5GR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.51Å | |
| C20 | N4 | sing | 1.47Å | 1.47Å | |
| C21 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| N4 | N5 | sing | 1.29Å | 1.34Å | Aromatic |
| N4 | C19 | sing | 1.35Å | 1.34Å | Aromatic |
| N5 | N6 | doub | 1.29Å | 1.31Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | doub | 1.35Å | 1.36Å | Aromatic |
| N6 | C18 | sing | 1.34Å | 1.36Å | Aromatic |
| C18 | C17 | sing | 1.51Å | 1.49Å | |
| C17 | O1 | sing | 1.43Å | 1.43Å | |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| O1 | C16 | sing | 1.36Å | 1.37Å | |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.51Å | |
| C11 | C10 | sing | 1.51Å | 1.50Å | |
| C10 | S1 | sing | 1.76Å | 1.73Å | Aromatic |
| C10 | C9 | doub | 1.33Å | 1.35Å | Aromatic |
| S1 | C8 | sing | 1.71Å | 1.73Å | Aromatic |
| C9 | N3 | sing | 1.32Å | 1.37Å | Aromatic |
| O | C | doub | 1.21Å | 1.23Å | |
| C8 | N3 | doub | 1.30Å | 1.30Å | Aromatic |
| C8 | N2 | sing | 1.39Å | 1.38Å | |
| C | N2 | sing | 1.35Å | 1.37Å | |
| C | C1 | sing | 1.51Å | 1.52Å | |
| S | C1 | sing | 1.81Å | 1.83Å | |
| S | C2 | sing | 1.76Å | 1.75Å | |
| C2 | N1 | doub | 1.33Å | 1.34Å | Aromatic |
| C2 | N | sing | 1.33Å | 1.34Å | Aromatic |
| N1 | C6 | sing | 1.32Å | 1.34Å | Aromatic |
| N | C3 | doub | 1.32Å | 1.34Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.50Å | |
| C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C5 | sing | 1.39Å | 1.38Å | Aromatic |
| C3 | C4 | sing | 1.51Å | 1.50Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C9 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H4 | sing | 1.08Å | 1.08Å | |
| C27 | H5 | sing | 1.08Å | 1.08Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.08Å | 1.08Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C4 | H11 | sing | 1.09Å | 1.10Å | |
| C4 | H12 | sing | 1.09Å | 1.10Å | |
| N2 | H13 | sing | 0.97Å | 1.00Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C13 | H17 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.08Å | 1.08Å | |
| C25 | H24 | sing | 1.08Å | 1.08Å | |
| C24 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | H26 | sing | 1.08Å | 1.08Å | |
| C22 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C21 | 120.8° | 120.0° |
| C26 | C25 | C24 | 120.2° | 120.0° |
| C25 | C26 | H23 | 119.6° | 120.0° |
| C26 | C25 | H24 | 119.9° | 120.0° |
| C26 | C21 | C20 | 120.9° | 120.0° |
| C26 | C21 | C22 | 118.5° | 120.0° |
| C21 | C26 | H23 | 119.6° | 120.0° |
| C25 | C24 | C23 | 119.7° | 120.0° |
| C24 | C25 | H24 | 119.9° | 120.0° |
| C25 | C24 | H25 | 120.2° | 120.0° |
| C21 | C20 | N4 | 112.9° | 109.5° |
| C20 | C21 | C22 | 120.7° | 120.0° |
| C21 | C20 | H21 | 108.6° | 109.4° |
| C21 | C20 | H22 | 108.6° | 109.5° |
| C20 | N4 | N5 | 120.3° | 125.8° |
| C20 | N4 | C19 | 128.9° | 125.9° |
| N4 | C20 | H21 | 108.6° | 109.5° |
| N4 | C20 | H22 | 108.6° | 109.5° |
| C21 | C22 | C23 | 120.8° | 120.0° |
| C21 | C22 | H27 | 119.6° | 120.0° |
| C24 | C23 | C22 | 120.2° | 120.0° |
| C23 | C24 | H25 | 120.2° | 120.0° |
| C24 | C23 | H26 | 119.9° | 120.0° |
| N5 | N4 | C19 | 110.8° | 108.3° |
| N4 | N5 | N6 | 107.0° | 110.2° |
| N4 | C19 | C18 | 105.2° | 106.1° |
| N4 | C19 | H20 | 127.4° | 126.9° |
| N5 | N6 | C18 | 109.1° | 108.9° |
| C22 | C23 | H26 | 119.9° | 120.0° |
| C23 | C22 | H27 | 119.6° | 120.0° |
| C19 | C18 | N6 | 107.9° | 106.5° |
| C19 | C18 | C17 | 130.2° | 126.7° |
| C18 | C19 | H20 | 127.4° | 127.0° |
| N6 | C18 | C17 | 121.9° | 126.8° |
| C18 | C17 | O1 | 107.1° | 109.5° |
| C18 | C17 | H18 | 110.1° | 109.4° |
| C18 | C17 | H19 | 110.1° | 109.4° |
| C17 | O1 | C16 | 121.6° | 117.0° |
| O1 | C17 | H18 | 110.0° | 109.5° |
| O1 | C17 | H19 | 110.0° | 109.5° |
| C14 | C15 | C16 | 118.9° | 119.9° |
| C15 | C14 | C13 | 120.5° | 120.1° |
| C14 | C15 | H4 | 120.6° | 120.1° |
| C15 | C14 | H16 | 119.7° | 119.9° |
| C15 | C16 | O1 | 129.4° | 120.0° |
| C15 | C16 | C27 | 120.8° | 119.9° |
| C16 | C15 | H4 | 120.6° | 120.0° |
| O1 | C16 | C27 | 109.8° | 120.1° |
| C14 | C13 | C12 | 120.9° | 120.1° |
| C13 | C14 | H16 | 119.7° | 120.0° |
| C14 | C13 | H17 | 119.6° | 120.0° |
| C16 | C27 | C12 | 120.3° | 119.9° |
| C16 | C27 | H5 | 119.9° | 120.1° |
| C13 | C12 | C27 | 118.7° | 120.0° |
| C13 | C12 | C11 | 120.7° | 120.0° |
| C12 | C13 | H17 | 119.6° | 119.9° |
| C27 | C12 | C11 | 120.6° | 120.0° |
| C12 | C27 | H5 | 119.9° | 120.0° |
| C12 | C11 | C10 | 115.4° | 109.5° |
| C12 | C11 | H14 | 108.0° | 109.4° |
| C12 | C11 | H15 | 107.9° | 109.4° |
| C11 | C10 | S1 | 122.4° | 126.0° |
| C11 | C10 | C9 | 128.6° | 126.0° |
| C10 | C11 | H14 | 107.9° | 109.5° |
| C10 | C11 | H15 | 108.0° | 109.5° |
| S1 | C10 | C9 | 108.9° | 108.0° |
| C10 | S1 | C8 | 89.1° | 90.3° |
| C10 | C9 | N3 | 117.2° | 114.6° |
| C10 | C9 | H3 | 121.4° | 122.7° |
| S1 | C8 | N3 | 115.2° | 110.2° |
| S1 | C8 | N2 | 125.0° | 124.9° |
| C9 | N3 | C8 | 109.6° | 116.9° |
| N3 | C9 | H3 | 121.4° | 122.7° |
| O | C | N2 | 123.5° | 120.0° |
| O | C | C1 | 121.5° | 120.0° |
| N3 | C8 | N2 | 119.8° | 124.9° |
| C8 | N2 | C | 124.8° | 120.0° |
| C8 | N2 | H13 | 117.6° | 120.0° |
| N2 | C | C1 | 114.9° | 120.0° |
| C | N2 | H13 | 117.6° | 120.0° |
| C | C1 | S | 123.9° | 109.5° |
| C | C1 | H1 | 105.8° | 109.4° |
| C | C1 | H2 | 105.8° | 109.4° |
| C1 | S | C2 | 102.1° | 100.0° |
| S | C1 | H1 | 105.8° | 109.5° |
| S | C1 | H2 | 105.8° | 109.5° |
| S | C2 | N1 | 111.1° | 119.2° |
| S | C2 | N | 121.2° | 119.2° |
| N1 | C2 | N | 127.5° | 121.6° |
| C2 | N1 | C6 | 115.7° | 120.8° |
| C2 | N | C3 | 115.6° | 120.7° |
| N1 | C6 | C7 | 116.8° | 120.4° |
| N1 | C6 | C5 | 121.2° | 119.2° |
| N | C3 | C5 | 121.3° | 119.3° |
| N | C3 | C4 | 116.7° | 120.4° |
| C7 | C6 | C5 | 121.9° | 120.3° |
| C6 | C7 | H6 | 109.5° | 109.4° |
| C6 | C7 | H7 | 109.4° | 109.4° |
| C6 | C7 | H8 | 109.5° | 109.4° |
| C6 | C5 | C3 | 118.6° | 118.5° |
| C6 | C5 | H9 | 120.7° | 120.8° |
| C5 | C3 | C4 | 122.0° | 120.4° |
| C3 | C5 | H9 | 120.7° | 120.7° |
| C3 | C4 | H10 | 109.5° | 109.5° |
| C3 | C4 | H11 | 109.4° | 109.5° |
| C3 | C4 | H12 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H6 | C7 | H7 | 109.5° | 109.5° |
| H6 | C7 | H8 | 109.5° | 109.5° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H10 | C4 | H11 | 109.5° | 109.5° |
| H10 | C4 | H12 | 109.4° | 109.4° |
| H11 | C4 | H12 | 109.5° | 109.5° |
| H14 | C11 | H15 | 109.5° | 109.5° |
| H18 | C17 | H19 | 109.5° | 109.5° |
| H21 | C20 | H22 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C21 | H23 | 180.0° | 179.9° |
| C26 | C25 | C24 | H24 | 180.0° | 179.9° |
| C25 | C26 | C21 | C20 | 179.6° | 179.7° |
| C25 | C26 | C21 | C22 | 0.1° | 0.1° |
| C26 | C25 | C24 | C23 | 0.1° | 0.0° |
| C26 | C25 | C24 | H25 | 179.9° | 179.9° |
| C21 | C26 | C25 | C24 | 0.1° | 0.1° |
| C26 | C21 | C20 | C22 | 179.7° | 179.6° |
| C26 | C21 | C20 | N4 | 118.3° | 89.7° |
| C26 | C21 | C22 | C23 | 0.2° | 0.0° |
| C26 | C21 | C20 | H21 | 2.2° | 30.3° |
| C26 | C21 | C20 | H22 | 121.2° | 150.3° |
| C21 | C26 | C25 | H24 | 180.0° | 179.9° |
| C26 | C21 | C22 | H27 | 179.8° | 179.7° |
| C25 | C24 | C23 | H25 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 0.1° | 0.1° |
| C24 | C25 | C26 | H23 | 179.9° | 180.0° |
| C25 | C24 | C23 | H26 | 179.9° | 180.0° |
| C21 | C20 | N4 | H21 | 120.5° | 120.0° |
| C21 | C20 | N4 | H22 | 120.5° | 120.0° |
| C21 | C20 | N4 | N5 | 50.3° | 55.0° |
| C21 | C20 | N4 | C19 | 131.6° | 125.3° |
| C20 | C21 | C22 | C23 | 179.5° | 179.6° |
| C21 | C20 | H21 | H22 | 118.4° | 120.0° |
| C20 | C21 | C26 | H23 | 0.4° | 0.4° |
| C20 | C21 | C22 | H27 | 0.5° | 0.1° |
| N4 | C20 | C21 | C22 | 61.4° | 90.0° |
| C20 | N4 | N5 | C19 | 178.4° | 179.7° |
| C20 | N4 | N5 | N6 | 178.1° | 180.0° |
| C20 | N4 | C19 | C18 | 178.0° | 179.8° |
| C20 | N4 | C19 | H20 | 2.0° | 0.3° |
| N4 | C20 | H21 | H22 | 118.4° | 120.0° |
| C21 | C22 | C23 | C24 | 0.2° | 0.1° |
| C21 | C22 | C23 | H27 | 180.0° | 179.7° |
| C22 | C21 | C20 | H21 | 178.0° | 150.0° |
| C22 | C21 | C20 | H22 | 59.1° | 30.1° |
| C22 | C21 | C26 | H23 | 179.9° | 180.0° |
| C21 | C22 | C23 | H26 | 179.8° | 180.0° |
| C24 | C23 | C22 | H26 | 180.0° | 179.9° |
| C23 | C24 | C25 | H24 | 180.0° | 179.9° |
| C24 | C23 | C22 | H27 | 179.8° | 179.8° |
| N5 | N4 | C19 | C18 | 0.3° | 0.5° |
| N4 | N5 | N6 | C18 | 0.3° | 0.0° |
| N5 | N4 | C19 | H20 | 179.8° | 180.0° |
| N5 | N4 | C20 | H21 | 70.2° | 175.0° |
| N5 | N4 | C20 | H22 | 170.8° | 65.0° |
| C19 | N4 | N5 | N6 | 0.4° | 0.3° |
| N4 | C19 | C18 | H20 | 180.0° | 179.5° |
| N4 | C19 | C18 | N6 | 0.1° | 0.5° |
| N4 | C19 | C18 | C17 | 177.6° | 179.8° |
| C19 | N4 | C20 | H21 | 107.9° | 5.4° |
| C19 | N4 | C20 | H22 | 11.0° | 114.7° |
| N5 | N6 | C18 | C19 | 0.2° | 0.3° |
| N5 | N6 | C18 | C17 | 177.7° | 180.0° |
| C22 | C23 | C24 | H25 | 179.9° | 179.9° |
| C19 | C18 | N6 | C17 | 177.8° | 179.7° |
| C19 | C18 | C17 | O1 | 86.1° | 0.3° |
| C19 | C18 | C17 | H18 | 154.3° | 119.7° |
| C19 | C18 | C17 | H19 | 33.5° | 120.3° |
| N6 | C18 | C17 | O1 | 91.2° | 179.9° |
| N6 | C18 | C17 | H18 | 28.4° | 59.9° |
| N6 | C18 | C17 | H19 | 149.2° | 60.0° |
| N6 | C18 | C19 | H20 | 180.0° | 180.0° |
| C18 | C17 | O1 | H18 | 119.6° | 120.0° |
| C18 | C17 | O1 | H19 | 119.6° | 120.0° |
| C18 | C17 | O1 | C16 | 82.6° | 180.0° |
| C18 | C17 | H18 | H19 | 121.1° | 119.9° |
| C17 | C18 | C19 | H20 | 2.4° | 0.3° |
| C17 | O1 | C16 | C15 | 5.8° | 0.0° |
| C17 | O1 | C16 | C27 | 171.2° | 179.9° |
| O1 | C17 | H18 | H19 | 121.1° | 120.1° |
| C14 | C15 | C16 | H4 | 180.0° | 179.7° |
| C14 | C15 | C16 | O1 | 178.0° | 179.7° |
| C15 | C14 | C13 | H16 | 180.0° | 179.6° |
| C14 | C15 | C16 | C27 | 1.2° | 0.4° |
| C15 | C14 | C13 | C12 | 0.4° | 0.0° |
| C15 | C14 | C13 | H17 | 179.6° | 179.9° |
| C15 | C16 | O1 | C27 | 177.1° | 179.9° |
| C16 | C15 | C14 | C13 | 0.8° | 0.3° |
| C15 | C16 | C27 | C12 | 0.4° | 0.1° |
| C15 | C16 | C27 | H5 | 179.6° | 179.9° |
| C16 | C15 | C14 | H16 | 179.2° | 180.0° |
| O1 | C16 | C27 | C12 | 177.8° | 180.0° |
| O1 | C16 | C15 | H4 | 2.0° | 0.1° |
| O1 | C16 | C27 | H5 | 2.2° | 0.1° |
| C16 | O1 | C17 | H18 | 157.8° | 60.0° |
| C16 | O1 | C17 | H19 | 37.1° | 60.0° |
| C14 | C13 | C12 | H17 | 180.0° | 180.0° |
| C14 | C13 | C12 | C27 | 1.2° | 0.3° |
| C14 | C13 | C12 | C11 | 176.3° | 180.0° |
| C13 | C14 | C15 | H4 | 179.2° | 180.0° |
| C16 | C27 | C12 | C13 | 0.8° | 0.2° |
| C16 | C27 | C12 | H5 | 180.0° | 179.9° |
| C16 | C27 | C12 | C11 | 176.8° | 179.9° |
| C27 | C16 | C15 | H4 | 178.8° | 180.0° |
| C13 | C12 | C27 | C11 | 177.5° | 179.7° |
| C13 | C12 | C11 | C10 | 139.2° | 89.7° |
| C13 | C12 | C27 | H5 | 179.2° | 179.6° |
| C13 | C12 | C11 | H14 | 18.4° | 30.3° |
| C13 | C12 | C11 | H15 | 99.9° | 150.3° |
| C12 | C13 | C14 | H16 | 179.6° | 179.7° |
| C27 | C12 | C11 | C10 | 43.3° | 90.0° |
| C27 | C12 | C11 | H14 | 164.1° | 150.0° |
| C27 | C12 | C11 | H15 | 77.6° | 30.0° |
| C27 | C12 | C13 | H17 | 178.8° | 179.8° |
| C12 | C11 | C10 | H14 | 120.9° | 120.0° |
| C12 | C11 | C10 | H15 | 120.9° | 120.0° |
| C12 | C11 | C10 | S1 | 93.2° | 90.0° |
| C12 | C11 | C10 | C9 | 86.3° | 90.0° |
| C11 | C12 | C27 | H5 | 3.3° | 0.1° |
| C12 | C11 | H14 | H15 | 117.3° | 119.9° |
| C11 | C12 | C13 | H17 | 3.7° | 0.1° |
| C11 | C10 | S1 | C9 | 179.6° | 180.0° |
| C11 | C10 | S1 | C8 | 179.3° | 179.8° |
| C11 | C10 | C9 | N3 | 179.3° | 180.0° |
| C11 | C10 | C9 | H3 | 0.7° | 0.3° |
| C10 | C11 | H14 | H15 | 117.3° | 120.1° |
| S1 | C10 | C9 | N3 | 0.3° | 0.0° |
| C10 | S1 | C8 | N3 | 0.3° | 0.3° |
| C10 | S1 | C8 | N2 | 179.6° | 179.9° |
| S1 | C10 | C9 | H3 | 179.7° | 179.7° |
| S1 | C10 | C11 | H14 | 145.9° | 150.0° |
| S1 | C10 | C11 | H15 | 27.7° | 30.0° |
| C9 | C10 | S1 | C8 | 0.3° | 0.2° |
| C10 | C9 | N3 | H3 | 180.0° | 179.7° |
| C10 | C9 | N3 | C8 | 0.1° | 0.2° |
| C9 | C10 | C11 | H14 | 34.6° | 30.0° |
| C9 | C10 | C11 | H15 | 152.9° | 150.0° |
| S1 | C8 | N3 | C9 | 0.2° | 0.4° |
| S1 | C8 | N3 | N2 | 179.9° | 179.7° |
| S1 | C8 | N2 | C | 0.1° | 179.6° |
| S1 | C8 | N2 | H13 | 179.9° | 0.5° |
| C9 | N3 | C8 | N2 | 179.7° | 180.0° |
| O | C | N2 | C8 | 14.0° | 0.0° |
| O | C | N2 | C1 | 176.7° | 180.0° |
| O | C | C1 | S | 111.8° | 0.0° |
| O | C | C1 | H1 | 126.3° | 120.0° |
| O | C | C1 | H2 | 10.2° | 120.0° |
| O | C | N2 | H13 | 166.0° | 180.0° |
| N3 | C8 | N2 | C | 179.8° | 0.0° |
| C8 | N3 | C9 | H3 | 179.9° | 180.0° |
| N3 | C8 | N2 | H13 | 0.2° | 179.9° |
| C8 | N2 | C | H13 | 180.0° | 180.0° |
| C8 | N2 | C | C1 | 169.3° | 180.0° |
| N2 | C | C1 | S | 71.5° | 180.0° |
| N2 | C | C1 | H1 | 50.5° | 60.0° |
| N2 | C | C1 | H2 | 166.6° | 60.0° |
| C | C1 | S | H1 | 122.0° | 120.0° |
| C | C1 | S | H2 | 122.0° | 120.0° |
| C | C1 | S | C2 | 76.6° | 180.0° |
| C | C1 | H1 | H2 | 113.5° | 119.9° |
| C1 | C | N2 | H13 | 10.7° | 0.0° |
| C1 | S | C2 | N1 | 169.0° | 180.0° |
| C1 | S | C2 | N | 6.1° | 0.3° |
| S | C1 | H1 | H2 | 113.5° | 120.0° |
| S | C2 | N1 | N | 174.7° | 179.7° |
| S | C2 | N1 | C6 | 174.2° | 179.7° |
| S | C2 | N | C3 | 175.1° | 179.8° |
| C2 | S | C1 | H1 | 45.4° | 60.0° |
| C2 | S | C1 | H2 | 161.4° | 60.0° |
| N1 | C2 | N | C3 | 0.9° | 0.0° |
| C2 | N1 | C6 | C7 | 177.7° | 180.0° |
| C2 | N1 | C6 | C5 | 1.3° | 0.0° |
| N | C2 | N1 | C6 | 0.6° | 0.0° |
| C2 | N | C3 | C5 | 1.6° | 0.1° |
| C2 | N | C3 | C4 | 176.3° | 180.0° |
| N1 | C6 | C7 | C5 | 179.0° | 180.0° |
| N1 | C6 | C5 | C3 | 0.6° | 0.0° |
| N1 | C6 | C7 | H6 | 0.0° | 90.0° |
| N1 | C6 | C7 | H7 | 120.0° | 30.0° |
| N1 | C6 | C7 | H8 | 120.0° | 149.9° |
| N1 | C6 | C5 | H9 | 179.4° | 180.0° |
| N | C3 | C5 | C6 | 0.9° | 0.1° |
| N | C3 | C5 | C4 | 177.8° | 179.9° |
| N | C3 | C5 | H9 | 179.1° | 180.0° |
| N | C3 | C4 | H10 | 0.0° | 90.0° |
| N | C3 | C4 | H11 | 120.0° | 30.1° |
| N | C3 | C4 | H12 | 120.0° | 150.1° |
| C7 | C6 | C5 | C3 | 178.3° | 180.0° |
| C6 | C7 | H6 | H7 | 120.0° | 119.9° |
| C6 | C7 | H6 | H8 | 120.0° | 120.0° |
| C6 | C7 | H7 | H8 | 120.0° | 119.9° |
| C7 | C6 | C5 | H9 | 1.7° | 0.1° |
| C6 | C5 | C3 | H9 | 180.0° | 179.9° |
| C6 | C5 | C3 | C4 | 176.9° | 180.0° |
| C5 | C6 | C7 | H6 | 179.0° | 90.0° |
| C5 | C6 | C7 | H7 | 61.0° | 150.0° |
| C5 | C6 | C7 | H8 | 58.9° | 30.0° |
| C5 | C3 | C4 | H10 | 177.9° | 90.0° |
| C5 | C3 | C4 | H11 | 62.1° | 150.0° |
| C5 | C3 | C4 | H12 | 57.9° | 30.0° |
| C4 | C3 | C5 | H9 | 3.1° | 0.1° |
| C3 | C4 | H10 | H11 | 120.0° | 120.0° |
| C3 | C4 | H10 | H12 | 120.0° | 120.0° |
| C3 | C4 | H11 | H12 | 120.0° | 120.0° |
| H4 | C15 | C14 | H16 | 0.8° | 0.4° |
| H6 | C7 | H7 | H8 | 120.0° | 120.1° |
| H10 | C4 | H11 | H12 | 120.0° | 120.0° |
| H16 | C14 | C13 | H17 | 0.4° | 0.3° |
| H23 | C26 | C25 | H24 | 0.0° | 0.1° |
| H24 | C25 | C24 | H25 | 0.0° | 0.0° |
| H25 | C24 | C23 | H26 | 0.1° | 0.0° |
| H26 | C23 | C22 | H27 | 0.2° | 0.3° |
