ZLM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C9 | doub | 1.21Å | 1.23Å | |
| O | C2 | sing | 1.43Å | 1.41Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C11 | C12 | sing | 1.53Å | 1.49Å | |
| C9 | C10 | sing | 1.51Å | 1.53Å | |
| C9 | N | sing | 1.35Å | 1.34Å | |
| N4 | C19 | doub | 1.31Å | 1.32Å | Aromatic |
| N4 | C32 | sing | 1.34Å | 1.37Å | Aromatic |
| C8 | N | sing | 1.47Å | 1.45Å | |
| C8 | C19 | sing | 1.51Å | 1.50Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| O1 | C2 | sing | 1.43Å | 1.41Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C6 | C5 | sing | 1.53Å | 1.52Å | |
| C10 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C19 | N2 | sing | 1.35Å | 1.36Å | Aromatic |
| C12 | C18 | sing | 1.53Å | 1.54Å | |
| C32 | C20 | doub | 1.36Å | 1.37Å | Aromatic |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C14 | N1 | sing | 1.47Å | 1.50Å | |
| N2 | C20 | sing | 1.38Å | 1.37Å | Aromatic |
| C20 | C21 | sing | 1.48Å | 1.47Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| N1 | C17 | sing | 1.47Å | 1.51Å | |
| N1 | C15 | sing | 1.47Å | 1.50Å | |
| C28 | C21 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.36Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.47Å | |
| C29 | C30 | doub | 1.40Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.39Å | 1.40Å | Aromatic |
| C30 | C23 | sing | 1.42Å | 1.40Å | Aromatic |
| C30 | C31 | sing | 1.47Å | 1.47Å | |
| C23 | C24 | sing | 1.47Å | 1.43Å | |
| O3 | C31 | doub | 1.22Å | 1.22Å | |
| C31 | N3 | sing | 1.35Å | 1.39Å | |
| C24 | C25 | doub | 1.34Å | 1.33Å | |
| N3 | C25 | sing | 1.37Å | 1.37Å | |
| N3 | C26 | sing | 1.47Å | 1.48Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.08Å | 1.08Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | H24 | sing | 1.08Å | 1.08Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.08Å | 1.08Å | |
| C28 | H29 | sing | 1.08Å | 1.08Å | |
| N2 | H30 | sing | 0.97Å | 1.00Å | |
| C32 | H31 | sing | 1.08Å | 1.08Å | |
| C8 | H33 | sing | 1.09Å | 1.10Å | |
| C7 | H34 | sing | 1.09Å | 1.10Å | |
| C7 | H35 | sing | 1.09Å | 1.10Å | |
| C3 | H36 | sing | 1.09Å | 1.10Å | |
| C3 | H37 | sing | 1.09Å | 1.10Å | |
| O1 | H38 | sing | 0.97Å | 0.95Å | |
| O | H39 | sing | 0.97Å | 0.95Å | |
| C1 | H40 | sing | 1.09Å | 1.10Å | |
| C1 | H41 | sing | 1.09Å | 1.10Å | |
| C | H42 | sing | 1.09Å | 1.10Å | |
| C | H43 | sing | 1.09Å | 1.10Å | |
| C | H44 | sing | 1.09Å | 1.10Å | |
| N | H45 | sing | 0.97Å | 1.00Å | |
| C11 | H46 | sing | 1.09Å | 1.10Å | |
| C11 | H47 | sing | 1.09Å | 1.10Å | |
| C17 | H48 | sing | 1.09Å | 1.10Å | |
| C17 | H49 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C9 | C10 | 122.4° | 120.0° |
| O2 | C9 | N | 122.4° | 120.0° |
| O | C2 | O1 | 107.5° | 109.5° |
| O | C2 | C3 | 111.8° | 109.5° |
| O | C2 | C1 | 106.7° | 109.4° |
| C2 | O | H39 | 109.5° | 114.0° |
| C10 | C11 | C12 | 60.3° | 59.9° |
| C11 | C10 | C9 | 124.1° | 117.5° |
| C11 | C10 | C12 | 58.4° | 59.9° |
| C11 | C10 | H8 | 114.4° | 117.5° |
| C10 | C11 | H46 | 120.0° | 117.5° |
| C10 | C11 | H47 | 120.0° | 117.5° |
| C11 | C12 | C10 | 61.2° | 60.1° |
| C11 | C12 | C13 | 119.3° | 117.9° |
| C11 | C12 | C18 | 120.7° | 117.8° |
| C12 | C11 | H46 | 119.9° | 117.5° |
| C12 | C11 | H47 | 120.0° | 117.5° |
| C10 | C9 | N | 115.3° | 120.0° |
| C9 | C10 | C12 | 119.4° | 117.5° |
| C9 | C10 | H8 | 114.4° | 115.5° |
| C9 | N | C8 | 122.5° | 120.0° |
| C9 | N | H45 | 118.7° | 120.0° |
| C19 | N4 | C32 | 104.8° | 109.6° |
| N4 | C19 | C8 | 122.6° | 125.5° |
| N4 | C19 | N2 | 111.7° | 109.0° |
| N4 | C32 | C20 | 111.0° | 107.9° |
| N4 | C32 | H31 | 124.5° | 126.1° |
| N | C8 | C19 | 105.2° | 109.5° |
| N | C8 | C7 | 110.1° | 109.5° |
| N | C8 | H33 | 111.1° | 109.5° |
| C8 | N | H45 | 118.8° | 120.0° |
| C19 | C8 | C7 | 110.0° | 109.5° |
| C8 | C19 | N2 | 125.7° | 125.5° |
| C19 | C8 | H33 | 110.4° | 109.4° |
| C8 | C7 | C6 | 113.8° | 109.5° |
| C7 | C8 | H33 | 110.0° | 109.5° |
| C8 | C7 | H34 | 108.4° | 109.5° |
| C8 | C7 | H35 | 108.4° | 109.5° |
| O1 | C2 | C3 | 106.6° | 109.5° |
| O1 | C2 | C1 | 109.1° | 109.5° |
| C2 | O1 | H38 | 109.5° | 113.9° |
| C7 | C6 | C5 | 112.8° | 109.5° |
| C7 | C6 | H6 | 108.6° | 109.4° |
| C7 | C6 | H7 | 108.6° | 109.4° |
| C6 | C7 | H34 | 108.4° | 109.4° |
| C6 | C7 | H35 | 108.4° | 109.4° |
| C6 | C5 | C4 | 114.6° | 109.5° |
| C6 | C5 | H4 | 108.2° | 109.5° |
| C6 | C5 | H5 | 108.2° | 109.5° |
| C5 | C6 | H6 | 108.6° | 109.5° |
| C5 | C6 | H7 | 108.6° | 109.5° |
| C10 | C12 | C13 | 120.9° | 117.8° |
| C10 | C12 | C18 | 117.5° | 117.8° |
| C12 | C10 | H8 | 114.6° | 117.5° |
| C12 | C13 | C14 | 111.5° | 108.7° |
| C13 | C12 | C18 | 110.0° | 114.7° |
| C12 | C13 | H9 | 109.0° | 109.6° |
| C12 | C13 | H10 | 108.9° | 109.6° |
| C13 | C14 | N1 | 111.0° | 109.4° |
| C14 | C13 | H9 | 109.0° | 109.6° |
| C14 | C13 | H10 | 109.0° | 109.6° |
| C13 | C14 | H16 | 109.1° | 109.5° |
| C13 | C14 | H17 | 109.1° | 109.5° |
| C5 | C4 | C3 | 112.1° | 109.5° |
| C5 | C4 | H2 | 108.8° | 109.5° |
| C5 | C4 | H3 | 108.8° | 109.5° |
| C4 | C5 | H4 | 108.2° | 109.5° |
| C4 | C5 | H5 | 108.1° | 109.5° |
| C4 | C3 | C2 | 115.6° | 109.5° |
| C3 | C4 | H2 | 108.8° | 109.5° |
| C3 | C4 | H3 | 108.8° | 109.5° |
| C4 | C3 | H36 | 107.9° | 109.5° |
| C4 | C3 | H37 | 107.9° | 109.4° |
| C3 | C2 | C1 | 114.9° | 109.5° |
| C2 | C3 | H36 | 107.9° | 109.5° |
| C2 | C3 | H37 | 107.9° | 109.4° |
| C2 | C1 | C | 114.5° | 109.5° |
| C2 | C1 | H40 | 108.2° | 109.5° |
| C2 | C1 | H41 | 108.2° | 109.4° |
| C19 | N2 | C20 | 107.6° | 107.1° |
| C19 | N2 | H30 | 126.2° | 126.5° |
| C12 | C18 | C17 | 112.8° | 108.6° |
| C12 | C18 | H21 | 108.6° | 109.6° |
| C12 | C18 | H22 | 108.6° | 109.8° |
| C32 | C20 | N2 | 104.9° | 106.4° |
| C32 | C20 | C21 | 130.8° | 126.8° |
| C20 | C32 | H31 | 124.5° | 126.0° |
| C | C1 | H40 | 108.2° | 109.5° |
| C | C1 | H41 | 108.2° | 109.5° |
| C1 | C | H42 | 109.5° | 109.5° |
| C1 | C | H43 | 109.5° | 109.5° |
| C1 | C | H44 | 109.4° | 109.5° |
| C14 | N1 | C17 | 111.8° | 111.5° |
| C14 | N1 | C15 | 110.2° | 111.0° |
| N1 | C14 | H16 | 109.1° | 109.4° |
| N1 | C14 | H17 | 109.1° | 109.5° |
| N2 | C20 | C21 | 124.3° | 126.8° |
| C20 | N2 | H30 | 126.2° | 126.4° |
| C20 | C21 | C28 | 120.6° | 119.8° |
| C20 | C21 | C22 | 120.0° | 119.8° |
| C18 | C17 | N1 | 111.0° | 109.4° |
| C17 | C18 | H21 | 108.6° | 109.6° |
| C17 | C18 | H22 | 108.6° | 109.6° |
| C18 | C17 | H48 | 109.1° | 109.5° |
| C18 | C17 | H49 | 109.1° | 109.5° |
| C17 | N1 | C15 | 112.9° | 111.0° |
| N1 | C17 | H48 | 109.1° | 109.4° |
| N1 | C17 | H49 | 109.1° | 109.5° |
| N1 | C15 | C16 | 116.7° | 109.5° |
| N1 | C15 | H11 | 107.6° | 109.5° |
| N1 | C15 | H12 | 107.6° | 109.5° |
| C21 | C28 | C29 | 120.6° | 120.8° |
| C28 | C21 | C22 | 119.4° | 120.4° |
| C21 | C28 | H29 | 119.7° | 119.6° |
| C28 | C29 | C30 | 120.4° | 119.9° |
| C28 | C29 | H24 | 119.8° | 120.1° |
| C29 | C28 | H29 | 119.7° | 119.6° |
| C21 | C22 | C23 | 120.7° | 119.3° |
| C21 | C22 | H28 | 119.6° | 120.4° |
| C16 | C15 | H11 | 107.6° | 109.5° |
| C16 | C15 | H12 | 107.6° | 109.5° |
| C15 | C16 | H18 | 109.5° | 109.5° |
| C15 | C16 | H19 | 109.5° | 109.5° |
| C15 | C16 | H20 | 109.5° | 109.5° |
| C29 | C30 | C23 | 119.7° | 119.9° |
| C29 | C30 | C31 | 119.4° | 121.8° |
| C30 | C29 | H24 | 119.8° | 120.0° |
| C22 | C23 | C30 | 119.2° | 119.7° |
| C22 | C23 | C24 | 121.8° | 121.8° |
| C23 | C22 | H28 | 119.7° | 120.3° |
| C23 | C30 | C31 | 120.9° | 118.2° |
| C30 | C23 | C24 | 118.9° | 118.4° |
| C30 | C31 | O3 | 123.9° | 120.4° |
| C30 | C31 | N3 | 114.6° | 119.3° |
| C23 | C24 | C25 | 119.7° | 119.3° |
| C23 | C24 | H13 | 120.2° | 120.4° |
| O3 | C31 | N3 | 121.5° | 120.3° |
| C31 | N3 | C25 | 123.4° | 122.3° |
| C31 | N3 | C26 | 118.0° | 118.8° |
| C24 | C25 | N3 | 122.4° | 122.4° |
| C25 | C24 | H13 | 120.1° | 120.3° |
| C24 | C25 | H23 | 118.8° | 118.8° |
| C25 | N3 | C26 | 118.6° | 118.9° |
| N3 | C25 | H23 | 118.8° | 118.8° |
| N3 | C26 | C27 | 111.7° | 109.5° |
| N3 | C26 | H14 | 108.9° | 109.5° |
| N3 | C26 | H15 | 108.9° | 109.4° |
| C27 | C26 | H14 | 108.9° | 109.5° |
| C27 | C26 | H15 | 108.9° | 109.5° |
| C26 | C27 | H25 | 109.5° | 109.5° |
| C26 | C27 | H26 | 109.5° | 109.5° |
| C26 | C27 | H27 | 109.5° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.4° |
| H4 | C5 | H5 | 109.4° | 109.4° |
| H6 | C6 | H7 | 109.5° | 109.4° |
| H9 | C13 | H10 | 109.5° | 109.7° |
| H11 | C15 | H12 | 109.5° | 109.4° |
| H14 | C26 | H15 | 109.5° | 109.5° |
| H16 | C14 | H17 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.5° |
| H18 | C16 | H20 | 109.4° | 109.5° |
| H19 | C16 | H20 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.4° | 109.6° |
| H25 | C27 | H26 | 109.5° | 109.4° |
| H25 | C27 | H27 | 109.5° | 109.4° |
| H26 | C27 | H27 | 109.4° | 109.5° |
| H34 | C7 | H35 | 109.5° | 109.4° |
| H36 | C3 | H37 | 109.5° | 109.5° |
| H40 | C1 | H41 | 109.5° | 109.5° |
| H42 | C | H43 | 109.5° | 109.5° |
| H42 | C | H44 | 109.5° | 109.4° |
| H43 | C | H44 | 109.5° | 109.5° |
| H46 | C11 | H47 | 109.4° | 115.6° |
| H48 | C17 | H49 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C9 | C10 | C11 | 5.3° | 21.0° |
| O2 | C9 | C10 | N | 179.0° | 180.0° |
| O2 | C9 | N | C8 | 0.3° | 0.0° |
| O2 | C9 | C10 | C12 | 64.5° | 89.6° |
| O2 | C9 | C10 | H8 | 154.1° | 124.7° |
| O2 | C9 | N | H45 | 179.7° | 179.9° |
| O | C2 | O1 | C3 | 120.0° | 120.0° |
| O | C2 | O1 | C1 | 115.3° | 119.9° |
| O | C2 | C3 | C4 | 58.2° | 60.1° |
| O | C2 | C3 | C1 | 121.7° | 119.9° |
| O | C2 | C1 | C | 165.7° | 60.0° |
| O | C2 | C3 | H36 | 62.7° | 60.0° |
| O | C2 | C3 | H37 | 179.1° | 180.0° |
| O | C2 | O1 | H38 | 180.0° | 180.0° |
| O | C2 | C1 | H40 | 73.6° | 60.1° |
| O | C2 | C1 | H41 | 44.9° | 180.0° |
| C10 | C11 | C12 | H46 | 109.6° | 107.5° |
| C10 | C11 | C12 | H47 | 109.6° | 107.5° |
| C11 | C10 | C9 | C12 | 69.8° | 68.6° |
| C11 | C10 | C9 | H8 | 148.8° | 145.7° |
| C11 | C10 | C9 | N | 175.6° | 158.9° |
| C11 | C10 | C12 | H8 | 104.6° | 107.5° |
| C11 | C10 | C12 | C13 | 108.8° | 107.8° |
| C10 | C11 | C12 | C18 | 106.6° | 107.8° |
| C10 | C11 | H46 | H47 | 144.6° | 145.8° |
| C11 | C12 | C13 | C18 | 145.7° | 145.5° |
| C11 | C12 | C13 | C14 | 159.7° | 163.1° |
| C11 | C12 | C18 | C17 | 162.3° | 163.1° |
| C11 | C12 | C13 | H9 | 79.9° | 43.3° |
| C11 | C12 | C13 | H10 | 39.5° | 77.1° |
| C11 | C12 | C18 | H21 | 41.8° | 43.4° |
| C11 | C12 | C18 | H22 | 77.2° | 77.1° |
| C12 | C11 | H46 | H47 | 144.5° | 145.7° |
| C10 | C9 | N | C8 | 179.3° | 180.0° |
| C9 | C10 | C12 | H8 | 141.3° | 145.0° |
| C9 | C10 | C12 | C13 | 5.4° | 0.3° |
| C9 | C10 | C12 | C18 | 134.1° | 144.7° |
| C10 | C9 | N | H45 | 0.7° | 0.0° |
| C9 | C10 | C11 | H46 | 144.2° | 145.1° |
| C9 | C10 | C11 | H47 | 3.4° | 0.1° |
| C9 | N | C8 | H45 | 180.0° | 180.0° |
| C9 | N | C8 | C19 | 90.9° | 155.0° |
| C9 | N | C8 | C7 | 150.7° | 85.0° |
| N | C9 | C10 | C12 | 114.5° | 90.4° |
| N | C9 | C10 | H8 | 26.8° | 55.3° |
| C9 | N | C8 | H33 | 28.6° | 35.0° |
| N4 | C19 | C8 | N | 136.6° | 174.8° |
| N4 | C19 | C8 | N2 | 178.6° | 179.7° |
| N4 | C19 | C8 | C7 | 104.9° | 54.8° |
| C19 | N4 | C32 | C20 | 0.2° | 0.1° |
| N4 | C19 | N2 | C20 | 0.1° | 0.2° |
| N4 | C19 | N2 | H30 | 179.8° | 179.8° |
| C19 | N4 | C32 | H31 | 179.8° | 179.9° |
| N4 | C19 | C8 | H33 | 16.7° | 65.2° |
| C32 | N4 | C19 | C8 | 178.6° | 179.8° |
| C32 | N4 | C19 | N2 | 0.2° | 0.0° |
| N4 | C32 | C20 | H31 | 180.0° | 180.0° |
| N4 | C32 | C20 | N2 | 0.1° | 0.2° |
| N4 | C32 | C20 | C21 | 178.6° | 180.0° |
| N | C8 | C19 | C7 | 118.5° | 120.1° |
| N | C8 | C19 | H33 | 119.9° | 120.0° |
| N | C8 | C7 | H33 | 122.8° | 120.0° |
| N | C8 | C7 | C6 | 176.4° | 65.0° |
| N | C8 | C19 | N2 | 44.8° | 4.9° |
| N | C8 | C7 | H34 | 55.7° | 175.0° |
| N | C8 | C7 | H35 | 63.0° | 55.0° |
| C19 | C8 | C7 | H33 | 121.8° | 120.0° |
| C19 | C8 | C7 | C6 | 68.2° | 175.0° |
| C8 | C19 | N2 | C20 | 178.6° | 179.9° |
| C8 | C19 | N2 | H30 | 1.4° | 0.1° |
| C19 | C8 | C7 | H34 | 171.1° | 55.0° |
| C19 | C8 | C7 | H35 | 52.4° | 65.0° |
| C19 | C8 | N | H45 | 89.1° | 25.0° |
| C8 | C7 | C6 | H34 | 120.7° | 120.1° |
| C8 | C7 | C6 | H35 | 120.6° | 120.0° |
| C8 | C7 | C6 | C5 | 177.7° | 180.0° |
| C7 | C8 | C19 | N2 | 73.7° | 125.0° |
| C8 | C7 | C6 | H6 | 57.2° | 59.9° |
| C8 | C7 | C6 | H7 | 61.7° | 60.0° |
| C8 | C7 | H34 | H35 | 118.0° | 120.1° |
| C7 | C8 | N | H45 | 29.3° | 95.1° |
| O1 | C2 | C3 | C4 | 59.0° | 60.0° |
| O1 | C2 | C3 | C1 | 121.0° | 120.0° |
| O1 | C2 | C1 | C | 78.5° | 60.0° |
| O1 | C2 | C3 | H36 | 179.9° | 180.0° |
| O1 | C2 | C3 | H37 | 61.9° | 60.0° |
| O1 | C2 | O | H39 | 180.0° | 180.0° |
| O1 | C2 | C1 | H40 | 42.3° | 180.0° |
| O1 | C2 | C1 | H41 | 160.8° | 60.0° |
| C7 | C6 | C5 | H6 | 120.5° | 120.0° |
| C7 | C6 | C5 | H7 | 120.5° | 120.0° |
| C7 | C6 | C5 | C4 | 171.8° | 180.0° |
| C7 | C6 | C5 | H4 | 51.1° | 60.0° |
| C7 | C6 | C5 | H5 | 67.4° | 60.0° |
| C7 | C6 | H6 | H7 | 118.5° | 119.9° |
| C6 | C7 | C8 | H33 | 53.6° | 55.0° |
| C6 | C7 | H34 | H35 | 118.0° | 119.9° |
| C6 | C5 | C4 | H4 | 120.8° | 120.0° |
| C6 | C5 | C4 | H5 | 120.8° | 120.0° |
| C6 | C5 | C4 | C3 | 177.8° | 180.0° |
| C6 | C5 | C4 | H2 | 57.4° | 60.0° |
| C6 | C5 | C4 | H3 | 61.8° | 60.0° |
| C6 | C5 | H4 | H5 | 117.7° | 120.0° |
| C5 | C6 | H6 | H7 | 118.5° | 120.1° |
| C5 | C6 | C7 | H34 | 61.6° | 59.9° |
| C5 | C6 | C7 | H35 | 57.1° | 60.0° |
| C10 | C12 | C13 | C18 | 142.2° | 145.5° |
| C10 | C12 | C13 | C14 | 87.6° | 94.1° |
| C10 | C12 | C18 | C17 | 91.1° | 94.1° |
| C10 | C12 | C13 | H9 | 152.1° | 25.7° |
| C10 | C12 | C13 | H10 | 32.7° | 146.2° |
| C10 | C12 | C18 | H21 | 29.4° | 25.7° |
| C10 | C12 | C18 | H22 | 148.4° | 146.1° |
| C12 | C13 | C14 | H9 | 120.3° | 119.8° |
| C12 | C13 | C14 | H10 | 120.3° | 119.7° |
| C12 | C13 | C14 | N1 | 57.6° | 55.6° |
| C13 | C12 | C18 | C17 | 52.6° | 51.4° |
| C13 | C12 | C10 | H8 | 146.7° | 144.7° |
| C12 | C13 | H9 | H10 | 119.1° | 120.4° |
| C12 | C13 | C14 | H16 | 177.9° | 64.3° |
| C12 | C13 | C14 | H17 | 62.6° | 175.6° |
| C13 | C12 | C18 | H21 | 173.1° | 171.1° |
| C13 | C12 | C18 | H22 | 68.0° | 68.4° |
| C13 | C12 | C11 | H46 | 139.0° | 144.8° |
| C13 | C12 | C11 | H47 | 1.8° | 0.3° |
| C14 | C13 | C12 | C18 | 54.6° | 51.4° |
| C13 | C14 | N1 | H16 | 120.2° | 120.0° |
| C13 | C14 | N1 | H17 | 120.2° | 120.0° |
| C13 | C14 | N1 | C17 | 57.7° | 64.8° |
| C13 | C14 | N1 | C15 | 175.9° | 170.8° |
| C14 | C13 | H9 | H10 | 119.1° | 120.4° |
| C13 | C14 | H16 | H17 | 119.3° | 120.0° |
| C5 | C4 | C3 | H2 | 120.4° | 120.0° |
| C5 | C4 | C3 | H3 | 120.4° | 120.0° |
| C5 | C4 | C3 | C2 | 161.4° | 180.0° |
| C5 | C4 | H2 | H3 | 118.8° | 120.0° |
| C4 | C5 | H4 | H5 | 117.6° | 120.0° |
| C4 | C5 | C6 | H6 | 67.7° | 60.0° |
| C4 | C5 | C6 | H7 | 51.3° | 60.0° |
| C5 | C4 | C3 | H36 | 40.5° | 60.0° |
| C5 | C4 | C3 | H37 | 77.7° | 60.0° |
| C4 | C3 | C2 | H36 | 120.9° | 120.1° |
| C4 | C3 | C2 | H37 | 120.9° | 119.9° |
| C4 | C3 | C2 | C1 | 179.9° | 180.0° |
| C3 | C4 | H2 | H3 | 118.8° | 120.0° |
| C3 | C4 | C5 | H4 | 61.5° | 60.0° |
| C3 | C4 | C5 | H5 | 57.0° | 59.9° |
| C4 | C3 | H36 | H37 | 117.2° | 120.0° |
| C3 | C2 | C1 | C | 41.2° | 180.0° |
| C2 | C3 | C4 | H2 | 78.2° | 59.9° |
| C2 | C3 | C4 | H3 | 41.0° | 60.0° |
| C2 | C3 | H36 | H37 | 117.2° | 120.0° |
| C3 | C2 | O1 | H38 | 60.0° | 60.0° |
| C3 | C2 | O | H39 | 63.3° | 60.0° |
| C3 | C2 | C1 | H40 | 161.9° | 59.9° |
| C3 | C2 | C1 | H41 | 79.5° | 60.0° |
| C2 | C1 | C | H40 | 120.7° | 120.0° |
| C2 | C1 | C | H41 | 120.8° | 120.0° |
| C1 | C2 | C3 | H36 | 59.0° | 59.9° |
| C1 | C2 | C3 | H37 | 59.2° | 60.1° |
| C1 | C2 | O1 | H38 | 64.7° | 60.1° |
| C1 | C2 | O | H39 | 63.1° | 60.0° |
| C2 | C1 | H40 | H41 | 117.7° | 119.9° |
| C2 | C1 | C | H42 | 180.0° | 60.0° |
| C2 | C1 | C | H43 | 60.0° | 60.0° |
| C2 | C1 | C | H44 | 60.0° | 180.0° |
| C19 | N2 | C20 | C32 | 0.0° | 0.2° |
| C19 | N2 | C20 | H30 | 180.0° | 180.0° |
| C19 | N2 | C20 | C21 | 178.8° | 180.0° |
| N2 | C19 | C8 | H33 | 164.7° | 115.0° |
| C12 | C18 | C17 | H21 | 120.5° | 119.7° |
| C12 | C18 | C17 | H22 | 120.5° | 120.0° |
| C12 | C18 | C17 | N1 | 52.9° | 55.6° |
| C18 | C12 | C10 | H8 | 7.2° | 0.3° |
| C18 | C12 | C13 | H9 | 65.7° | 171.2° |
| C18 | C12 | C13 | H10 | 174.9° | 68.4° |
| C12 | C18 | H21 | H22 | 118.5° | 120.6° |
| C18 | C12 | C11 | H46 | 3.0° | 0.3° |
| C18 | C12 | C11 | H47 | 143.8° | 144.7° |
| C12 | C18 | C17 | H48 | 67.3° | 175.6° |
| C12 | C18 | C17 | H49 | 173.2° | 64.4° |
| C32 | C20 | N2 | C21 | 178.8° | 179.8° |
| C32 | C20 | C21 | C28 | 18.1° | 179.6° |
| C32 | C20 | C21 | C22 | 162.7° | 0.3° |
| C32 | C20 | N2 | H30 | 180.0° | 179.8° |
| C | C1 | H40 | H41 | 117.7° | 120.0° |
| C1 | C | H42 | H43 | 120.0° | 120.0° |
| C1 | C | H42 | H44 | 120.0° | 120.0° |
| C1 | C | H43 | H44 | 120.0° | 120.0° |
| C14 | N1 | C17 | C18 | 54.9° | 64.9° |
| C14 | N1 | C17 | C15 | 124.9° | 124.3° |
| C14 | N1 | C15 | C16 | 174.5° | 65.3° |
| N1 | C14 | C13 | H9 | 62.7° | 175.4° |
| N1 | C14 | C13 | H10 | 177.9° | 64.2° |
| C14 | N1 | C15 | H11 | 53.4° | 54.7° |
| C14 | N1 | C15 | H12 | 64.5° | 174.7° |
| N1 | C14 | H16 | H17 | 119.3° | 120.0° |
| C14 | N1 | C17 | H48 | 65.3° | 175.2° |
| C14 | N1 | C17 | H49 | 175.2° | 55.1° |
| N2 | C20 | C21 | C28 | 160.4° | 0.1° |
| N2 | C20 | C21 | C22 | 18.8° | 180.0° |
| N2 | C20 | C32 | H31 | 179.9° | 179.8° |
| C20 | C21 | C28 | C22 | 179.2° | 179.9° |
| C20 | C21 | C28 | C29 | 178.3° | 180.0° |
| C20 | C21 | C22 | C23 | 178.4° | 180.0° |
| C20 | C21 | C22 | H28 | 1.6° | 0.1° |
| C20 | C21 | C28 | H29 | 1.7° | 0.1° |
| C21 | C20 | N2 | H30 | 1.1° | 0.0° |
| C21 | C20 | C32 | H31 | 1.4° | 0.0° |
| C18 | C17 | N1 | H48 | 120.2° | 120.0° |
| C18 | C17 | N1 | H49 | 120.3° | 120.0° |
| C18 | C17 | N1 | C15 | 179.9° | 170.8° |
| C17 | C18 | H21 | H22 | 118.5° | 120.3° |
| C18 | C17 | H48 | H49 | 119.3° | 120.0° |
| C17 | N1 | C15 | C16 | 59.7° | 170.0° |
| C17 | N1 | C15 | H11 | 179.2° | 70.0° |
| C17 | N1 | C15 | H12 | 61.3° | 50.0° |
| C17 | N1 | C14 | H16 | 177.9° | 55.1° |
| C17 | N1 | C14 | H17 | 62.6° | 175.2° |
| N1 | C17 | C18 | H21 | 173.4° | 175.4° |
| N1 | C17 | C18 | H22 | 67.6° | 64.3° |
| N1 | C17 | H48 | H49 | 119.3° | 120.0° |
| N1 | C15 | C16 | H11 | 121.0° | 120.0° |
| N1 | C15 | C16 | H12 | 121.1° | 120.0° |
| N1 | C15 | H11 | H12 | 116.7° | 120.0° |
| C15 | N1 | C14 | H16 | 55.7° | 69.2° |
| C15 | N1 | C14 | H17 | 63.9° | 50.8° |
| N1 | C15 | C16 | H18 | 180.0° | 60.0° |
| N1 | C15 | C16 | H19 | 60.0° | 180.0° |
| N1 | C15 | C16 | H20 | 60.0° | 60.0° |
| C15 | N1 | C17 | H48 | 59.6° | 50.9° |
| C15 | N1 | C17 | H49 | 59.9° | 69.2° |
| C21 | C28 | C29 | H29 | 180.0° | 180.0° |
| C21 | C28 | C29 | C30 | 0.2° | 0.0° |
| C28 | C21 | C22 | C23 | 0.8° | 0.1° |
| C21 | C28 | C29 | H24 | 179.8° | 179.9° |
| C28 | C21 | C22 | H28 | 179.2° | 180.0° |
| C29 | C28 | C21 | C22 | 0.9° | 0.1° |
| C28 | C29 | C30 | H24 | 180.0° | 179.9° |
| C28 | C29 | C30 | C23 | 0.7° | 0.0° |
| C28 | C29 | C30 | C31 | 179.7° | 179.2° |
| C21 | C22 | C23 | H28 | 180.0° | 179.9° |
| C21 | C22 | C23 | C30 | 0.1° | 0.0° |
| C21 | C22 | C23 | C24 | 179.4° | 180.0° |
| C22 | C21 | C28 | H29 | 179.1° | 179.9° |
| C16 | C15 | H11 | H12 | 116.7° | 120.0° |
| C15 | C16 | H18 | H19 | 120.0° | 120.0° |
| C15 | C16 | H18 | H20 | 120.0° | 120.0° |
| C15 | C16 | H19 | H20 | 120.0° | 120.0° |
| C29 | C30 | C23 | C22 | 0.8° | 0.0° |
| C29 | C30 | C23 | C31 | 179.6° | 179.2° |
| C29 | C30 | C23 | C24 | 178.7° | 180.0° |
| C29 | C30 | C31 | O3 | 0.6° | 0.3° |
| C29 | C30 | C31 | N3 | 178.8° | 179.7° |
| C30 | C29 | C28 | H29 | 179.8° | 180.0° |
| C22 | C23 | C30 | C24 | 179.5° | 180.0° |
| C22 | C23 | C30 | C31 | 179.6° | 179.3° |
| C22 | C23 | C24 | C25 | 179.9° | 179.5° |
| C22 | C23 | C24 | H13 | 0.1° | 0.5° |
| C23 | C30 | C31 | O3 | 179.8° | 179.5° |
| C23 | C30 | C31 | N3 | 0.8° | 0.5° |
| C30 | C23 | C24 | C25 | 0.4° | 0.5° |
| C30 | C23 | C24 | H13 | 179.6° | 179.5° |
| C23 | C30 | C29 | H24 | 179.3° | 180.0° |
| C30 | C23 | C22 | H28 | 179.9° | 179.9° |
| C31 | C30 | C23 | C24 | 0.9° | 0.7° |
| C30 | C31 | O3 | N3 | 179.4° | 179.9° |
| C30 | C31 | N3 | C25 | 0.4° | 0.1° |
| C30 | C31 | N3 | C26 | 178.9° | 179.7° |
| C31 | C30 | C29 | H24 | 0.3° | 0.8° |
| C23 | C24 | C25 | H13 | 180.0° | 180.0° |
| C23 | C24 | C25 | N3 | 0.1° | 0.0° |
| C23 | C24 | C25 | H23 | 179.9° | 180.0° |
| C24 | C23 | C22 | H28 | 0.6° | 0.0° |
| O3 | C31 | N3 | C25 | 179.8° | 180.0° |
| O3 | C31 | N3 | C26 | 0.5° | 0.2° |
| C31 | N3 | C25 | C24 | 0.1° | 0.2° |
| C31 | N3 | C25 | C26 | 179.3° | 179.8° |
| C31 | N3 | C26 | C27 | 118.5° | 90.3° |
| C31 | N3 | C26 | H14 | 1.8° | 29.8° |
| C31 | N3 | C26 | H15 | 121.2° | 149.7° |
| C31 | N3 | C25 | H23 | 179.9° | 179.8° |
| C24 | C25 | N3 | H23 | 180.0° | 180.0° |
| C24 | C25 | N3 | C26 | 179.3° | 180.0° |
| C25 | N3 | C26 | C27 | 62.2° | 90.0° |
| N3 | C25 | C24 | H13 | 179.9° | 180.0° |
| C25 | N3 | C26 | H14 | 177.5° | 150.0° |
| C25 | N3 | C26 | H15 | 58.1° | 30.0° |
| N3 | C26 | C27 | H14 | 120.3° | 120.0° |
| N3 | C26 | C27 | H15 | 120.3° | 120.0° |
| N3 | C26 | H14 | H15 | 119.0° | 120.0° |
| C26 | N3 | C25 | H23 | 0.7° | 0.0° |
| N3 | C26 | C27 | H25 | 180.0° | 60.0° |
| N3 | C26 | C27 | H26 | 60.0° | 60.0° |
| N3 | C26 | C27 | H27 | 60.0° | 180.0° |
| C27 | C26 | H14 | H15 | 119.0° | 120.0° |
| C26 | C27 | H25 | H26 | 120.0° | 120.0° |
| C26 | C27 | H25 | H27 | 120.0° | 120.0° |
| C26 | C27 | H26 | H27 | 120.0° | 120.0° |
| H2 | C4 | C5 | H4 | 178.2° | 60.1° |
| H2 | C4 | C5 | H5 | 63.4° | 180.0° |
| H2 | C4 | C3 | H36 | 160.9° | 180.0° |
| H2 | C4 | C3 | H37 | 42.7° | 60.0° |
| H3 | C4 | C5 | H4 | 59.0° | 180.0° |
| H3 | C4 | C5 | H5 | 177.4° | 60.1° |
| H3 | C4 | C3 | H36 | 79.9° | 60.1° |
| H3 | C4 | C3 | H37 | 161.9° | 180.0° |
| H4 | C5 | C6 | H6 | 171.5° | 180.0° |
| H4 | C5 | C6 | H7 | 69.5° | 60.0° |
| H5 | C5 | C6 | H6 | 53.1° | 60.0° |
| H5 | C5 | C6 | H7 | 172.1° | 180.0° |
| H6 | C6 | C7 | H34 | 177.9° | 180.0° |
| H6 | C6 | C7 | H35 | 63.4° | 60.1° |
| H7 | C6 | C7 | H34 | 58.9° | 60.1° |
| H7 | C6 | C7 | H35 | 177.6° | 180.0° |
| H8 | C10 | C11 | H46 | 4.6° | 0.0° |
| H8 | C10 | C11 | H47 | 145.4° | 145.1° |
| H9 | C13 | C14 | H16 | 57.5° | 55.4° |
| H9 | C13 | C14 | H17 | 177.1° | 64.6° |
| H10 | C13 | C14 | H16 | 61.9° | 175.9° |
| H10 | C13 | C14 | H17 | 57.7° | 55.9° |
| H11 | C15 | C16 | H18 | 58.9° | 60.0° |
| H11 | C15 | C16 | H19 | 179.0° | 60.0° |
| H11 | C15 | C16 | H20 | 61.0° | 180.0° |
| H12 | C15 | C16 | H18 | 59.0° | 180.0° |
| H12 | C15 | C16 | H19 | 61.1° | 60.0° |
| H12 | C15 | C16 | H20 | 178.9° | 60.0° |
| H13 | C24 | C25 | H23 | 0.1° | 0.0° |
| H14 | C26 | C27 | H25 | 59.7° | 180.0° |
| H14 | C26 | C27 | H26 | 179.7° | 60.0° |
| H14 | C26 | C27 | H27 | 60.3° | 60.0° |
| H15 | C26 | C27 | H25 | 59.7° | 60.0° |
| H15 | C26 | C27 | H26 | 60.4° | 180.0° |
| H15 | C26 | C27 | H27 | 179.7° | 60.0° |
| H18 | C16 | H19 | H20 | 120.0° | 120.0° |
| H21 | C18 | C17 | H48 | 53.2° | 64.7° |
| H21 | C18 | C17 | H49 | 66.3° | 55.3° |
| H22 | C18 | C17 | H48 | 172.2° | 55.6° |
| H22 | C18 | C17 | H49 | 52.6° | 175.6° |
| H24 | C29 | C28 | H29 | 0.2° | 0.0° |
| H25 | C27 | H26 | H27 | 120.0° | 119.9° |
| H33 | C8 | C7 | H34 | 67.1° | 65.0° |
| H33 | C8 | C7 | H35 | 174.2° | 175.0° |
| H33 | C8 | N | H45 | 151.4° | 144.9° |
| H40 | C1 | C | H42 | 59.3° | 179.9° |
| H40 | C1 | C | H43 | 179.3° | 60.1° |
| H40 | C1 | C | H44 | 60.7° | 60.0° |
| H41 | C1 | C | H42 | 59.3° | 60.0° |
| H41 | C1 | C | H43 | 60.8° | 180.0° |
| H41 | C1 | C | H44 | 179.3° | 60.0° |
| H42 | C | H43 | H44 | 120.0° | 120.0° |
