 1.43Å | |
| C30 | F1 | sing | 1.35Å | 1.35Å | |
| C30 | C31 | doub | 1.47Å | 1.39Å | Aromatic |
| C32 | F2 | sing | 1.35Å | 1.34Å | |
| C32 | C31 | sing | 1.47Å | 1.39Å | Aromatic |
| C31 | N5 | sing | 1.32Å | 1.43Å | |
| N5 | N6 | doub | 1.12Å | 1.28Å | |
| N6 | N7 | doub | 1.12Å | 1.14Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.08Å | 1.08Å | |
| N7 | H21 | sing | 0.97Å | 1.00Å | |
| N | H22 | sing | 0.97Å | 1.00Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C1 | H25 | sing | 1.09Å | 1.10Å | |
| C1 | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å | |
| C | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C9 | H30 | sing | 1.08Å | 1.08Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| C19 | H32 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C18 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | N3 | C18 | 119.9° | 119.5° |
| C17 | N3 | C16 | 117.4° | 119.5° |
| N3 | C17 | H10 | 109.5° | 109.5° |
| N3 | C17 | H11 | 109.4° | 109.5° |
| N3 | C17 | H12 | 109.5° | 109.5° |
| C | C1 | O | 108.5° | 109.5° |
| C | C1 | H25 | 109.7° | 109.4° |
| C | C1 | H26 | 109.7° | 109.5° |
| C1 | C | H27 | 109.5° | 109.5° |
| C1 | C | H28 | 109.4° | 109.5° |
| C1 | C | H29 | 109.5° | 109.4° |
| C18 | N3 | C16 | 122.5° | 121.0° |
| N3 | C18 | C12 | 121.8° | 120.4° |
| N3 | C18 | H35 | 119.1° | 119.7° |
| N3 | C16 | O3 | 120.4° | 119.7° |
| N3 | C16 | C14 | 116.1° | 120.5° |
| O3 | C16 | C14 | 123.4° | 119.8° |
| C18 | C12 | C11 | 118.5° | 120.2° |
| C18 | C12 | C13 | 116.9° | 119.5° |
| C12 | C18 | H35 | 119.1° | 119.8° |
| C16 | C14 | C15 | 118.2° | 120.3° |
| C16 | C14 | C13 | 119.4° | 119.5° |
| C10 | N2 | C11 | 104.7° | 109.6° |
| N2 | C10 | C9 | 130.1° | 133.3° |
| N2 | C10 | C25 | 110.5° | 107.2° |
| N2 | C11 | C12 | 120.8° | 125.1° |
| N2 | C11 | N4 | 112.8° | 109.8° |
| C10 | C9 | C8 | 119.3° | 119.7° |
| C9 | C10 | C25 | 119.3° | 119.5° |
| C10 | C9 | H30 | 120.3° | 120.1° |
| C9 | C8 | C7 | 121.5° | 120.5° |
| C9 | C8 | H5 | 119.3° | 119.7° |
| C8 | C9 | H30 | 120.3° | 120.2° |
| C1 | O | C2 | 116.8° | 117.0° |
| O | C1 | H25 | 109.7° | 109.5° |
| O | C1 | H26 | 109.7° | 109.5° |
| O | C2 | C3 | 110.4° | 120.0° |
| O | C2 | O1 | 124.2° | 120.0° |
| C15 | C14 | C13 | 122.3° | 120.2° |
| C14 | C15 | H7 | 109.5° | 109.5° |
| C14 | C15 | H8 | 109.5° | 109.5° |
| C14 | C15 | H9 | 109.4° | 109.5° |
| C14 | C13 | C12 | 122.8° | 119.1° |
| C14 | C13 | H6 | 118.6° | 120.5° |
| C10 | C25 | N4 | 105.6° | 106.2° |
| C10 | C25 | C26 | 121.3° | 119.9° |
| C11 | C12 | C13 | 124.2° | 120.3° |
| C12 | C11 | N4 | 125.6° | 125.1° |
| C12 | C13 | H6 | 118.6° | 120.5° |
| C8 | C7 | C26 | 118.7° | 120.5° |
| C8 | C7 | C6 | 120.1° | 119.8° |
| C7 | C8 | H5 | 119.3° | 119.8° |
| C11 | N4 | C25 | 106.3° | 107.2° |
| C11 | N4 | C19 | 129.0° | 126.4° |
| C2 | C3 | N | 112.3° | 109.5° |
| C3 | C2 | O1 | 125.4° | 120.0° |
| C2 | C3 | H23 | 108.7° | 109.5° |
| C2 | C3 | H24 | 108.7° | 109.5° |
| C3 | N | C4 | 121.5° | 120.0° |
| C3 | N | H22 | 119.3° | 120.0° |
| N | C3 | H23 | 108.8° | 109.5° |
| N | C3 | H24 | 108.8° | 109.4° |
| N4 | C25 | C26 | 132.7° | 133.8° |
| C25 | N4 | C19 | 123.5° | 126.4° |
| C25 | C26 | C7 | 119.8° | 119.8° |
| C25 | C26 | H20 | 120.1° | 120.1° |
| N4 | C19 | C20 | 112.2° | 109.5° |
| N4 | C19 | H31 | 108.8° | 109.5° |
| N4 | C19 | H32 | 108.8° | 109.5° |
| C26 | C7 | C6 | 120.8° | 119.7° |
| C7 | C26 | H20 | 120.1° | 120.1° |
| C7 | C6 | N1 | 114.6° | 109.5° |
| C7 | C6 | H3 | 108.2° | 109.5° |
| C7 | C6 | H4 | 108.2° | 109.4° |
| N | C4 | O2 | 123.5° | 120.0° |
| N | C4 | C5 | 115.6° | 120.0° |
| C4 | N | H22 | 119.2° | 120.0° |
| O2 | C4 | C5 | 120.9° | 120.0° |
| C4 | C5 | N1 | 112.5° | 109.5° |
| C4 | C5 | H1 | 108.7° | 109.4° |
| C4 | C5 | H2 | 108.7° | 109.5° |
| C5 | N1 | C6 | 115.6° | 120.0° |
| C5 | N1 | C27 | 118.7° | 120.0° |
| N1 | C5 | H1 | 108.7° | 109.5° |
| N1 | C5 | H2 | 108.7° | 109.5° |
| C6 | N1 | C27 | 125.6° | 120.0° |
| N1 | C6 | H3 | 108.2° | 109.5° |
| N1 | C6 | H4 | 108.2° | 109.5° |
| C19 | C20 | C21 | 111.4° | 109.6° |
| C19 | C20 | C24 | 111.2° | 109.6° |
| C19 | C20 | H13 | 108.5° | 109.5° |
| C20 | C19 | H31 | 108.8° | 109.5° |
| C20 | C19 | H32 | 108.8° | 109.4° |
| N1 | C27 | O5 | 122.8° | 120.0° |
| N1 | C27 | C28 | 118.4° | 120.0° |
| C20 | C21 | C22 | 110.6° | 109.2° |
| C21 | C20 | C24 | 108.9° | 109.0° |
| C21 | C20 | H13 | 108.3° | 109.6° |
| C20 | C21 | H14 | 109.2° | 109.5° |
| C20 | C21 | H15 | 109.2° | 109.5° |
| C21 | C22 | O4 | 111.5° | 109.4° |
| C22 | C21 | H14 | 109.2° | 109.5° |
| C22 | C21 | H15 | 109.2° | 109.5° |
| C21 | C22 | H16 | 109.0° | 109.5° |
| C21 | C22 | H17 | 109.0° | 109.5° |
| C20 | C24 | C23 | 110.2° | 109.2° |
| C24 | C20 | H13 | 108.3° | 109.5° |
| C20 | C24 | H18 | 109.3° | 109.4° |
| C20 | C24 | H19 | 109.3° | 109.5° |
| O5 | C27 | C28 | 118.7° | 120.0° |
| C27 | C28 | C29 | 122.9° | 119.2° |
| C27 | C28 | C33 | 120.6° | 119.2° |
| C22 | O4 | C23 | 110.3° | 114.1° |
| O4 | C22 | H16 | 109.0° | 109.5° |
| O4 | C22 | H17 | 109.0° | 109.5° |
| C24 | C23 | O4 | 111.5° | 109.4° |
| C23 | C24 | H18 | 109.3° | 109.5° |
| C23 | C24 | H19 | 109.3° | 109.5° |
| C24 | C23 | H33 | 109.0° | 109.5° |
| C24 | C23 | H34 | 109.0° | 109.5° |
| F | C29 | C28 | 119.8° | 119.6° |
| F | C29 | C30 | 118.2° | 119.7° |
| C29 | C28 | C33 | 116.4° | 121.6° |
| C28 | C29 | C30 | 122.0° | 120.7° |
| C28 | C33 | F3 | 119.8° | 119.6° |
| C28 | C33 | C32 | 121.8° | 120.8° |
| F3 | C33 | C32 | 118.3° | 119.6° |
| C29 | C30 | F1 | 118.4° | 120.4° |
| C29 | C30 | C31 | 121.6° | 119.2° |
| C33 | C32 | F2 | 118.7° | 120.5° |
| C33 | C32 | C31 | 121.6° | 119.2° |
| O4 | C23 | H33 | 109.0° | 109.5° |
| O4 | C23 | H34 | 109.0° | 109.4° |
| F1 | C30 | C31 | 120.0° | 120.4° |
| C30 | C31 | C32 | 116.5° | 118.5° |
| C30 | C31 | N5 | 125.0° | 120.8° |
| F2 | C32 | C31 | 119.8° | 120.4° |
| C32 | C31 | N5 | 118.4° | 120.7° |
| C31 | N5 | N6 | 119.8° | 120.0° |
| N5 | N6 | N7 | 167.5° | 179.9° |
| N6 | N7 | H21 | 112.0° | 120.0° |
| H1 | C5 | H2 | 109.5° | 109.4° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H7 | C15 | H8 | 109.5° | 109.4° |
| H7 | C15 | H9 | 109.5° | 109.4° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H10 | C17 | H11 | 109.5° | 109.4° |
| H10 | C17 | H12 | 109.5° | 109.4° |
| H11 | C17 | H12 | 109.5° | 109.4° |
| H14 | C21 | H15 | 109.5° | 109.6° |
| H16 | C22 | H17 | 109.4° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.6° |
| H23 | C3 | H24 | 109.5° | 109.4° |
| H25 | C1 | H26 | 109.4° | 109.5° |
| H27 | C | H28 | 109.5° | 109.5° |
| H27 | C | H29 | 109.5° | 109.5° |
| H28 | C | H29 | 109.5° | 109.4° |
| H31 | C19 | H32 | 109.5° | 109.5° |
| H33 | C23 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | N3 | C18 | C16 | 175.0° | 179.7° |
| C17 | N3 | C16 | O3 | 2.5° | 0.3° |
| C17 | N3 | C18 | C12 | 169.0° | 179.7° |
| C17 | N3 | C16 | C14 | 175.1° | 179.7° |
| N3 | C17 | H10 | H11 | 120.0° | 120.0° |
| N3 | C17 | H10 | H12 | 120.0° | 120.1° |
| N3 | C17 | H11 | H12 | 120.0° | 120.1° |
| C17 | N3 | C18 | H35 | 11.0° | 0.3° |
| C | C1 | O | H25 | 119.9° | 119.9° |
| C | C1 | O | H26 | 119.9° | 120.0° |
| C | C1 | O | C2 | 132.5° | 180.0° |
| C | C1 | H25 | H26 | 120.5° | 120.0° |
| C1 | C | H27 | H28 | 120.0° | 120.1° |
| C1 | C | H27 | H29 | 120.0° | 120.0° |
| C1 | C | H28 | H29 | 120.0° | 120.0° |
| C18 | N3 | C16 | O3 | 177.5° | 180.0° |
| N3 | C18 | C12 | H35 | 180.0° | 180.0° |
| C18 | N3 | C16 | C14 | 0.0° | 0.0° |
| N3 | C18 | C12 | C11 | 179.3° | 180.0° |
| N3 | C18 | C12 | C13 | 7.3° | 0.0° |
| C18 | N3 | C17 | H10 | 180.0° | 90.0° |
| C18 | N3 | C17 | H11 | 60.0° | 150.0° |
| C18 | N3 | C17 | H12 | 60.0° | 30.0° |
| N3 | C16 | O3 | C14 | 177.3° | 180.0° |
| C16 | N3 | C18 | C12 | 6.0° | 0.0° |
| N3 | C16 | C14 | C15 | 172.7° | 180.0° |
| N3 | C16 | C14 | C13 | 4.1° | 0.0° |
| C16 | N3 | C17 | H10 | 4.8° | 90.3° |
| C16 | N3 | C17 | H11 | 115.2° | 29.7° |
| C16 | N3 | C17 | H12 | 124.8° | 149.7° |
| C16 | N3 | C18 | H35 | 174.0° | 180.0° |
| O3 | C16 | C14 | C15 | 9.8° | 0.0° |
| O3 | C16 | C14 | C13 | 173.3° | 180.0° |
| C18 | C12 | C11 | N2 | 27.0° | 60.5° |
| C18 | C12 | C13 | C14 | 3.0° | 0.0° |
| C18 | C12 | C11 | C13 | 172.8° | 180.0° |
| C18 | C12 | C11 | N4 | 163.4° | 119.5° |
| C18 | C12 | C13 | H6 | 177.0° | 180.0° |
| C16 | C14 | C15 | C13 | 176.7° | 180.0° |
| C16 | C14 | C13 | C12 | 2.7° | 0.0° |
| C16 | C14 | C13 | H6 | 177.3° | 180.0° |
| C16 | C14 | C15 | H7 | 180.0° | 0.0° |
| C16 | C14 | C15 | H8 | 60.0° | 120.0° |
| C16 | C14 | C15 | H9 | 60.0° | 120.0° |
| N2 | C10 | C9 | C25 | 175.3° | 179.9° |
| N2 | C10 | C9 | C8 | 173.1° | 179.2° |
| C10 | N2 | C11 | C12 | 171.5° | 180.0° |
| C10 | N2 | C11 | N4 | 0.7° | 0.1° |
| N2 | C10 | C25 | N4 | 1.0° | 0.1° |
| N2 | C10 | C25 | C26 | 173.9° | 179.5° |
| N2 | C10 | C9 | H30 | 6.9° | 0.1° |
| C11 | N2 | C10 | C9 | 175.8° | 180.0° |
| C11 | N2 | C10 | C25 | 0.2° | 0.1° |
| N2 | C11 | C12 | N4 | 169.6° | 180.0° |
| N2 | C11 | C12 | C13 | 145.8° | 119.5° |
| N2 | C11 | N4 | C25 | 1.3° | 0.0° |
| N2 | C11 | N4 | C19 | 169.1° | 180.0° |
| C10 | C9 | C8 | H30 | 180.0° | 179.2° |
| C10 | C9 | C8 | C7 | 0.5° | 0.5° |
| C9 | C10 | C25 | N4 | 177.1° | 180.0° |
| C9 | C10 | C25 | C26 | 2.3° | 0.4° |
| C10 | C9 | C8 | H5 | 179.5° | 179.5° |
| C8 | C9 | C10 | C25 | 2.2° | 0.7° |
| C9 | C8 | C7 | H5 | 180.0° | 180.0° |
| C9 | C8 | C7 | C26 | 3.0° | 0.0° |
| C9 | C8 | C7 | C6 | 170.9° | 179.7° |
| C1 | O | C2 | C3 | 128.5° | 180.0° |
| C1 | O | C2 | O1 | 51.5° | 0.0° |
| O | C1 | H25 | H26 | 120.4° | 120.0° |
| O | C1 | C | H27 | 180.0° | 60.0° |
| O | C1 | C | H28 | 60.0° | 180.0° |
| O | C1 | C | H29 | 60.0° | 60.0° |
| O | C2 | C3 | O1 | 180.0° | 180.0° |
| O | C2 | C3 | N | 164.5° | 180.0° |
| O | C2 | C3 | H23 | 44.1° | 60.0° |
| O | C2 | C3 | H24 | 75.1° | 60.0° |
| C2 | O | C1 | H25 | 107.7° | 60.0° |
| C2 | O | C1 | H26 | 12.6° | 60.0° |
| C15 | C14 | C13 | C12 | 174.0° | 180.0° |
| C15 | C14 | C13 | H6 | 6.0° | 0.0° |
| C14 | C15 | H7 | H8 | 120.0° | 120.0° |
| C14 | C15 | H7 | H9 | 120.0° | 120.0° |
| C14 | C15 | H8 | H9 | 120.0° | 120.1° |
| C14 | C13 | C12 | C11 | 176.0° | 180.0° |
| C14 | C13 | C12 | H6 | 180.0° | 180.0° |
| C13 | C14 | C15 | H7 | 3.3° | 180.0° |
| C13 | C14 | C15 | H8 | 123.3° | 60.0° |
| C13 | C14 | C15 | H9 | 116.8° | 60.0° |
| C10 | C25 | N4 | C11 | 1.3° | 0.0° |
| C10 | C25 | N4 | C26 | 174.0° | 179.5° |
| C10 | C25 | N4 | C19 | 170.0° | 180.0° |
| C10 | C25 | C26 | C7 | 0.3° | 0.1° |
| C10 | C25 | C26 | H20 | 179.7° | 180.0° |
| C25 | C10 | C9 | H30 | 177.8° | 179.9° |
| C12 | C11 | N4 | C25 | 171.6° | 180.0° |
| C12 | C11 | N4 | C19 | 20.6° | 0.0° |
| C11 | C12 | C13 | H6 | 4.1° | 0.0° |
| C11 | C12 | C18 | H35 | 0.7° | 0.0° |
| C13 | C12 | C11 | N4 | 23.8° | 60.5° |
| C13 | C12 | C18 | H35 | 172.7° | 180.0° |
| C8 | C7 | C26 | C25 | 2.9° | 0.3° |
| C8 | C7 | C26 | C6 | 173.8° | 179.7° |
| C8 | C7 | C6 | N1 | 149.5° | 89.7° |
| C8 | C7 | C6 | H3 | 28.8° | 150.3° |
| C8 | C7 | C6 | H4 | 89.7° | 30.3° |
| C8 | C7 | C26 | H20 | 177.1° | 179.7° |
| C7 | C8 | C9 | H30 | 179.6° | 179.7° |
| C11 | N4 | C25 | C19 | 168.7° | 180.0° |
| C11 | N4 | C25 | C26 | 172.7° | 179.4° |
| C11 | N4 | C19 | C20 | 96.6° | 84.8° |
| C11 | N4 | C19 | H31 | 23.8° | 35.2° |
| C11 | N4 | C19 | H32 | 143.1° | 155.3° |
| C2 | C3 | N | H23 | 120.4° | 120.0° |
| C2 | C3 | N | H24 | 120.4° | 120.0° |
| C2 | C3 | N | C4 | 74.5° | 180.0° |
| C2 | C3 | N | H22 | 105.5° | 0.0° |
| C2 | C3 | H23 | H24 | 118.7° | 120.0° |
| N | C3 | C2 | O1 | 15.5° | 0.0° |
| C3 | N | C4 | H22 | 180.0° | 180.0° |
| C3 | N | C4 | O2 | 35.4° | 0.0° |
| C3 | N | C4 | C5 | 145.2° | 180.0° |
| N | C3 | H23 | H24 | 118.7° | 120.0° |
| O1 | C2 | C3 | H23 | 136.0° | 120.0° |
| O1 | C2 | C3 | H24 | 104.9° | 120.0° |
| N4 | C25 | C26 | C7 | 172.9° | 179.3° |
| C25 | N4 | C19 | C20 | 69.4° | 95.2° |
| N4 | C25 | C26 | H20 | 7.1° | 0.6° |
| C25 | N4 | C19 | H31 | 170.2° | 144.8° |
| C25 | N4 | C19 | H32 | 50.9° | 24.7° |
| C26 | C25 | N4 | C19 | 4.0° | 0.6° |
| C25 | C26 | C7 | H20 | 180.0° | 180.0° |
| C25 | C26 | C7 | C6 | 171.0° | 180.0° |
| N4 | C19 | C20 | H31 | 120.4° | 120.0° |
| N4 | C19 | C20 | H32 | 120.4° | 120.0° |
| N4 | C19 | C20 | C21 | 61.4° | 65.5° |
| N4 | C19 | C20 | C24 | 176.9° | 174.9° |
| N4 | C19 | C20 | H13 | 57.8° | 54.8° |
| N4 | C19 | H31 | H32 | 118.8° | 120.0° |
| C26 | C7 | C6 | N1 | 36.7° | 90.0° |
| C26 | C7 | C6 | H3 | 157.5° | 30.0° |
| C26 | C7 | C6 | H4 | 84.0° | 150.0° |
| C26 | C7 | C8 | H5 | 177.0° | 180.0° |
| C7 | C6 | N1 | C5 | 56.8° | 90.3° |
| C7 | C6 | N1 | H3 | 120.8° | 120.0° |
| C7 | C6 | N1 | H4 | 120.8° | 120.0° |
| C7 | C6 | N1 | C27 | 126.3° | 90.0° |
| C7 | C6 | H3 | H4 | 117.7° | 119.9° |
| C6 | C7 | C8 | H5 | 9.1° | 0.3° |
| C6 | C7 | C26 | H20 | 9.0° | 0.0° |
| N | C4 | O2 | C5 | 179.3° | 180.0° |
| N | C4 | C5 | N1 | 155.4° | 180.0° |
| N | C4 | C5 | H1 | 84.2° | 60.0° |
| N | C4 | C5 | H2 | 34.9° | 60.0° |
| C4 | N | C3 | H23 | 46.0° | 60.0° |
| C4 | N | C3 | H24 | 165.1° | 60.0° |
| O2 | C4 | C5 | N1 | 24.0° | 0.0° |
| O2 | C4 | C5 | H1 | 96.4° | 120.1° |
| O2 | C4 | C5 | H2 | 144.5° | 120.0° |
| O2 | C4 | N | H22 | 144.6° | 180.0° |
| C4 | C5 | N1 | H1 | 120.4° | 120.0° |
| C4 | C5 | N1 | H2 | 120.5° | 120.0° |
| C4 | C5 | N1 | C6 | 92.5° | 89.7° |
| C4 | C5 | N1 | C27 | 84.6° | 90.0° |
| C4 | C5 | H1 | H2 | 118.6° | 120.0° |
| C5 | C4 | N | H22 | 34.8° | 0.0° |
| C5 | N1 | C6 | C27 | 176.9° | 179.7° |
| C5 | N1 | C27 | O5 | 0.4° | 180.0° |
| C5 | N1 | C27 | C28 | 178.1° | 0.0° |
| N1 | C5 | H1 | H2 | 118.6° | 120.0° |
| C5 | N1 | C6 | H3 | 63.9° | 29.7° |
| C5 | N1 | C6 | H4 | 177.6° | 149.7° |
| C6 | N1 | C27 | O5 | 177.2° | 0.2° |
| C6 | N1 | C27 | C28 | 1.3° | 179.7° |
| C6 | N1 | C5 | H1 | 28.0° | 30.3° |
| C6 | N1 | C5 | H2 | 147.1° | 150.3° |
| N1 | C6 | H3 | H4 | 117.6° | 120.0° |
| C19 | C20 | C21 | C24 | 123.1° | 119.9° |
| C19 | C20 | C21 | H13 | 119.3° | 120.3° |
| C19 | C20 | C21 | C22 | 176.0° | 176.9° |
| C19 | C20 | C24 | H13 | 119.1° | 120.2° |
| C19 | C20 | C24 | C23 | 176.5° | 176.9° |
| C19 | C20 | C21 | H14 | 63.9° | 63.2° |
| C19 | C20 | C21 | H15 | 55.8° | 57.0° |
| C19 | C20 | C24 | H18 | 56.4° | 57.1° |
| C19 | C20 | C24 | H19 | 63.3° | 63.1° |
| C20 | C19 | H31 | H32 | 118.8° | 120.0° |
| N1 | C27 | O5 | C28 | 178.6° | 179.9° |
| N1 | C27 | C28 | C29 | 96.9° | 90.0° |
| N1 | C27 | C28 | C33 | 86.7° | 90.3° |
| C27 | N1 | C5 | H1 | 154.9° | 150.0° |
| C27 | N1 | C5 | H2 | 35.8° | 30.0° |
| C27 | N1 | C6 | H3 | 113.0° | 150.0° |
| C27 | N1 | C6 | H4 | 5.5° | 30.0° |
| C20 | C21 | C22 | H14 | 120.2° | 119.9° |
| C20 | C21 | C22 | H15 | 120.2° | 119.9° |
| C21 | C20 | C24 | H13 | 117.6° | 119.8° |
| C20 | C21 | C22 | O4 | 57.1° | 57.6° |
| C21 | C20 | C24 | C23 | 53.3° | 57.0° |
| C20 | C21 | H14 | H15 | 119.5° | 120.2° |
| C20 | C21 | C22 | H16 | 63.2° | 62.4° |
| C20 | C21 | C22 | H17 | 177.4° | 177.6° |
| C21 | C20 | C24 | H18 | 66.8° | 62.9° |
| C21 | C20 | C24 | H19 | 173.4° | 176.9° |
| C21 | C20 | C19 | H31 | 59.0° | 174.5° |
| C21 | C20 | C19 | H32 | 178.2° | 54.5° |
| C22 | C21 | C20 | C24 | 52.8° | 57.0° |
| C21 | C22 | O4 | H16 | 120.3° | 120.0° |
| C21 | C22 | O4 | H17 | 120.3° | 120.0° |
| C21 | C22 | O4 | C23 | 60.7° | 61.1° |
| C22 | C21 | C20 | H13 | 64.8° | 62.8° |
| C22 | C21 | H14 | H15 | 119.5° | 120.2° |
| C21 | C22 | H16 | H17 | 119.1° | 120.0° |
| C20 | C24 | C23 | H18 | 120.1° | 119.8° |
| C20 | C24 | C23 | H19 | 120.1° | 119.9° |
| C20 | C24 | C23 | O4 | 58.4° | 57.6° |
| C24 | C20 | C21 | H14 | 173.0° | 176.8° |
| C24 | C20 | C21 | H15 | 67.3° | 63.0° |
| C20 | C24 | H18 | H19 | 119.7° | 120.1° |
| C24 | C20 | C19 | H31 | 62.7° | 54.9° |
| C24 | C20 | C19 | H32 | 56.5° | 65.2° |
| C20 | C24 | C23 | H33 | 178.7° | 177.6° |
| C20 | C24 | C23 | H34 | 61.9° | 62.4° |
| O5 | C27 | C28 | C29 | 81.8° | 89.9° |
| O5 | C27 | C28 | C33 | 94.6° | 89.8° |
| C27 | C28 | C29 | F | 5.9° | 0.3° |
| C27 | C28 | C29 | C33 | 176.5° | 179.7° |
| C27 | C28 | C33 | F3 | 4.0° | 0.3° |
| C27 | C28 | C29 | C30 | 175.1° | 179.7° |
| C27 | C28 | C33 | C32 | 175.9° | 179.7° |
| C22 | O4 | C23 | C24 | 61.4° | 61.1° |
| O4 | C22 | C21 | H14 | 177.3° | 177.5° |
| O4 | C22 | C21 | H15 | 63.0° | 62.3° |
| O4 | C22 | H16 | H17 | 119.0° | 120.1° |
| C22 | O4 | C23 | H33 | 178.3° | 178.8° |
| C22 | O4 | C23 | H34 | 58.9° | 58.9° |
| C24 | C23 | O4 | H33 | 120.3° | 120.0° |
| C24 | C23 | O4 | H34 | 120.3° | 120.0° |
| C23 | C24 | C20 | H13 | 64.3° | 62.9° |
| C23 | C24 | H18 | H19 | 119.7° | 120.2° |
| C24 | C23 | H33 | H34 | 119.1° | 120.1° |
| F | C29 | C28 | C30 | 179.0° | 179.9° |
| F | C29 | C28 | C33 | 177.5° | 180.0° |
| F | C29 | C30 | F1 | 3.7° | 0.0° |
| F | C29 | C30 | C31 | 177.6° | 180.0° |
| C29 | C28 | C33 | F3 | 179.3° | 179.9° |
| C29 | C28 | C33 | C32 | 0.8° | 0.0° |
| C28 | C29 | C30 | F1 | 177.3° | 179.9° |
| C28 | C29 | C30 | C31 | 1.5° | 0.1° |
| C28 | C33 | F3 | C32 | 179.9° | 179.9° |
| C33 | C28 | C29 | C30 | 1.5° | 0.1° |
| C28 | C33 | C32 | F2 | 179.9° | 179.9° |
| C28 | C33 | C32 | C31 | 0.0° | 0.0° |
| F3 | C33 | C32 | F2 | 0.0° | 0.0° |
| F3 | C33 | C32 | C31 | 179.9° | 180.0° |
| C29 | C30 | F1 | C31 | 178.7° | 180.0° |
| C29 | C30 | C31 | C32 | 0.6° | 0.1° |
| C29 | C30 | C31 | N5 | 178.3° | 179.9° |
| C33 | C32 | C31 | C30 | 0.1° | 0.0° |
| C33 | C32 | F2 | C31 | 179.9° | 180.0° |
| C33 | C32 | C31 | N5 | 179.1° | 180.0° |
| C23 | O4 | C22 | H16 | 59.7° | 58.9° |
| C23 | O4 | C22 | H17 | 179.0° | 178.9° |
| O4 | C23 | C24 | H18 | 61.7° | 62.3° |
| O4 | C23 | C24 | H19 | 178.5° | 177.5° |
| O4 | C23 | H33 | H34 | 119.1° | 119.9° |
| F1 | C30 | C31 | C32 | 178.1° | 180.0° |
| F1 | C30 | C31 | N5 | 2.9° | 0.0° |
| C30 | C31 | C32 | F2 | 180.0° | 180.0° |
| C30 | C31 | C32 | N5 | 179.0° | 180.0° |
| C30 | C31 | N5 | N6 | 37.8° | 0.0° |
| F2 | C32 | C31 | N5 | 1.0° | 0.0° |
| C32 | C31 | N5 | N6 | 143.2° | 180.0° |
| C31 | N5 | N6 | N7 | 179.7° | 109.2° |
| N5 | N6 | N7 | H21 | 0.0° | 19.1° |
| H5 | C8 | C9 | H30 | 0.4° | 0.3° |
| H7 | C15 | H8 | H9 | 120.0° | 119.9° |
| H10 | C17 | H11 | H12 | 120.0° | 119.9° |
| H13 | C20 | C21 | H14 | 55.4° | 57.0° |
| H13 | C20 | C21 | H15 | 175.1° | 177.2° |
| H13 | C20 | C24 | H18 | 175.6° | 177.2° |
| H13 | C20 | C24 | H19 | 55.8° | 57.0° |
| H13 | C20 | C19 | H31 | 178.2° | 65.3° |
| H13 | C20 | C19 | H32 | 62.6° | 174.7° |
| H14 | C21 | C22 | H16 | 57.0° | 57.5° |
| H14 | C21 | C22 | H17 | 62.4° | 62.5° |
| H15 | C21 | C22 | H16 | 176.6° | 177.7° |
| H15 | C21 | C22 | H17 | 57.3° | 57.7° |
| H18 | C24 | C23 | H33 | 58.6° | 57.7° |
| H18 | C24 | C23 | H34 | 178.0° | 177.8° |
| H19 | C24 | C23 | H33 | 61.2° | 62.5° |
| H19 | C24 | C23 | H34 | 58.2° | 57.5° |
| H22 | N | C3 | H23 | 134.0° | 120.0° |
| H22 | N | C3 | H24 | 14.9° | 120.0° |
| H25 | C1 | C | H27 | 60.1° | 60.0° |
| H25 | C1 | C | H28 | 59.9° | 60.0° |
| H25 | C1 | C | H29 | 179.9° | 180.0° |
| H26 | C1 | C | H27 | 60.2° | 180.0° |
| H26 | C1 | C | H28 | 179.8° | 59.9° |
| H26 | C1 | C | H29 | 59.8° | 60.0° |
| H27 | C | H28 | H29 | 120.0° | 120.0° |
