GZ9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C6 | sing | 1.53Å | 1.51Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C16 | C15 | sing | 1.53Å | 1.50Å | |
| C6 | C5 | sing | 1.53Å | 1.51Å | |
| C17 | C15 | sing | 1.53Å | 1.51Å | |
| C15 | C18 | sing | 1.53Å | 1.50Å | |
| C15 | O2 | sing | 1.43Å | 1.40Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C5 | N3 | sing | 1.46Å | 1.44Å | |
| C5 | C10 | sing | 1.53Å | 1.52Å | |
| N3 | C4 | sing | 1.35Å | 1.30Å | |
| C4 | O1 | doub | 1.22Å | 1.18Å | |
| C4 | N2 | sing | 1.35Å | 1.29Å | |
| C22 | C23 | doub | 1.38Å | 1.36Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.36Å | Aromatic |
| N2 | C3 | sing | 1.39Å | 1.33Å | |
| O2 | C14 | sing | 1.43Å | 1.41Å | |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| N1 | C3 | doub | 1.32Å | 1.32Å | Aromatic |
| N1 | C2 | sing | 1.32Å | 1.33Å | Aromatic |
| C3 | C11 | sing | 1.39Å | 1.35Å | Aromatic |
| C1 | C2 | sing | 1.51Å | 1.49Å | |
| C2 | C20 | doub | 1.39Å | 1.36Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.48Å | |
| C11 | C13 | doub | 1.38Å | 1.35Å | Aromatic |
| C13 | C20 | sing | 1.40Å | 1.37Å | Aromatic |
| C13 | C14 | sing | 1.51Å | 1.48Å | |
| C20 | C21 | sing | 1.48Å | 1.48Å | |
| C21 | C29 | doub | 1.39Å | 1.37Å | Aromatic |
| C14 | C19 | sing | 1.51Å | 1.51Å | |
| C24 | O5 | sing | 1.36Å | 1.34Å | |
| C24 | C28 | doub | 1.38Å | 1.37Å | Aromatic |
| O5 | C25 | sing | 1.43Å | 1.40Å | |
| C29 | C28 | sing | 1.38Å | 1.37Å | Aromatic |
| C29 | C30 | sing | 1.51Å | 1.49Å | |
| C28 | C27 | sing | 1.51Å | 1.50Å | |
| C25 | C26 | sing | 1.53Å | 1.50Å | |
| C19 | O4 | doub | 1.21Å | 1.22Å | |
| C19 | O3 | sing | 1.34Å | 1.21Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| N2 | H7 | sing | 0.97Å | 1.00Å | |
| N3 | H8 | sing | 0.97Å | 1.00Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H28 | sing | 1.09Å | 1.10Å | |
| C18 | H29 | sing | 1.09Å | 1.10Å | |
| O3 | H30 | sing | 0.97Å | 0.95Å | |
| C22 | H31 | sing | 1.08Å | 1.08Å | |
| C23 | H32 | sing | 1.08Å | 1.08Å | |
| C30 | H33 | sing | 1.09Å | 1.10Å | |
| C30 | H34 | sing | 1.09Å | 1.10Å | |
| C30 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| C25 | H37 | sing | 1.09Å | 1.10Å | |
| C26 | H38 | sing | 1.09Å | 1.10Å | |
| C26 | H39 | sing | 1.09Å | 1.10Å | |
| C27 | H40 | sing | 1.09Å | 1.10Å | |
| C27 | H41 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C6 | C7 | C8 | 110.4° | 109.5° |
| C7 | C6 | C5 | 111.6° | 109.5° |
| C7 | C6 | H5 | 109.0° | 109.5° |
| C7 | C6 | H6 | 108.9° | 109.4° |
| C6 | C7 | H9 | 109.2° | 109.5° |
| C6 | C7 | H10 | 109.2° | 109.5° |
| C7 | C8 | C9 | 112.1° | 109.5° |
| C8 | C7 | H9 | 109.2° | 109.5° |
| C8 | C7 | H10 | 109.3° | 109.4° |
| C7 | C8 | H11 | 108.8° | 109.4° |
| C7 | C8 | H12 | 108.8° | 109.5° |
| C16 | C15 | C17 | 109.9° | 109.4° |
| C16 | C15 | C18 | 111.1° | 109.4° |
| C16 | C15 | O2 | 107.8° | 109.5° |
| C15 | C16 | H21 | 109.5° | 109.4° |
| C15 | C16 | H22 | 109.5° | 109.5° |
| C15 | C16 | H23 | 109.5° | 109.5° |
| C6 | C5 | N3 | 108.9° | 109.5° |
| C6 | C5 | C10 | 107.0° | 109.4° |
| C6 | C5 | H4 | 109.8° | 109.4° |
| C5 | C6 | H5 | 108.9° | 109.5° |
| C5 | C6 | H6 | 108.9° | 109.5° |
| C17 | C15 | C18 | 108.9° | 109.5° |
| C17 | C15 | O2 | 107.5° | 109.5° |
| C15 | C17 | H24 | 109.5° | 109.5° |
| C15 | C17 | H25 | 109.5° | 109.5° |
| C15 | C17 | H26 | 109.4° | 109.4° |
| C18 | C15 | O2 | 111.6° | 109.5° |
| C15 | C18 | H27 | 109.5° | 109.5° |
| C15 | C18 | H28 | 109.5° | 109.5° |
| C15 | C18 | H29 | 109.4° | 109.5° |
| C15 | O2 | C14 | 117.4° | 114.0° |
| C8 | C9 | C10 | 113.8° | 109.5° |
| C9 | C8 | H11 | 108.8° | 109.5° |
| C9 | C8 | H12 | 108.8° | 109.5° |
| C8 | C9 | H13 | 108.4° | 109.5° |
| C8 | C9 | H14 | 108.4° | 109.5° |
| N3 | C5 | C10 | 110.7° | 109.5° |
| C5 | N3 | C4 | 121.8° | 120.0° |
| N3 | C5 | H4 | 110.7° | 109.5° |
| C5 | N3 | H8 | 119.1° | 120.0° |
| C5 | C10 | C9 | 111.4° | 109.5° |
| C10 | C5 | H4 | 109.7° | 109.4° |
| C5 | C10 | H15 | 109.0° | 109.5° |
| C5 | C10 | H16 | 109.0° | 109.4° |
| N3 | C4 | O1 | 121.0° | 120.0° |
| N3 | C4 | N2 | 118.6° | 120.0° |
| C4 | N3 | H8 | 119.1° | 120.0° |
| O1 | C4 | N2 | 120.4° | 120.0° |
| C4 | N2 | C3 | 123.7° | 120.0° |
| C4 | N2 | H7 | 118.2° | 120.0° |
| C23 | C22 | C21 | 121.2° | 119.9° |
| C22 | C23 | C24 | 119.5° | 120.3° |
| C23 | C22 | H31 | 119.4° | 120.0° |
| C22 | C23 | H32 | 120.2° | 119.9° |
| C22 | C21 | C20 | 115.7° | 120.1° |
| C22 | C21 | C29 | 119.0° | 119.7° |
| C21 | C22 | H31 | 119.4° | 120.1° |
| C23 | C24 | O5 | 118.3° | 118.3° |
| C23 | C24 | C28 | 119.8° | 119.9° |
| C24 | C23 | H32 | 120.3° | 119.8° |
| N2 | C3 | N1 | 122.0° | 119.5° |
| N2 | C3 | C11 | 117.6° | 119.6° |
| C3 | N2 | H7 | 118.1° | 120.0° |
| O2 | C14 | C13 | 110.7° | 109.5° |
| O2 | C14 | C19 | 109.3° | 109.4° |
| O2 | C14 | H20 | 109.3° | 109.5° |
| C10 | C9 | H13 | 108.4° | 109.4° |
| C10 | C9 | H14 | 108.3° | 109.4° |
| C9 | C10 | H15 | 109.0° | 109.5° |
| C9 | C10 | H16 | 109.0° | 109.5° |
| C3 | N1 | C2 | 120.6° | 121.7° |
| N1 | C3 | C11 | 120.4° | 120.9° |
| N1 | C2 | C1 | 119.5° | 119.7° |
| N1 | C2 | C20 | 120.8° | 120.6° |
| C3 | C11 | C12 | 119.2° | 120.4° |
| C3 | C11 | C13 | 120.2° | 119.3° |
| C1 | C2 | C20 | 119.7° | 119.7° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C2 | C20 | C13 | 118.7° | 119.1° |
| C2 | C20 | C21 | 121.8° | 120.4° |
| C12 | C11 | C13 | 120.6° | 120.4° |
| C11 | C12 | H17 | 109.5° | 109.5° |
| C11 | C12 | H18 | 109.5° | 109.5° |
| C11 | C12 | H19 | 109.5° | 109.5° |
| C11 | C13 | C20 | 119.3° | 118.3° |
| C11 | C13 | C14 | 118.6° | 120.8° |
| C20 | C13 | C14 | 122.1° | 120.8° |
| C13 | C20 | C21 | 119.4° | 120.4° |
| C13 | C14 | C19 | 111.0° | 109.4° |
| C13 | C14 | H20 | 108.4° | 109.5° |
| C20 | C21 | C29 | 125.3° | 120.2° |
| C21 | C29 | C28 | 119.8° | 120.3° |
| C21 | C29 | C30 | 120.3° | 119.9° |
| C14 | C19 | O4 | 119.9° | 120.0° |
| C14 | C19 | O3 | 121.0° | 120.0° |
| C19 | C14 | H20 | 108.0° | 109.5° |
| O5 | C24 | C28 | 121.9° | 121.7° |
| C24 | O5 | C25 | 119.3° | 117.9° |
| C24 | C28 | C29 | 120.7° | 119.9° |
| C24 | C28 | C27 | 120.1° | 121.4° |
| O5 | C25 | C26 | 108.0° | 108.3° |
| O5 | C25 | H36 | 109.8° | 109.7° |
| O5 | C25 | H37 | 109.8° | 109.7° |
| C28 | C29 | C30 | 119.9° | 119.8° |
| C29 | C28 | C27 | 119.2° | 118.7° |
| C29 | C30 | H33 | 109.5° | 109.5° |
| C29 | C30 | H34 | 109.4° | 109.5° |
| C29 | C30 | H35 | 109.5° | 109.4° |
| C28 | C27 | C26 | 111.2° | 109.7° |
| C28 | C27 | H40 | 109.1° | 109.5° |
| C28 | C27 | H41 | 109.0° | 109.4° |
| C25 | C26 | C27 | 110.9° | 108.3° |
| C26 | C25 | H36 | 109.9° | 109.7° |
| C26 | C25 | H37 | 109.8° | 109.7° |
| C25 | C26 | H38 | 109.1° | 109.6° |
| C25 | C26 | H39 | 109.1° | 109.7° |
| O4 | C19 | O3 | 119.0° | 120.0° |
| C19 | O3 | H30 | 109.5° | 117.0° |
| C27 | C26 | H38 | 109.1° | 109.7° |
| C27 | C26 | H39 | 109.1° | 109.7° |
| C26 | C27 | H40 | 109.0° | 109.4° |
| C26 | C27 | H41 | 109.0° | 109.4° |
| H1 | C1 | H2 | 109.4° | 109.4° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H5 | C6 | H6 | 109.5° | 109.5° |
| H9 | C7 | H10 | 109.5° | 109.4° |
| H11 | C8 | H12 | 109.5° | 109.5° |
| H13 | C9 | H14 | 109.5° | 109.5° |
| H15 | C10 | H16 | 109.5° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H17 | C12 | H19 | 109.5° | 109.4° |
| H18 | C12 | H19 | 109.5° | 109.5° |
| H21 | C16 | H22 | 109.4° | 109.5° |
| H21 | C16 | H23 | 109.5° | 109.5° |
| H22 | C16 | H23 | 109.5° | 109.5° |
| H24 | C17 | H25 | 109.5° | 109.5° |
| H24 | C17 | H26 | 109.5° | 109.5° |
| H25 | C17 | H26 | 109.5° | 109.5° |
| H27 | C18 | H28 | 109.5° | 109.5° |
| H27 | C18 | H29 | 109.5° | 109.5° |
| H28 | C18 | H29 | 109.5° | 109.4° |
| H33 | C30 | H34 | 109.5° | 109.5° |
| H33 | C30 | H35 | 109.5° | 109.5° |
| H34 | C30 | H35 | 109.5° | 109.5° |
| H36 | C25 | H37 | 109.5° | 109.8° |
| H38 | C26 | H39 | 109.5° | 109.7° |
| H40 | C27 | H41 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C6 | C7 | C8 | H9 | 120.1° | 120.0° |
| C6 | C7 | C8 | H10 | 120.1° | 120.1° |
| C7 | C6 | C5 | H5 | 120.3° | 120.0° |
| C7 | C6 | C5 | H6 | 120.3° | 120.0° |
| C6 | C7 | C8 | C9 | 50.4° | 60.0° |
| C7 | C6 | C5 | N3 | 176.8° | 180.0° |
| C7 | C6 | C5 | C10 | 63.5° | 60.0° |
| C7 | C6 | C5 | H4 | 55.5° | 59.9° |
| C7 | C6 | H5 | H6 | 119.1° | 120.0° |
| C6 | C7 | H9 | H10 | 119.6° | 120.1° |
| C6 | C7 | C8 | H11 | 70.0° | 60.0° |
| C6 | C7 | C8 | H12 | 170.8° | 180.0° |
| C8 | C7 | C6 | C5 | 60.3° | 60.0° |
| C7 | C8 | C9 | H11 | 120.4° | 120.0° |
| C7 | C8 | C9 | H12 | 120.4° | 120.0° |
| C7 | C8 | C9 | C10 | 47.5° | 60.0° |
| C8 | C7 | C6 | H5 | 179.4° | 60.0° |
| C8 | C7 | C6 | H6 | 60.0° | 180.0° |
| C8 | C7 | H9 | H10 | 119.6° | 119.9° |
| C7 | C8 | H11 | H12 | 118.8° | 120.0° |
| C7 | C8 | C9 | H13 | 168.2° | 180.0° |
| C7 | C8 | C9 | H14 | 73.1° | 60.0° |
| C16 | C15 | C17 | C18 | 121.9° | 119.9° |
| C16 | C15 | C17 | O2 | 117.1° | 120.0° |
| C16 | C15 | C18 | O2 | 120.3° | 120.0° |
| C16 | C15 | O2 | C14 | 76.0° | 180.0° |
| C15 | C16 | H21 | H22 | 120.0° | 119.9° |
| C15 | C16 | H21 | H23 | 120.0° | 120.0° |
| C15 | C16 | H22 | H23 | 120.0° | 120.0° |
| C16 | C15 | C17 | H24 | 180.0° | 60.0° |
| C16 | C15 | C17 | H25 | 60.0° | 60.1° |
| C16 | C15 | C17 | H26 | 60.0° | 180.0° |
| C16 | C15 | C18 | H27 | 180.0° | 60.1° |
| C16 | C15 | C18 | H28 | 60.0° | 60.0° |
| C16 | C15 | C18 | H29 | 60.0° | 179.9° |
| C6 | C5 | N3 | C10 | 117.3° | 120.0° |
| C6 | C5 | N3 | H4 | 120.8° | 120.0° |
| C6 | C5 | C10 | H4 | 119.0° | 119.9° |
| C6 | C5 | N3 | C4 | 144.6° | 85.0° |
| C6 | C5 | C10 | C9 | 58.4° | 59.9° |
| C5 | C6 | H5 | H6 | 119.0° | 120.0° |
| C6 | C5 | N3 | H8 | 35.3° | 95.0° |
| C5 | C6 | C7 | H9 | 179.6° | 180.0° |
| C5 | C6 | C7 | H10 | 59.9° | 60.0° |
| C6 | C5 | C10 | H15 | 178.7° | 180.0° |
| C6 | C5 | C10 | H16 | 61.9° | 60.0° |
| C17 | C15 | C18 | O2 | 118.5° | 120.1° |
| C17 | C15 | O2 | C14 | 165.5° | 60.0° |
| C17 | C15 | C16 | H21 | 180.0° | 180.0° |
| C17 | C15 | C16 | H22 | 60.0° | 60.0° |
| C17 | C15 | C16 | H23 | 60.0° | 60.0° |
| C15 | C17 | H24 | H25 | 120.0° | 120.0° |
| C15 | C17 | H24 | H26 | 120.0° | 119.9° |
| C15 | C17 | H25 | H26 | 120.0° | 119.9° |
| C17 | C15 | C18 | H27 | 58.9° | 180.0° |
| C17 | C15 | C18 | H28 | 61.1° | 59.9° |
| C17 | C15 | C18 | H29 | 178.9° | 60.0° |
| C18 | C15 | O2 | C14 | 46.2° | 60.1° |
| C18 | C15 | C16 | H21 | 59.4° | 60.0° |
| C18 | C15 | C16 | H22 | 60.6° | 180.0° |
| C18 | C15 | C16 | H23 | 179.4° | 60.0° |
| C18 | C15 | C17 | H24 | 58.2° | 59.9° |
| C18 | C15 | C17 | H25 | 178.2° | 180.0° |
| C18 | C15 | C17 | H26 | 61.9° | 60.0° |
| C15 | C18 | H27 | H28 | 120.0° | 120.1° |
| C15 | C18 | H27 | H29 | 120.0° | 120.0° |
| C15 | C18 | H28 | H29 | 120.0° | 120.0° |
| C15 | O2 | C14 | C13 | 89.1° | 150.0° |
| C15 | O2 | C14 | C19 | 148.3° | 90.0° |
| C15 | O2 | C14 | H20 | 30.3° | 30.0° |
| O2 | C15 | C16 | H21 | 63.1° | 60.0° |
| O2 | C15 | C16 | H22 | 176.9° | 60.0° |
| O2 | C15 | C16 | H23 | 56.9° | 180.0° |
| O2 | C15 | C17 | H24 | 62.9° | 180.0° |
| O2 | C15 | C17 | H25 | 57.1° | 59.9° |
| O2 | C15 | C17 | H26 | 177.1° | 60.0° |
| O2 | C15 | C18 | H27 | 59.7° | 59.9° |
| O2 | C15 | C18 | H28 | 179.7° | 180.0° |
| O2 | C15 | C18 | H29 | 60.3° | 60.1° |
| C8 | C9 | C10 | C5 | 52.2° | 60.0° |
| C8 | C9 | C10 | H13 | 120.6° | 120.0° |
| C8 | C9 | C10 | H14 | 120.6° | 120.1° |
| C9 | C8 | C7 | H9 | 170.5° | 180.0° |
| C9 | C8 | C7 | H10 | 69.7° | 60.1° |
| C9 | C8 | H11 | H12 | 118.8° | 120.0° |
| C8 | C9 | H13 | H14 | 118.0° | 120.1° |
| C8 | C9 | C10 | H15 | 172.5° | 180.0° |
| C8 | C9 | C10 | H16 | 68.1° | 60.0° |
| N3 | C5 | C10 | H4 | 122.5° | 120.1° |
| C5 | N3 | C4 | H8 | 180.0° | 180.0° |
| C5 | N3 | C4 | O1 | 6.7° | 0.0° |
| C5 | N3 | C4 | N2 | 173.6° | 179.9° |
| N3 | C5 | C10 | C9 | 176.9° | 180.0° |
| N3 | C5 | C6 | H5 | 56.5° | 60.0° |
| N3 | C5 | C6 | H6 | 62.9° | 60.0° |
| N3 | C5 | C10 | H15 | 62.9° | 60.0° |
| N3 | C5 | C10 | H16 | 56.6° | 60.0° |
| C10 | C5 | N3 | C4 | 98.0° | 155.0° |
| C5 | C10 | C9 | H15 | 120.3° | 120.0° |
| C5 | C10 | C9 | H16 | 120.3° | 120.0° |
| C10 | C5 | C6 | H5 | 176.2° | 60.0° |
| C10 | C5 | C6 | H6 | 56.8° | 180.0° |
| C10 | C5 | N3 | H8 | 82.0° | 25.0° |
| C5 | C10 | C9 | H13 | 172.9° | 180.0° |
| C5 | C10 | C9 | H14 | 68.4° | 60.1° |
| C5 | C10 | H15 | H16 | 119.1° | 120.0° |
| N3 | C4 | O1 | N2 | 179.7° | 180.0° |
| N3 | C4 | N2 | C3 | 14.9° | 180.0° |
| C4 | N3 | C5 | H4 | 23.9° | 35.0° |
| N3 | C4 | N2 | H7 | 165.1° | 0.1° |
| O1 | C4 | N2 | C3 | 164.8° | 0.1° |
| O1 | C4 | N2 | H7 | 15.1° | 180.0° |
| O1 | C4 | N3 | H8 | 173.3° | 180.0° |
| C4 | N2 | C3 | H7 | 180.0° | 179.9° |
| C4 | N2 | C3 | N1 | 5.7° | 0.1° |
| C4 | N2 | C3 | C11 | 174.7° | 180.0° |
| N2 | C4 | N3 | H8 | 6.4° | 0.0° |
| C23 | C22 | C21 | H31 | 180.0° | 179.9° |
| C22 | C23 | C24 | H32 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 179.3° | 179.9° |
| C23 | C22 | C21 | C29 | 1.3° | 0.4° |
| C22 | C23 | C24 | O5 | 178.4° | 179.8° |
| C22 | C23 | C24 | C28 | 0.1° | 0.1° |
| C21 | C22 | C23 | C24 | 0.8° | 0.0° |
| C22 | C21 | C20 | C2 | 87.0° | 90.3° |
| C22 | C21 | C20 | C13 | 89.5° | 89.7° |
| C22 | C21 | C20 | C29 | 177.8° | 179.7° |
| C22 | C21 | C29 | C28 | 1.0° | 0.6° |
| C22 | C21 | C29 | C30 | 179.8° | 179.7° |
| C21 | C22 | C23 | H32 | 179.2° | 179.9° |
| C23 | C24 | O5 | C28 | 178.3° | 179.9° |
| C23 | C24 | O5 | C25 | 159.5° | 162.9° |
| C23 | C24 | C28 | C29 | 0.4° | 0.1° |
| C23 | C24 | C28 | C27 | 179.8° | 179.7° |
| C24 | C23 | C22 | H31 | 179.2° | 179.9° |
| N2 | C3 | N1 | C11 | 179.6° | 179.9° |
| N2 | C3 | N1 | C2 | 179.7° | 179.8° |
| N2 | C3 | C11 | C12 | 0.5° | 0.1° |
| N2 | C3 | C11 | C13 | 179.9° | 180.0° |
| O2 | C14 | C13 | C11 | 44.5° | 44.9° |
| O2 | C14 | C13 | C20 | 136.6° | 135.3° |
| O2 | C14 | C13 | C19 | 121.6° | 120.0° |
| O2 | C14 | C13 | H20 | 119.9° | 120.0° |
| O2 | C14 | C19 | H20 | 118.8° | 120.0° |
| O2 | C14 | C19 | O4 | 29.6° | 4.9° |
| O2 | C14 | C19 | O3 | 153.2° | 175.0° |
| C9 | C10 | C5 | H4 | 60.6° | 60.0° |
| C10 | C9 | C8 | H11 | 72.9° | 60.0° |
| C10 | C9 | C8 | H12 | 167.9° | 180.0° |
| C10 | C9 | H13 | H14 | 118.0° | 119.9° |
| C9 | C10 | H15 | H16 | 119.1° | 120.0° |
| C3 | N1 | C2 | C1 | 180.0° | 180.0° |
| C3 | N1 | C2 | C20 | 1.0° | 0.3° |
| N1 | C3 | C11 | C12 | 179.9° | 180.0° |
| N1 | C3 | C11 | C13 | 0.5° | 0.1° |
| N1 | C3 | N2 | H7 | 174.3° | 179.8° |
| C2 | N1 | C3 | C11 | 0.1° | 0.1° |
| N1 | C2 | C1 | C20 | 179.0° | 179.7° |
| N1 | C2 | C20 | C13 | 1.7° | 0.3° |
| N1 | C2 | C20 | C21 | 178.2° | 179.7° |
| N1 | C2 | C1 | H1 | 0.0° | 89.7° |
| N1 | C2 | C1 | H2 | 120.0° | 30.3° |
| N1 | C2 | C1 | H3 | 120.0° | 150.3° |
| C3 | C11 | C12 | C13 | 179.4° | 179.8° |
| C3 | C11 | C13 | C20 | 0.3° | 0.2° |
| C3 | C11 | C13 | C14 | 179.2° | 180.0° |
| C11 | C3 | N2 | H7 | 5.3° | 0.1° |
| C3 | C11 | C12 | H17 | 90.3° | 90.0° |
| C3 | C11 | C12 | H18 | 149.7° | 150.0° |
| C3 | C11 | C12 | H19 | 29.7° | 29.9° |
| C1 | C2 | C20 | C13 | 179.2° | 180.0° |
| C1 | C2 | C20 | C21 | 2.7° | 0.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.1° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C2 | C20 | C13 | C11 | 1.4° | 0.0° |
| C2 | C20 | C13 | C21 | 176.6° | 179.9° |
| C2 | C20 | C13 | C14 | 179.8° | 179.8° |
| C2 | C20 | C21 | C29 | 95.3° | 90.0° |
| C20 | C2 | C1 | H1 | 179.1° | 90.1° |
| C20 | C2 | C1 | H2 | 59.1° | 150.0° |
| C20 | C2 | C1 | H3 | 60.9° | 30.0° |
| C12 | C11 | C13 | C20 | 179.1° | 180.0° |
| C12 | C11 | C13 | C14 | 0.2° | 0.2° |
| C11 | C12 | H17 | H18 | 120.0° | 120.1° |
| C11 | C12 | H17 | H19 | 120.0° | 120.0° |
| C11 | C12 | H18 | H19 | 120.0° | 120.0° |
| C11 | C13 | C20 | C14 | 178.8° | 179.8° |
| C11 | C13 | C20 | C21 | 178.0° | 179.9° |
| C11 | C13 | C14 | C19 | 77.1° | 75.0° |
| C13 | C11 | C12 | H17 | 90.3° | 89.8° |
| C13 | C11 | C12 | H18 | 29.7° | 30.2° |
| C13 | C11 | C12 | H19 | 149.7° | 150.2° |
| C11 | C13 | C14 | H20 | 164.4° | 165.0° |
| C13 | C20 | C21 | C29 | 88.2° | 89.9° |
| C20 | C13 | C14 | C19 | 101.7° | 104.8° |
| C20 | C13 | C14 | H20 | 16.7° | 15.3° |
| C14 | C13 | C20 | C21 | 3.2° | 0.3° |
| C13 | C14 | C19 | H20 | 118.7° | 120.0° |
| C13 | C14 | C19 | O4 | 152.0° | 115.0° |
| C13 | C14 | C19 | O3 | 30.7° | 65.0° |
| C20 | C21 | C29 | C28 | 178.7° | 179.8° |
| C20 | C21 | C29 | C30 | 2.4° | 0.0° |
| C20 | C21 | C22 | H31 | 0.8° | 0.1° |
| C21 | C29 | C28 | C24 | 0.2° | 0.4° |
| C21 | C29 | C28 | C30 | 178.8° | 179.7° |
| C21 | C29 | C28 | C27 | 179.7° | 180.0° |
| C29 | C21 | C22 | H31 | 178.7° | 179.7° |
| C21 | C29 | C30 | H33 | 90.6° | 90.0° |
| C21 | C29 | C30 | H34 | 149.4° | 150.0° |
| C21 | C29 | C30 | H35 | 29.4° | 30.0° |
| C14 | C19 | O4 | O3 | 177.3° | 179.9° |
| C14 | C19 | O3 | H30 | 177.3° | 180.0° |
| O5 | C24 | C28 | C29 | 178.7° | 180.0° |
| O5 | C24 | C28 | C27 | 1.5° | 0.5° |
| C24 | O5 | C25 | C26 | 49.4° | 49.3° |
| O5 | C24 | C23 | H32 | 1.6° | 0.2° |
| C24 | O5 | C25 | H36 | 70.4° | 168.9° |
| C24 | O5 | C25 | H37 | 169.1° | 70.4° |
| C28 | C24 | O5 | C25 | 18.8° | 17.3° |
| C24 | C28 | C29 | C27 | 179.8° | 179.6° |
| C24 | C28 | C29 | C30 | 179.0° | 179.8° |
| C24 | C28 | C27 | C26 | 12.0° | 17.8° |
| C28 | C24 | C23 | H32 | 179.9° | 179.9° |
| C24 | C28 | C27 | H40 | 132.2° | 102.3° |
| C24 | C28 | C27 | H41 | 108.3° | 137.8° |
| O5 | C25 | C26 | H36 | 119.7° | 119.7° |
| O5 | C25 | C26 | H37 | 119.8° | 119.7° |
| O5 | C25 | C26 | C27 | 60.8° | 64.8° |
| O5 | C25 | H36 | H37 | 120.7° | 120.6° |
| O5 | C25 | C26 | H38 | 178.9° | 54.9° |
| O5 | C25 | C26 | H39 | 59.4° | 175.5° |
| C29 | C28 | C27 | C26 | 167.8° | 162.6° |
| C28 | C29 | C30 | H33 | 90.6° | 89.7° |
| C28 | C29 | C30 | H34 | 29.5° | 30.3° |
| C28 | C29 | C30 | H35 | 149.4° | 150.3° |
| C29 | C28 | C27 | H40 | 47.6° | 77.3° |
| C29 | C28 | C27 | H41 | 71.9° | 42.6° |
| C30 | C29 | C28 | C27 | 0.8° | 0.2° |
| C29 | C30 | H33 | H34 | 120.0° | 120.1° |
| C29 | C30 | H33 | H35 | 120.0° | 120.0° |
| C29 | C30 | H34 | H35 | 120.0° | 120.0° |
| C28 | C27 | C26 | C25 | 42.5° | 48.2° |
| C28 | C27 | C26 | H40 | 120.3° | 120.1° |
| C28 | C27 | C26 | H41 | 120.2° | 120.1° |
| C28 | C27 | C26 | H38 | 162.8° | 71.4° |
| C28 | C27 | C26 | H39 | 77.7° | 167.9° |
| C28 | C27 | H40 | H41 | 119.2° | 119.9° |
| C25 | C26 | C27 | H38 | 120.2° | 119.7° |
| C25 | C26 | C27 | H39 | 120.2° | 119.7° |
| C26 | C25 | H36 | H37 | 120.7° | 120.6° |
| C25 | C26 | H38 | H39 | 119.3° | 120.5° |
| C25 | C26 | C27 | H40 | 162.8° | 71.9° |
| C25 | C26 | C27 | H41 | 77.7° | 168.3° |
| O4 | C19 | C14 | H20 | 89.2° | 125.0° |
| O4 | C19 | O3 | H30 | 0.0° | 0.0° |
| O3 | C19 | C14 | H20 | 88.0° | 55.0° |
| C27 | C26 | C25 | H36 | 58.9° | 175.5° |
| C27 | C26 | C25 | H37 | 179.4° | 54.9° |
| C27 | C26 | H38 | H39 | 119.3° | 120.7° |
| C26 | C27 | H40 | H41 | 119.2° | 119.9° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C5 | C6 | H5 | 64.9° | 180.0° |
| H4 | C5 | C6 | H6 | 175.7° | 60.0° |
| H4 | C5 | N3 | H8 | 156.1° | 145.0° |
| H4 | C5 | C10 | H15 | 59.6° | 60.1° |
| H4 | C5 | C10 | H16 | 179.1° | 179.9° |
| H5 | C6 | C7 | H9 | 59.3° | 60.0° |
| H5 | C6 | C7 | H10 | 60.4° | 180.0° |
| H6 | C6 | C7 | H9 | 60.1° | 60.0° |
| H6 | C6 | C7 | H10 | 179.8° | 60.0° |
| H9 | C7 | C8 | H11 | 50.1° | 60.0° |
| H9 | C7 | C8 | H12 | 69.1° | 60.0° |
| H10 | C7 | C8 | H11 | 169.9° | 179.9° |
| H10 | C7 | C8 | H12 | 50.7° | 60.0° |
| H11 | C8 | C9 | H13 | 47.8° | 60.0° |
| H11 | C8 | C9 | H14 | 166.5° | 180.0° |
| H12 | C8 | C9 | H13 | 71.4° | 60.0° |
| H12 | C8 | C9 | H14 | 47.3° | 60.0° |
| H13 | C9 | C10 | H15 | 66.8° | 60.0° |
| H13 | C9 | C10 | H16 | 52.6° | 60.0° |
| H14 | C9 | C10 | H15 | 51.9° | 59.9° |
| H14 | C9 | C10 | H16 | 171.3° | 180.0° |
| H17 | C12 | H18 | H19 | 120.0° | 119.9° |
| H21 | C16 | H22 | H23 | 120.0° | 120.1° |
| H24 | C17 | H25 | H26 | 120.0° | 120.1° |
| H27 | C18 | H28 | H29 | 120.0° | 119.9° |
| H31 | C22 | C23 | H32 | 0.8° | 0.0° |
| H33 | C30 | H34 | H35 | 120.0° | 120.0° |
| H36 | C25 | C26 | H38 | 61.3° | 64.8° |
| H36 | C25 | C26 | H39 | 179.1° | 55.8° |
| H37 | C25 | C26 | H38 | 59.2° | 174.6° |
| H37 | C25 | C26 | H39 | 60.4° | 64.8° |
| H38 | C26 | C27 | H40 | 77.0° | 168.5° |
| H38 | C26 | C27 | H41 | 42.5° | 48.6° |
| H39 | C26 | C27 | H40 | 42.6° | 47.8° |
| H39 | C26 | C27 | H41 | 162.1° | 72.0° |
