4B7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C5 | sing | 1.39Å | 1.41Å | Aromatic |
| C13 | C2 | sing | 1.39Å | 1.42Å | Aromatic |
| O2 | C6 | sing | 1.36Å | 1.40Å | |
| O2 | C5 | sing | 1.36Å | 1.35Å | |
| C7 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C11 | sing | 1.39Å | 1.44Å | Aromatic |
| C5 | C4 | doub | 1.39Å | 1.36Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | N1 | sing | 1.40Å | 1.42Å | |
| C2 | C3 | doub | 1.39Å | 1.41Å | Aromatic |
| N1 | C1 | sing | 1.35Å | 1.38Å | |
| C4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | doub | 1.37Å | 1.37Å | Aromatic |
| C15 | N2 | sing | 1.31Å | 1.38Å | Aromatic |
| C1 | C14 | sing | 1.46Å | 1.44Å | |
| C1 | O1 | doub | 1.22Å | 1.22Å | |
| C14 | S | sing | 1.76Å | 1.65Å | Aromatic |
| N2 | C16 | doub | 1.30Å | 1.35Å | Aromatic |
| C16 | S | sing | 1.71Å | 1.69Å | Aromatic |
| C16 | N3 | sing | 1.38Å | 1.40Å | |
| N3 | C17 | sing | 1.39Å | 1.41Å | |
| C17 | C27 | doub | 1.39Å | 1.43Å | Aromatic |
| C17 | N4 | sing | 1.33Å | 1.40Å | Aromatic |
| C27 | C20 | sing | 1.39Å | 1.43Å | Aromatic |
| N4 | C18 | doub | 1.32Å | 1.36Å | Aromatic |
| C18 | N5 | sing | 1.32Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.51Å | 1.50Å | |
| C20 | N5 | doub | 1.33Å | 1.40Å | Aromatic |
| C20 | N6 | sing | 1.39Å | 1.45Å | |
| C21 | N6 | sing | 1.47Å | 1.48Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| N6 | C26 | sing | 1.47Å | 1.49Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C22 | N7 | sing | 1.47Å | 1.50Å | |
| C25 | N7 | sing | 1.47Å | 1.50Å | |
| N7 | C23 | sing | 1.47Å | 1.51Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| O3 | C24 | sing | 1.43Å | 1.42Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| N3 | H13 | sing | 0.97Å | 1.00Å | |
| C27 | H30 | sing | 1.08Å | 1.08Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C26 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| O3 | H25 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C12 | C5 | 118.6° | 120.1° |
| C12 | C13 | C2 | 120.6° | 120.0° |
| C12 | C13 | H11 | 119.7° | 120.0° |
| C13 | C12 | H10 | 120.7° | 120.0° |
| C12 | C5 | O2 | 117.8° | 120.0° |
| C12 | C5 | C4 | 121.3° | 120.0° |
| C5 | C12 | H10 | 120.7° | 120.0° |
| C13 | C2 | N1 | 116.1° | 120.0° |
| C13 | C2 | C3 | 118.9° | 120.0° |
| C2 | C13 | H11 | 119.7° | 120.0° |
| C6 | O2 | C5 | 121.2° | 118.0° |
| O2 | C6 | C7 | 117.4° | 120.0° |
| O2 | C6 | C11 | 121.8° | 120.1° |
| O2 | C5 | C4 | 120.8° | 120.0° |
| C6 | C7 | C8 | 119.5° | 119.9° |
| C7 | C6 | C11 | 120.8° | 119.9° |
| C6 | C7 | H5 | 120.3° | 120.1° |
| C7 | C8 | C9 | 120.6° | 120.1° |
| C7 | C8 | H6 | 119.7° | 120.0° |
| C8 | C7 | H5 | 120.2° | 120.0° |
| C6 | C11 | C10 | 118.3° | 119.9° |
| C6 | C11 | H9 | 120.9° | 120.0° |
| C5 | C4 | C3 | 120.8° | 120.0° |
| C5 | C4 | H4 | 119.6° | 120.0° |
| C8 | C9 | C10 | 120.1° | 120.1° |
| C8 | C9 | H7 | 119.9° | 119.9° |
| C9 | C8 | H6 | 119.7° | 120.0° |
| C11 | C10 | C9 | 120.8° | 120.1° |
| C10 | C11 | H9 | 120.9° | 120.0° |
| C11 | C10 | H8 | 119.6° | 120.0° |
| C9 | C10 | H8 | 119.6° | 119.9° |
| C10 | C9 | H7 | 120.0° | 120.0° |
| N1 | C2 | C3 | 125.0° | 120.0° |
| C2 | N1 | C1 | 127.5° | 120.0° |
| C2 | N1 | H2 | 116.2° | 120.1° |
| C2 | C3 | C4 | 119.7° | 120.0° |
| C2 | C3 | H3 | 120.2° | 120.0° |
| N1 | C1 | C14 | 117.3° | 120.0° |
| N1 | C1 | O1 | 125.2° | 120.0° |
| C1 | N1 | H2 | 116.3° | 119.9° |
| C3 | C4 | H4 | 119.6° | 120.0° |
| C4 | C3 | H3 | 120.2° | 120.0° |
| C14 | C15 | N2 | 114.0° | 114.0° |
| C15 | C14 | C1 | 128.2° | 126.1° |
| C15 | C14 | S | 112.8° | 107.8° |
| C14 | C15 | H12 | 123.0° | 123.0° |
| C15 | N2 | C16 | 108.1° | 117.3° |
| N2 | C15 | H12 | 123.0° | 123.0° |
| C14 | C1 | O1 | 117.2° | 120.0° |
| C1 | C14 | S | 118.7° | 126.1° |
| C14 | S | C16 | 89.9° | 90.4° |
| N2 | C16 | S | 115.3° | 110.5° |
| N2 | C16 | N3 | 119.8° | 124.7° |
| S | C16 | N3 | 124.8° | 124.8° |
| C16 | N3 | C17 | 126.4° | 120.0° |
| C16 | N3 | H13 | 116.8° | 120.0° |
| N3 | C17 | C27 | 118.3° | 120.5° |
| N3 | C17 | N4 | 119.8° | 120.5° |
| C17 | N3 | H13 | 116.8° | 120.0° |
| C27 | C17 | N4 | 121.7° | 119.0° |
| C17 | C27 | C20 | 116.9° | 118.3° |
| C17 | C27 | H30 | 121.5° | 120.9° |
| C17 | N4 | C18 | 117.2° | 120.9° |
| C27 | C20 | N5 | 121.9° | 119.0° |
| C27 | C20 | N6 | 122.8° | 120.5° |
| C20 | C27 | H30 | 121.5° | 120.9° |
| N4 | C18 | N5 | 126.2° | 121.9° |
| N4 | C18 | C19 | 115.9° | 119.0° |
| N5 | C18 | C19 | 117.8° | 119.1° |
| C18 | N5 | C20 | 116.1° | 120.9° |
| C18 | C19 | H14 | 109.5° | 109.5° |
| C18 | C19 | H15 | 109.5° | 109.5° |
| C18 | C19 | H16 | 109.5° | 109.5° |
| N5 | C20 | N6 | 115.4° | 120.5° |
| C20 | N6 | C21 | 125.3° | 111.0° |
| C20 | N6 | C26 | 125.0° | 111.0° |
| N6 | C21 | C22 | 108.0° | 109.4° |
| C21 | N6 | C26 | 109.7° | 110.9° |
| N6 | C21 | H17 | 109.8° | 109.5° |
| N6 | C21 | H18 | 109.8° | 109.5° |
| C21 | C22 | N7 | 108.9° | 109.3° |
| C21 | C22 | H19 | 109.6° | 109.5° |
| C21 | C22 | H20 | 109.6° | 109.5° |
| C22 | C21 | H17 | 109.9° | 109.5° |
| C22 | C21 | H18 | 109.8° | 109.5° |
| N6 | C26 | C25 | 106.5° | 109.3° |
| N6 | C26 | H28 | 110.2° | 109.5° |
| N6 | C26 | H29 | 110.2° | 109.5° |
| C26 | C25 | N7 | 109.0° | 109.4° |
| C25 | C26 | H28 | 110.2° | 109.5° |
| C25 | C26 | H29 | 110.2° | 109.5° |
| C26 | C25 | H27 | 109.6° | 109.5° |
| C26 | C25 | H26 | 109.6° | 109.5° |
| C22 | N7 | C25 | 110.0° | 110.9° |
| C22 | N7 | C23 | 114.0° | 111.0° |
| N7 | C22 | H19 | 109.6° | 109.5° |
| N7 | C22 | H20 | 109.6° | 109.5° |
| C25 | N7 | C23 | 114.2° | 111.0° |
| N7 | C25 | H27 | 109.6° | 109.5° |
| N7 | C25 | H26 | 109.6° | 109.5° |
| N7 | C23 | C24 | 114.2° | 109.5° |
| N7 | C23 | H22 | 108.3° | 109.4° |
| N7 | C23 | H21 | 108.3° | 109.5° |
| C23 | C24 | O3 | 110.6° | 109.5° |
| C24 | C23 | H22 | 108.3° | 109.5° |
| C24 | C23 | H21 | 108.3° | 109.4° |
| C23 | C24 | H23 | 109.2° | 109.5° |
| C23 | C24 | H24 | 109.2° | 109.5° |
| O3 | C24 | H23 | 109.2° | 109.5° |
| O3 | C24 | H24 | 109.2° | 109.5° |
| C24 | O3 | H25 | 109.5° | 114.0° |
| H14 | C19 | H15 | 109.5° | 109.5° |
| H14 | C19 | H16 | 109.5° | 109.5° |
| H15 | C19 | H16 | 109.5° | 109.5° |
| H28 | C26 | H29 | 109.5° | 109.5° |
| H27 | C25 | H26 | 109.5° | 109.5° |
| H19 | C22 | H20 | 109.5° | 109.5° |
| H17 | C21 | H18 | 109.5° | 109.5° |
| H22 | C23 | H21 | 109.5° | 109.5° |
| H23 | C24 | H24 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C12 | C5 | H10 | 180.0° | 180.0° |
| C12 | C13 | C2 | H11 | 180.0° | 179.9° |
| C13 | C12 | C5 | O2 | 174.7° | 180.0° |
| C13 | C12 | C5 | C4 | 1.9° | 0.0° |
| C12 | C13 | C2 | N1 | 176.4° | 180.0° |
| C12 | C13 | C2 | C3 | 4.2° | 0.3° |
| C5 | C12 | C13 | C2 | 1.6° | 0.0° |
| C12 | C5 | O2 | C6 | 105.7° | 80.1° |
| C12 | C5 | O2 | C4 | 176.6° | 180.0° |
| C12 | C5 | C4 | C3 | 2.9° | 0.2° |
| C5 | C12 | C13 | H11 | 178.4° | 179.9° |
| C12 | C5 | C4 | H4 | 177.1° | 180.0° |
| C13 | C2 | N1 | C3 | 179.4° | 179.8° |
| C13 | C2 | N1 | C1 | 165.3° | 153.8° |
| C13 | C2 | C3 | C4 | 3.3° | 0.5° |
| C13 | C2 | N1 | H2 | 14.8° | 26.1° |
| C2 | C13 | C12 | H10 | 178.4° | 180.0° |
| C13 | C2 | C3 | H3 | 176.7° | 179.7° |
| O2 | C6 | C7 | C11 | 178.0° | 179.7° |
| O2 | C6 | C7 | C8 | 178.4° | 179.7° |
| C6 | O2 | C5 | C4 | 70.9° | 99.9° |
| O2 | C6 | C11 | C10 | 178.8° | 180.0° |
| O2 | C6 | C11 | H9 | 1.2° | 0.0° |
| O2 | C6 | C7 | H5 | 1.6° | 0.0° |
| C5 | O2 | C6 | C7 | 162.1° | 173.6° |
| C5 | O2 | C6 | C11 | 19.9° | 6.6° |
| O2 | C5 | C4 | C3 | 173.7° | 179.8° |
| O2 | C5 | C12 | H10 | 5.3° | 0.0° |
| O2 | C5 | C4 | H4 | 6.3° | 0.0° |
| C6 | C7 | C8 | H5 | 180.0° | 179.7° |
| C6 | C7 | C8 | C9 | 0.3° | 0.5° |
| C7 | C6 | C11 | C10 | 0.9° | 0.2° |
| C7 | C6 | C11 | H9 | 179.1° | 179.8° |
| C6 | C7 | C8 | H6 | 179.7° | 179.7° |
| C8 | C7 | C6 | C11 | 0.4° | 0.5° |
| C7 | C8 | C9 | H6 | 180.0° | 179.7° |
| C7 | C8 | C9 | C10 | 0.5° | 0.3° |
| C7 | C8 | C9 | H7 | 179.5° | 179.7° |
| C6 | C11 | C10 | H9 | 180.0° | 180.0° |
| C6 | C11 | C10 | C9 | 0.7° | 0.0° |
| C6 | C11 | C10 | H8 | 179.3° | 180.0° |
| C11 | C6 | C7 | H5 | 179.6° | 179.8° |
| C5 | C4 | C3 | C2 | 0.2° | 0.5° |
| C5 | C4 | C3 | H4 | 180.0° | 179.8° |
| C4 | C5 | C12 | H10 | 178.1° | 180.0° |
| C5 | C4 | C3 | H3 | 179.8° | 179.7° |
| C8 | C9 | C10 | C11 | 0.0° | 0.0° |
| C8 | C9 | C10 | H7 | 180.0° | 180.0° |
| C8 | C9 | C10 | H8 | 180.0° | 179.9° |
| C9 | C8 | C7 | H5 | 179.7° | 179.7° |
| C11 | C10 | C9 | H8 | 180.0° | 179.9° |
| C11 | C10 | C9 | H7 | 180.0° | 180.0° |
| C9 | C10 | C11 | H9 | 179.3° | 180.0° |
| C10 | C9 | C8 | H6 | 179.5° | 180.0° |
| C2 | N1 | C1 | H2 | 180.0° | 179.9° |
| N1 | C2 | C3 | C4 | 177.4° | 179.7° |
| C2 | N1 | C1 | C14 | 176.3° | 176.7° |
| C2 | N1 | C1 | O1 | 9.5° | 3.7° |
| N1 | C2 | C13 | H11 | 3.6° | 0.0° |
| N1 | C2 | C3 | H3 | 2.7° | 0.1° |
| C3 | C2 | N1 | C1 | 14.1° | 25.9° |
| C2 | C3 | C4 | H3 | 180.0° | 179.8° |
| C3 | C2 | N1 | H2 | 165.9° | 154.2° |
| C3 | C2 | C13 | H11 | 175.8° | 179.8° |
| C2 | C3 | C4 | H4 | 179.8° | 179.7° |
| N1 | C1 | C14 | C15 | 42.7° | 180.0° |
| N1 | C1 | C14 | O1 | 174.7° | 179.6° |
| N1 | C1 | C14 | S | 144.2° | 0.4° |
| C14 | C15 | N2 | H12 | 180.0° | 179.9° |
| C15 | C14 | C1 | S | 173.1° | 179.6° |
| C15 | C14 | C1 | O1 | 142.6° | 0.4° |
| C14 | C15 | N2 | C16 | 0.0° | 0.1° |
| C15 | C14 | S | C16 | 0.7° | 0.4° |
| N2 | C15 | C14 | C1 | 172.9° | 180.0° |
| N2 | C15 | C14 | S | 0.5° | 0.3° |
| C15 | N2 | C16 | S | 0.6° | 0.3° |
| C15 | N2 | C16 | N3 | 178.6° | 180.0° |
| C1 | C14 | S | C16 | 173.4° | 180.0° |
| C14 | C1 | N1 | H2 | 3.7° | 3.2° |
| C1 | C14 | C15 | H12 | 7.1° | 0.1° |
| O1 | C1 | C14 | S | 30.5° | 180.0° |
| O1 | C1 | N1 | H2 | 170.5° | 176.4° |
| C14 | S | C16 | N2 | 0.7° | 0.4° |
| C14 | S | C16 | N3 | 178.7° | 179.9° |
| S | C14 | C15 | H12 | 179.4° | 179.8° |
| N2 | C16 | S | N3 | 177.9° | 179.8° |
| N2 | C16 | N3 | C17 | 177.4° | 5.2° |
| C16 | N2 | C15 | H12 | 180.0° | 180.0° |
| N2 | C16 | N3 | H13 | 2.6° | 174.9° |
| S | C16 | N3 | C17 | 4.8° | 174.6° |
| S | C16 | N3 | H13 | 175.2° | 5.4° |
| C16 | N3 | C17 | H13 | 180.0° | 180.0° |
| C16 | N3 | C17 | C27 | 179.1° | 176.1° |
| C16 | N3 | C17 | N4 | 6.6° | 3.6° |
| N3 | C17 | C27 | N4 | 174.2° | 179.7° |
| N3 | C17 | C27 | C20 | 173.8° | 180.0° |
| N3 | C17 | N4 | C18 | 172.4° | 179.8° |
| N3 | C17 | C27 | H30 | 6.3° | 0.0° |
| C17 | C27 | C20 | H30 | 180.0° | 180.0° |
| C27 | C17 | N4 | C18 | 1.7° | 0.5° |
| C17 | C27 | C20 | N5 | 0.9° | 0.0° |
| C17 | C27 | C20 | N6 | 177.8° | 180.0° |
| C27 | C17 | N3 | H13 | 1.0° | 4.0° |
| N4 | C17 | C27 | C20 | 0.4° | 0.3° |
| C17 | N4 | C18 | N5 | 1.8° | 0.5° |
| C17 | N4 | C18 | C19 | 174.7° | 179.7° |
| N4 | C17 | N3 | H13 | 173.4° | 176.3° |
| N4 | C17 | C27 | H30 | 179.5° | 179.8° |
| C27 | C20 | N5 | C18 | 0.9° | 0.0° |
| C27 | C20 | N5 | N6 | 178.8° | 180.0° |
| C27 | C20 | N6 | C21 | 18.2° | 56.2° |
| C27 | C20 | N6 | C26 | 161.8° | 180.0° |
| N4 | C18 | N5 | C19 | 176.4° | 179.8° |
| N4 | C18 | N5 | C20 | 0.5° | 0.2° |
| N4 | C18 | C19 | H14 | 0.0° | 89.7° |
| N4 | C18 | C19 | H15 | 120.0° | 30.3° |
| N4 | C18 | C19 | H16 | 120.0° | 150.3° |
| C18 | N5 | C20 | N6 | 177.9° | 180.0° |
| N5 | C18 | C19 | H14 | 176.8° | 90.0° |
| N5 | C18 | C19 | H15 | 63.2° | 150.0° |
| N5 | C18 | C19 | H16 | 56.7° | 30.0° |
| C19 | C18 | N5 | C20 | 175.9° | 180.0° |
| C18 | C19 | H14 | H15 | 120.0° | 120.0° |
| C18 | C19 | H14 | H16 | 120.0° | 120.0° |
| C18 | C19 | H15 | H16 | 120.0° | 120.0° |
| N5 | C20 | N6 | C21 | 163.0° | 123.8° |
| N5 | C20 | N6 | C26 | 17.0° | 0.0° |
| N5 | C20 | C27 | H30 | 179.1° | 180.0° |
| C20 | N6 | C21 | C26 | 180.0° | 123.9° |
| C20 | N6 | C21 | C22 | 115.4° | 176.8° |
| C20 | N6 | C26 | C25 | 114.7° | 176.8° |
| N6 | C20 | C27 | H30 | 2.2° | 0.0° |
| C20 | N6 | C26 | H28 | 4.9° | 56.9° |
| C20 | N6 | C26 | H29 | 125.8° | 63.3° |
| C20 | N6 | C21 | H17 | 124.8° | 63.2° |
| C20 | N6 | C21 | H18 | 4.4° | 56.8° |
| N6 | C21 | C22 | H17 | 119.8° | 119.9° |
| N6 | C21 | C22 | H18 | 119.8° | 120.0° |
| C21 | N6 | C26 | C25 | 65.3° | 59.3° |
| N6 | C21 | C22 | N7 | 59.9° | 58.4° |
| C21 | N6 | C26 | H28 | 175.1° | 179.2° |
| C21 | N6 | C26 | H29 | 54.2° | 60.6° |
| N6 | C21 | C22 | H19 | 179.8° | 61.6° |
| N6 | C21 | C22 | H20 | 60.0° | 178.4° |
| N6 | C21 | H17 | H18 | 120.7° | 120.1° |
| C22 | C21 | N6 | C26 | 64.6° | 59.3° |
| C21 | C22 | N7 | H19 | 119.9° | 119.9° |
| C21 | C22 | N7 | H20 | 119.9° | 120.0° |
| C21 | C22 | N7 | C25 | 58.6° | 59.3° |
| C21 | C22 | N7 | C23 | 171.6° | 176.9° |
| C21 | C22 | H19 | H20 | 120.3° | 120.1° |
| C22 | C21 | H17 | H18 | 120.7° | 120.0° |
| N6 | C26 | C25 | H28 | 119.5° | 120.0° |
| N6 | C26 | C25 | H29 | 119.5° | 120.0° |
| N6 | C26 | C25 | N7 | 62.1° | 58.4° |
| N6 | C26 | H28 | H29 | 121.4° | 120.1° |
| N6 | C26 | C25 | H27 | 57.8° | 61.6° |
| N6 | C26 | C25 | H26 | 177.9° | 178.4° |
| C26 | N6 | C21 | H17 | 55.2° | 60.6° |
| C26 | N6 | C21 | H18 | 175.6° | 179.3° |
| C26 | C25 | N7 | C22 | 60.3° | 59.4° |
| C26 | C25 | N7 | H27 | 119.9° | 119.9° |
| C26 | C25 | N7 | H26 | 119.9° | 120.0° |
| C26 | C25 | N7 | C23 | 170.0° | 176.8° |
| C25 | C26 | H28 | H29 | 121.4° | 120.0° |
| C26 | C25 | H27 | H26 | 120.2° | 120.0° |
| C22 | N7 | C25 | C23 | 129.7° | 123.8° |
| C22 | N7 | C23 | C24 | 61.6° | 159.1° |
| C22 | N7 | C25 | H27 | 59.6° | 60.6° |
| C22 | N7 | C25 | H26 | 179.8° | 179.3° |
| N7 | C22 | H19 | H20 | 120.3° | 120.1° |
| N7 | C22 | C21 | H17 | 59.9° | 61.5° |
| N7 | C22 | C21 | H18 | 179.7° | 178.4° |
| C22 | N7 | C23 | H22 | 177.7° | 39.2° |
| C22 | N7 | C23 | H21 | 59.1° | 80.9° |
| C25 | N7 | C23 | C24 | 66.1° | 77.1° |
| N7 | C25 | C26 | H28 | 178.3° | 178.4° |
| N7 | C25 | C26 | H29 | 57.4° | 61.6° |
| N7 | C25 | H27 | H26 | 120.2° | 120.1° |
| C25 | N7 | C22 | H19 | 178.5° | 60.6° |
| C25 | N7 | C22 | H20 | 61.3° | 179.3° |
| C25 | N7 | C23 | H22 | 54.6° | 162.9° |
| C25 | N7 | C23 | H21 | 173.2° | 42.9° |
| N7 | C23 | C24 | H22 | 120.7° | 119.9° |
| N7 | C23 | C24 | H21 | 120.7° | 120.1° |
| N7 | C23 | C24 | O3 | 86.0° | 54.6° |
| C23 | N7 | C25 | H27 | 70.1° | 63.2° |
| C23 | N7 | C25 | H26 | 50.0° | 56.9° |
| C23 | N7 | C22 | H19 | 51.7° | 63.2° |
| C23 | N7 | C22 | H20 | 68.5° | 56.9° |
| N7 | C23 | H22 | H21 | 117.9° | 120.1° |
| N7 | C23 | C24 | H23 | 34.2° | 174.6° |
| N7 | C23 | C24 | H24 | 153.8° | 65.4° |
| C23 | C24 | O3 | H23 | 120.2° | 120.0° |
| C23 | C24 | O3 | H24 | 120.2° | 120.0° |
| C24 | C23 | H22 | H21 | 117.8° | 120.0° |
| C23 | C24 | H23 | H24 | 119.5° | 120.0° |
| C23 | C24 | O3 | H25 | 180.0° | 180.0° |
| O3 | C24 | C23 | H22 | 153.3° | 65.3° |
| O3 | C24 | C23 | H21 | 34.7° | 174.7° |
| O3 | C24 | H23 | H24 | 119.5° | 120.0° |
| H11 | C13 | C12 | H10 | 1.6° | 0.1° |
| H9 | C11 | C10 | H8 | 0.7° | 0.1° |
| H8 | C10 | C9 | H7 | 0.0° | 0.1° |
| H7 | C9 | C8 | H6 | 0.5° | 0.0° |
| H6 | C8 | C7 | H5 | 0.3° | 0.0° |
| H4 | C4 | C3 | H3 | 0.1° | 0.1° |
| H14 | C19 | H15 | H16 | 120.0° | 120.0° |
| H28 | C26 | C25 | H27 | 61.8° | 58.4° |
| H28 | C26 | C25 | H26 | 58.4° | 61.7° |
| H29 | C26 | C25 | H27 | 177.3° | 178.5° |
| H29 | C26 | C25 | H26 | 62.6° | 58.4° |
| H19 | C22 | C21 | H17 | 60.0° | 178.5° |
| H19 | C22 | C21 | H18 | 60.4° | 58.4° |
| H20 | C22 | C21 | H17 | 179.8° | 58.4° |
| H20 | C22 | C21 | H18 | 59.8° | 61.6° |
| H22 | C23 | C24 | H23 | 86.5° | 54.7° |
| H22 | C23 | C24 | H24 | 33.1° | 174.7° |
| H21 | C23 | C24 | H23 | 154.9° | 65.3° |
| H21 | C23 | C24 | H24 | 85.5° | 54.7° |
| H23 | C24 | O3 | H25 | 59.8° | 60.0° |
| H24 | C24 | O3 | H25 | 59.8° | 60.0° |
