9X4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | sing | 1.54Å | 1.56Å | |
| C26 | C23 | sing | 1.54Å | 1.55Å | |
| C25 | C24 | sing | 1.54Å | 1.56Å | |
| C25 | C15 | sing | 1.50Å | 1.52Å | |
| C24 | C23 | sing | 1.53Å | 1.55Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | N22 | sing | 1.46Å | 1.48Å | |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| O28 | C27 | doub | 1.22Å | 1.23Å | |
| C16 | C18 | sing | 1.48Å | 1.49Å | |
| C16 | C17 | doub | 1.40Å | 1.40Å | Aromatic |
| N22 | C18 | sing | 1.35Å | 1.38Å | Aromatic |
| N22 | C21 | sing | 1.38Å | 1.44Å | Aromatic |
| C12 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.43Å | 1.44Å | |
| C18 | N19 | doub | 1.32Å | 1.32Å | Aromatic |
| C27 | C21 | sing | 1.47Å | 1.49Å | |
| C27 | N29 | sing | 1.35Å | 1.33Å | |
| C21 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | trip | 1.17Å | 1.19Å | |
| C30 | N29 | sing | 1.47Å | 1.45Å | |
| N19 | C20 | sing | 1.34Å | 1.39Å | Aromatic |
| C10 | C7 | sing | 1.47Å | 1.47Å | |
| C20 | C31 | sing | 1.48Å | 1.47Å | |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| N4 | C5 | doub | 1.30Å | 1.28Å | Aromatic |
| N4 | C3 | sing | 1.34Å | 1.37Å | Aromatic |
| C7 | C5 | sing | 1.51Å | 1.51Å | |
| C7 | C9 | sing | 1.53Å | 1.55Å | |
| C31 | O32 | doub | 1.22Å | 1.24Å | |
| C31 | N33 | sing | 1.35Å | 1.33Å | |
| C5 | O6 | sing | 1.34Å | 1.37Å | Aromatic |
| C3 | C2 | doub | 1.34Å | 1.35Å | Aromatic |
| O6 | C2 | sing | 1.35Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.49Å | |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C3 | H9 | sing | 1.08Å | 1.08Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| N29 | H20 | sing | 0.97Å | 1.00Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| N33 | H24 | sing | 0.97Å | 1.00Å | |
| N33 | H25 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C23 | 91.1° | 88.2° |
| C26 | C25 | C24 | 84.9° | 86.7° |
| C26 | C25 | C15 | 113.2° | 114.0° |
| C26 | C25 | H17 | 113.3° | 112.3° |
| C25 | C26 | H18 | 113.8° | 113.4° |
| C25 | C26 | H19 | 113.9° | 113.5° |
| C26 | C23 | C24 | 85.8° | 87.0° |
| C26 | C23 | N22 | 112.1° | 111.3° |
| C26 | C23 | H14 | 113.9° | 114.6° |
| C23 | C26 | H18 | 113.8° | 113.4° |
| C23 | C26 | H19 | 113.8° | 113.5° |
| C24 | C25 | C15 | 115.0° | 116.3° |
| C25 | C24 | C23 | 91.4° | 88.6° |
| C25 | C24 | H15 | 113.8° | 113.9° |
| C25 | C24 | H16 | 113.8° | 113.3° |
| C24 | C25 | H17 | 113.3° | 112.9° |
| C25 | C15 | C14 | 119.3° | 115.9° |
| C25 | C15 | C16 | 122.1° | 124.9° |
| C15 | C25 | H17 | 114.0° | 112.3° |
| C24 | C23 | N22 | 112.6° | 113.2° |
| C24 | C23 | H14 | 114.0° | 114.6° |
| C23 | C24 | H15 | 113.8° | 113.1° |
| C23 | C24 | H16 | 113.8° | 113.2° |
| C15 | C14 | C13 | 121.4° | 121.0° |
| C14 | C15 | C16 | 118.6° | 118.8° |
| C15 | C14 | H1 | 119.3° | 119.5° |
| C14 | C13 | C12 | 120.0° | 120.2° |
| C13 | C14 | H1 | 119.3° | 119.5° |
| C14 | C13 | H8 | 120.0° | 119.9° |
| C23 | N22 | C18 | 124.3° | 128.2° |
| C23 | N22 | C21 | 130.0° | 124.2° |
| N22 | C23 | H14 | 115.1° | 113.6° |
| C15 | C16 | C18 | 126.5° | 122.4° |
| C15 | C16 | C17 | 120.3° | 120.5° |
| C13 | C12 | C17 | 119.7° | 119.2° |
| C13 | C12 | C11 | 120.4° | 120.4° |
| C12 | C13 | H8 | 120.0° | 119.9° |
| O28 | C27 | C21 | 121.3° | 120.0° |
| O28 | C27 | N29 | 121.3° | 120.0° |
| C18 | C16 | C17 | 113.2° | 117.1° |
| C16 | C18 | N22 | 129.1° | 126.5° |
| C16 | C18 | N19 | 118.3° | 124.4° |
| C16 | C17 | C12 | 120.0° | 120.0° |
| C16 | C17 | H13 | 120.0° | 120.0° |
| C18 | N22 | C21 | 105.6° | 107.2° |
| N22 | C18 | N19 | 112.5° | 109.1° |
| N22 | C21 | C27 | 117.5° | 127.0° |
| N22 | C21 | C20 | 104.9° | 106.0° |
| C17 | C12 | C11 | 119.9° | 120.4° |
| C12 | C17 | H13 | 120.0° | 120.0° |
| C12 | C11 | C10 | 176.9° | 180.0° |
| C18 | N19 | C20 | 106.5° | 109.3° |
| C21 | C27 | N29 | 117.5° | 120.0° |
| C27 | C21 | C20 | 137.5° | 127.0° |
| C27 | N29 | C30 | 122.0° | 120.0° |
| C27 | N29 | H20 | 119.0° | 120.0° |
| C21 | C20 | N19 | 110.4° | 107.5° |
| C21 | C20 | C31 | 129.6° | 126.2° |
| C11 | C10 | C7 | 175.6° | 180.0° |
| C30 | N29 | H20 | 119.0° | 120.0° |
| N29 | C30 | H21 | 109.5° | 109.5° |
| N29 | C30 | H22 | 109.5° | 109.4° |
| N29 | C30 | H23 | 109.5° | 109.5° |
| N19 | C20 | C31 | 119.5° | 126.3° |
| C10 | C7 | C8 | 109.4° | 109.5° |
| C10 | C7 | C5 | 108.6° | 109.5° |
| C10 | C7 | C9 | 111.0° | 109.5° |
| C20 | C31 | O32 | 121.3° | 120.0° |
| C20 | C31 | N33 | 115.8° | 120.0° |
| C8 | C7 | C5 | 109.7° | 109.5° |
| C8 | C7 | C9 | 107.8° | 109.4° |
| C7 | C8 | H2 | 109.5° | 109.5° |
| C7 | C8 | H3 | 109.4° | 109.5° |
| C7 | C8 | H4 | 109.5° | 109.5° |
| C5 | N4 | C3 | 104.3° | 108.7° |
| N4 | C5 | C7 | 127.0° | 125.6° |
| N4 | C5 | O6 | 114.5° | 108.8° |
| N4 | C3 | C2 | 110.3° | 107.7° |
| N4 | C3 | H9 | 124.8° | 126.1° |
| C5 | C7 | C9 | 110.3° | 109.4° |
| C7 | C5 | O6 | 118.4° | 125.6° |
| C7 | C9 | H5 | 109.5° | 109.5° |
| C7 | C9 | H6 | 109.4° | 109.4° |
| C7 | C9 | H7 | 109.5° | 109.5° |
| O32 | C31 | N33 | 122.8° | 120.0° |
| C31 | N33 | H24 | 120.0° | 120.0° |
| C31 | N33 | H25 | 120.0° | 120.0° |
| C5 | O6 | C2 | 103.3° | 107.8° |
| C3 | C2 | O6 | 107.5° | 107.1° |
| C3 | C2 | C1 | 136.6° | 126.5° |
| C2 | C3 | H9 | 124.8° | 126.2° |
| O6 | C2 | C1 | 115.9° | 126.4° |
| C2 | C1 | H10 | 109.5° | 109.5° |
| C2 | C1 | H11 | 109.5° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.4° |
| H2 | C8 | H3 | 109.5° | 109.4° |
| H2 | C8 | H4 | 109.4° | 109.5° |
| H3 | C8 | H4 | 109.5° | 109.4° |
| H5 | C9 | H6 | 109.5° | 109.5° |
| H5 | C9 | H7 | 109.4° | 109.5° |
| H6 | C9 | H7 | 109.5° | 109.5° |
| H10 | C1 | H11 | 109.4° | 109.5° |
| H10 | C1 | H12 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.5° |
| H15 | C24 | H16 | 109.5° | 112.5° |
| H18 | C26 | H19 | 109.5° | 112.7° |
| H21 | C30 | H22 | 109.5° | 109.4° |
| H21 | C30 | H23 | 109.5° | 109.5° |
| H22 | C30 | H23 | 109.4° | 109.5° |
| H24 | N33 | H25 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C23 | H18 | 116.8° | 114.8° |
| C25 | C26 | C23 | H19 | 116.8° | 114.9° |
| C26 | C25 | C24 | C15 | 113.2° | 115.2° |
| C26 | C25 | C24 | H17 | 113.2° | 112.9° |
| C26 | C25 | C15 | H17 | 131.4° | 129.2° |
| C25 | C26 | C23 | C24 | 19.6° | 23.0° |
| C26 | C25 | C15 | C14 | 134.3° | 122.8° |
| C25 | C26 | C23 | N22 | 93.1° | 90.7° |
| C26 | C25 | C15 | C16 | 47.0° | 63.9° |
| C25 | C26 | C23 | H14 | 134.0° | 138.7° |
| C26 | C25 | C24 | H15 | 97.4° | 137.9° |
| C26 | C25 | C24 | H16 | 136.3° | 91.7° |
| C25 | C26 | H18 | H19 | 128.7° | 130.7° |
| C23 | C26 | C25 | C15 | 95.7° | 94.6° |
| C26 | C23 | C24 | N22 | 112.2° | 111.9° |
| C26 | C23 | C24 | H14 | 114.3° | 115.7° |
| C26 | C23 | N22 | H14 | 132.3° | 131.1° |
| C26 | C23 | N22 | C18 | 44.0° | 62.4° |
| C26 | C23 | N22 | C21 | 132.4° | 125.5° |
| C26 | C23 | C24 | H15 | 97.3° | 138.5° |
| C26 | C23 | C24 | H16 | 136.4° | 92.0° |
| C23 | C26 | C25 | H17 | 132.6° | 136.3° |
| C23 | C26 | H18 | H19 | 128.7° | 130.7° |
| C24 | C25 | C15 | H17 | 133.3° | 132.2° |
| C25 | C24 | C23 | H15 | 116.9° | 115.5° |
| C25 | C24 | C23 | H16 | 116.8° | 114.9° |
| C24 | C25 | C15 | C14 | 130.3° | 138.5° |
| C25 | C24 | C23 | N22 | 92.6° | 88.9° |
| C24 | C25 | C15 | C16 | 48.4° | 34.7° |
| C25 | C24 | C23 | H14 | 133.9° | 138.7° |
| C25 | C24 | H15 | H16 | 128.5° | 130.8° |
| C24 | C25 | C26 | H18 | 136.1° | 92.0° |
| C24 | C25 | C26 | H19 | 97.4° | 137.7° |
| C15 | C25 | C24 | C23 | 93.8° | 92.1° |
| C25 | C15 | C14 | C16 | 178.7° | 173.7° |
| C25 | C15 | C14 | C13 | 178.5° | 169.5° |
| C25 | C15 | C16 | C18 | 0.4° | 15.9° |
| C25 | C15 | C16 | C17 | 178.6° | 166.8° |
| C25 | C15 | C14 | H1 | 1.5° | 10.8° |
| C15 | C25 | C24 | H15 | 149.4° | 22.7° |
| C15 | C25 | C24 | H16 | 23.1° | 153.1° |
| C15 | C25 | C26 | H18 | 21.0° | 150.6° |
| C15 | C25 | C26 | H19 | 147.5° | 20.3° |
| C24 | C23 | N22 | H14 | 133.0° | 132.9° |
| C24 | C23 | N22 | C18 | 50.7° | 33.6° |
| C24 | C23 | N22 | C21 | 132.9° | 138.5° |
| C23 | C24 | H15 | H16 | 128.5° | 129.9° |
| C23 | C24 | C25 | H17 | 132.6° | 135.9° |
| C24 | C23 | C26 | H18 | 136.3° | 91.8° |
| C24 | C23 | C26 | H19 | 97.2° | 137.9° |
| C15 | C14 | C13 | H1 | 180.0° | 179.7° |
| C15 | C14 | C13 | C12 | 0.6° | 0.0° |
| C14 | C15 | C16 | C18 | 178.3° | 171.0° |
| C14 | C15 | C16 | C17 | 0.0° | 6.3° |
| C15 | C14 | C13 | H8 | 179.4° | 179.9° |
| C14 | C15 | C25 | H17 | 2.9° | 6.3° |
| C13 | C14 | C15 | C16 | 0.2° | 4.2° |
| C14 | C13 | C12 | H8 | 180.0° | 180.0° |
| C14 | C13 | C12 | C17 | 0.8° | 2.1° |
| C14 | C13 | C12 | C11 | 177.6° | 177.9° |
| C23 | N22 | C18 | C16 | 4.6° | 17.5° |
| C23 | N22 | C18 | C21 | 177.1° | 173.2° |
| C23 | N22 | C18 | N19 | 175.6° | 163.5° |
| C23 | N22 | C21 | C27 | 5.0° | 14.4° |
| C23 | N22 | C21 | C20 | 175.2° | 165.7° |
| N22 | C23 | C24 | H15 | 150.5° | 26.6° |
| N22 | C23 | C24 | H16 | 24.2° | 156.2° |
| N22 | C23 | C26 | H18 | 23.6° | 154.5° |
| N22 | C23 | C26 | H19 | 150.1° | 24.2° |
| C15 | C16 | C18 | C17 | 178.3° | 177.3° |
| C15 | C16 | C18 | N22 | 2.4° | 0.4° |
| C15 | C16 | C17 | C12 | 0.3° | 4.2° |
| C15 | C16 | C18 | N19 | 177.9° | 179.3° |
| C16 | C15 | C14 | H1 | 179.8° | 175.5° |
| C15 | C16 | C17 | H13 | 179.7° | 175.7° |
| C16 | C15 | C25 | H17 | 178.4° | 167.0° |
| C13 | C12 | C17 | C16 | 0.7° | 0.1° |
| C13 | C12 | C17 | C11 | 178.4° | 180.0° |
| C13 | C12 | C11 | C10 | 173.9° | 159.8° |
| C12 | C13 | C14 | H1 | 179.4° | 179.7° |
| C13 | C12 | C17 | H13 | 179.3° | 180.0° |
| O28 | C27 | C21 | N22 | 3.8° | 92.8° |
| O28 | C27 | C21 | N29 | 179.5° | 180.0° |
| O28 | C27 | C21 | C20 | 176.0° | 87.3° |
| O28 | C27 | N29 | C30 | 4.8° | 5.3° |
| O28 | C27 | N29 | H20 | 175.2° | 174.7° |
| C16 | C18 | N22 | N19 | 179.8° | 179.0° |
| C16 | C18 | N22 | C21 | 178.3° | 169.3° |
| C18 | C16 | C17 | C12 | 178.7° | 173.2° |
| C16 | C18 | N19 | C20 | 179.2° | 171.3° |
| C18 | C16 | C17 | H13 | 1.2° | 6.9° |
| C17 | C16 | C18 | N22 | 176.0° | 176.9° |
| C16 | C17 | C12 | H13 | 180.0° | 179.9° |
| C16 | C17 | C12 | C11 | 177.7° | 179.9° |
| C17 | C16 | C18 | N19 | 3.8° | 2.0° |
| C18 | N22 | C21 | C27 | 178.1° | 172.1° |
| C18 | N22 | C21 | C20 | 1.7° | 7.9° |
| N22 | C18 | N19 | C20 | 0.6° | 7.7° |
| C18 | N22 | C23 | H14 | 176.3° | 166.5° |
| C21 | N22 | C18 | N19 | 1.5° | 9.7° |
| N22 | C21 | C27 | C20 | 179.8° | 179.9° |
| N22 | C21 | C27 | N29 | 176.7° | 87.1° |
| N22 | C21 | C20 | N19 | 1.4° | 3.3° |
| N22 | C21 | C20 | C31 | 171.1° | 176.6° |
| C21 | N22 | C23 | H14 | 0.1° | 5.7° |
| C17 | C12 | C11 | C10 | 7.7° | 20.3° |
| C17 | C12 | C13 | H8 | 179.2° | 177.9° |
| C12 | C11 | C10 | C7 | 21.4° | 167.1° |
| C11 | C12 | C13 | H8 | 2.4° | 2.1° |
| C11 | C12 | C17 | H13 | 2.3° | 0.0° |
| C18 | N19 | C20 | C21 | 0.6° | 2.6° |
| C18 | N19 | C20 | C31 | 172.8° | 177.5° |
| C21 | C27 | N29 | C30 | 174.7° | 174.7° |
| C27 | C21 | C20 | N19 | 178.3° | 176.6° |
| C27 | C21 | C20 | C31 | 9.1° | 3.5° |
| C21 | C27 | N29 | H20 | 5.3° | 5.3° |
| N29 | C27 | C21 | C20 | 3.5° | 92.8° |
| C27 | N29 | C30 | H20 | 180.0° | 180.0° |
| C27 | N29 | C30 | H21 | 180.0° | 180.0° |
| C27 | N29 | C30 | H22 | 60.0° | 60.0° |
| C27 | N29 | C30 | H23 | 60.0° | 60.0° |
| C21 | C20 | N19 | C31 | 173.4° | 179.9° |
| C21 | C20 | C31 | O32 | 13.8° | 0.1° |
| C21 | C20 | C31 | N33 | 167.7° | 180.0° |
| C11 | C10 | C7 | C8 | 158.8° | 112.7° |
| C11 | C10 | C7 | C5 | 81.4° | 7.4° |
| C11 | C10 | C7 | C9 | 40.0° | 127.3° |
| N29 | C30 | H21 | H22 | 120.0° | 119.9° |
| N29 | C30 | H21 | H23 | 120.0° | 120.0° |
| N29 | C30 | H22 | H23 | 120.0° | 120.0° |
| N19 | C20 | C31 | O32 | 174.2° | 180.0° |
| N19 | C20 | C31 | N33 | 4.3° | 0.1° |
| C10 | C7 | C8 | C5 | 119.0° | 120.0° |
| C10 | C7 | C8 | C9 | 120.8° | 120.0° |
| C10 | C7 | C5 | N4 | 23.5° | 179.7° |
| C10 | C7 | C5 | C9 | 121.8° | 120.0° |
| C10 | C7 | C5 | O6 | 156.1° | 0.0° |
| C10 | C7 | C8 | H2 | 180.0° | 180.0° |
| C10 | C7 | C8 | H3 | 60.0° | 60.0° |
| C10 | C7 | C8 | H4 | 60.0° | 59.9° |
| C10 | C7 | C9 | H5 | 180.0° | 60.0° |
| C10 | C7 | C9 | H6 | 60.0° | 60.0° |
| C10 | C7 | C9 | H7 | 60.0° | 180.0° |
| C20 | C31 | O32 | N33 | 178.4° | 180.0° |
| C20 | C31 | N33 | H24 | 178.5° | 0.0° |
| C20 | C31 | N33 | H25 | 1.5° | 180.0° |
| C8 | C7 | C5 | N4 | 96.1° | 59.7° |
| C8 | C7 | C5 | C9 | 118.6° | 119.9° |
| C8 | C7 | C5 | O6 | 84.4° | 120.0° |
| C7 | C8 | H2 | H3 | 120.0° | 120.0° |
| C7 | C8 | H2 | H4 | 120.0° | 120.1° |
| C7 | C8 | H3 | H4 | 120.0° | 120.0° |
| C8 | C7 | C9 | H5 | 60.2° | 180.0° |
| C8 | C7 | C9 | H6 | 179.8° | 60.0° |
| C8 | C7 | C9 | H7 | 59.8° | 60.0° |
| N4 | C5 | C7 | O6 | 179.6° | 179.7° |
| N4 | C5 | C7 | C9 | 145.3° | 60.3° |
| C5 | N4 | C3 | C2 | 0.5° | 0.3° |
| N4 | C5 | O6 | C2 | 0.4° | 0.3° |
| C5 | N4 | C3 | H9 | 179.5° | 179.9° |
| C3 | N4 | C5 | C7 | 179.6° | 179.7° |
| C3 | N4 | C5 | O6 | 0.1° | 0.0° |
| N4 | C3 | C2 | H9 | 180.0° | 179.6° |
| N4 | C3 | C2 | O6 | 0.7° | 0.5° |
| N4 | C3 | C2 | C1 | 177.0° | 179.6° |
| C7 | C5 | O6 | C2 | 179.3° | 180.0° |
| C5 | C7 | C8 | H2 | 61.0° | 60.0° |
| C5 | C7 | C8 | H3 | 179.0° | 180.0° |
| C5 | C7 | C8 | H4 | 59.0° | 60.1° |
| C5 | C7 | C9 | H5 | 59.6° | 60.0° |
| C5 | C7 | C9 | H6 | 60.4° | 180.0° |
| C5 | C7 | C9 | H7 | 179.6° | 60.0° |
| C9 | C7 | C5 | O6 | 34.3° | 120.0° |
| C9 | C7 | C8 | H2 | 59.2° | 59.9° |
| C9 | C7 | C8 | H3 | 60.8° | 60.1° |
| C9 | C7 | C8 | H4 | 179.2° | 180.0° |
| C7 | C9 | H5 | H6 | 120.0° | 119.9° |
| C7 | C9 | H5 | H7 | 120.0° | 120.0° |
| C7 | C9 | H6 | H7 | 120.0° | 120.0° |
| O32 | C31 | N33 | H24 | 0.0° | 180.0° |
| O32 | C31 | N33 | H25 | 180.0° | 0.0° |
| C31 | N33 | H24 | H25 | 180.0° | 180.0° |
| C5 | O6 | C2 | C3 | 0.6° | 0.5° |
| C5 | O6 | C2 | C1 | 177.6° | 179.6° |
| C3 | C2 | O6 | C1 | 178.2° | 179.9° |
| C3 | C2 | C1 | H10 | 177.5° | 89.9° |
| C3 | C2 | C1 | H11 | 62.5° | 150.0° |
| C3 | C2 | C1 | H12 | 57.5° | 30.0° |
| O6 | C2 | C3 | H9 | 179.3° | 179.9° |
| O6 | C2 | C1 | H10 | 0.0° | 90.0° |
| O6 | C2 | C1 | H11 | 120.0° | 30.1° |
| O6 | C2 | C1 | H12 | 120.0° | 150.1° |
| C1 | C2 | C3 | H9 | 3.0° | 0.0° |
| C2 | C1 | H10 | H11 | 120.0° | 120.0° |
| C2 | C1 | H10 | H12 | 120.0° | 120.0° |
| C2 | C1 | H11 | H12 | 120.0° | 119.9° |
| H1 | C14 | C13 | H8 | 0.6° | 0.3° |
| H2 | C8 | H3 | H4 | 120.0° | 120.0° |
| H5 | C9 | H6 | H7 | 120.0° | 120.1° |
| H10 | C1 | H11 | H12 | 120.0° | 120.0° |
| H14 | C23 | C24 | H15 | 17.0° | 105.8° |
| H14 | C23 | C24 | H16 | 109.3° | 23.8° |
| H14 | C23 | C26 | H18 | 109.2° | 23.9° |
| H14 | C23 | C26 | H19 | 17.2° | 106.4° |
| H15 | C24 | C25 | H17 | 15.8° | 109.3° |
| H16 | C24 | C25 | H17 | 110.5° | 21.1° |
| H17 | C25 | C26 | H18 | 110.7° | 21.5° |
| H17 | C25 | C26 | H19 | 15.8° | 108.8° |
| H20 | N29 | C30 | H21 | 0.0° | 0.0° |
| H20 | N29 | C30 | H22 | 120.0° | 119.9° |
| H20 | N29 | C30 | H23 | 120.1° | 120.0° |
| H21 | C30 | H22 | H23 | 120.0° | 120.1° |
