A1AEE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N1 | sing | 1.47Å | 1.48Å | |
| N1 | C2 | sing | 1.37Å | 1.33Å | |
| C2 | C3 | doub | 1.35Å | 1.38Å | |
| C3 | C4 | sing | 1.47Å | 1.38Å | |
| C4 | C5 | doub | 1.38Å | 1.43Å | |
| C5 | C6 | sing | 1.41Å | 1.40Å | |
| C6 | S1 | sing | 1.76Å | 1.74Å | Aromatic |
| S1 | C7 | sing | 1.76Å | 1.73Å | Aromatic |
| C7 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.37Å | 1.38Å | Aromatic |
| C11 | C12 | doub | 1.41Å | 1.39Å | Aromatic |
| C12 | N2 | sing | 1.34Å | 1.39Å | Aromatic |
| N2 | C13 | sing | 1.46Å | 1.46Å | |
| C13 | C14 | sing | 1.51Å | 1.50Å | |
| C14 | O1 | doub | 1.21Å | 1.23Å | |
| C14 | N3 | sing | 1.35Å | 1.33Å | |
| N3 | C15 | sing | 1.47Å | 1.45Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.37Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | doub | 1.39Å | 1.38Å | Aromatic |
| C21 | N4 | sing | 1.40Å | 1.42Å | |
| N4 | C22 | sing | 1.35Å | 1.35Å | Aromatic |
| C22 | C23 | doub | 1.35Å | 1.36Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.39Å | Aromatic |
| C24 | N5 | doub | 1.31Å | 1.33Å | Aromatic |
| C4 | C25 | sing | 1.48Å | 1.43Å | |
| C25 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.36Å | Aromatic |
| C27 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.37Å | Aromatic |
| C29 | C30 | doub | 1.39Å | 1.40Å | Aromatic |
| N1 | C30 | sing | 1.38Å | 1.39Å | |
| C6 | N2 | doub | 1.30Å | 1.36Å | Aromatic |
| C16 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| N4 | N5 | sing | 1.40Å | 1.36Å | Aromatic |
| C25 | C30 | sing | 1.41Å | 1.41Å | Aromatic |
| C7 | C12 | sing | 1.40Å | 1.40Å | Aromatic |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H17 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H19 | sing | 1.08Å | 1.08Å | |
| C24 | H22 | sing | 1.08Å | 1.08Å | |
| C10 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C26 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H24 | sing | 1.08Å | 1.08Å | |
| C28 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C9 | H8 | sing | 1.08Å | 1.08Å | |
| N3 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N1 | C2 | 119.0° | 119.1° |
| C1 | N1 | C30 | 120.0° | 119.0° |
| N1 | C1 | H3 | 109.5° | 109.4° |
| N1 | C1 | H1 | 109.5° | 109.5° |
| N1 | C1 | H2 | 109.5° | 109.4° |
| N1 | C2 | C3 | 122.0° | 121.9° |
| C2 | N1 | C30 | 121.0° | 121.9° |
| N1 | C2 | H4 | 119.0° | 119.1° |
| C2 | C3 | C4 | 120.1° | 119.1° |
| C3 | C2 | H4 | 119.0° | 119.0° |
| C2 | C3 | H5 | 120.0° | 120.5° |
| C3 | C4 | C5 | 123.1° | 121.6° |
| C3 | C4 | C25 | 119.0° | 116.9° |
| C4 | C3 | H5 | 120.0° | 120.5° |
| C4 | C5 | C6 | 131.9° | 120.0° |
| C5 | C4 | C25 | 117.9° | 121.5° |
| C4 | C5 | H6 | 114.0° | 120.0° |
| C5 | C6 | S1 | 125.4° | 124.9° |
| C5 | C6 | N2 | 123.9° | 124.8° |
| C6 | C5 | H6 | 114.0° | 120.0° |
| C6 | S1 | C7 | 90.7° | 90.5° |
| S1 | C6 | N2 | 110.7° | 110.3° |
| S1 | C7 | C8 | 128.6° | 131.0° |
| S1 | C7 | C12 | 110.5° | 108.5° |
| C7 | C8 | C9 | 117.7° | 120.2° |
| C8 | C7 | C12 | 120.8° | 120.4° |
| C7 | C8 | H7 | 121.1° | 119.9° |
| C8 | C9 | C10 | 121.2° | 120.0° |
| C9 | C8 | H7 | 121.1° | 119.9° |
| C8 | C9 | H8 | 119.4° | 120.0° |
| C9 | C10 | C11 | 121.8° | 120.6° |
| C9 | C10 | H9 | 119.1° | 119.7° |
| C10 | C9 | H8 | 119.4° | 120.0° |
| C10 | C11 | C12 | 117.6° | 120.4° |
| C10 | C11 | H10 | 121.2° | 119.8° |
| C11 | C10 | H9 | 119.1° | 119.7° |
| C11 | C12 | N2 | 126.9° | 128.6° |
| C11 | C12 | C7 | 120.8° | 118.4° |
| C12 | C11 | H10 | 121.2° | 119.9° |
| C12 | N2 | C13 | 123.7° | 121.2° |
| C12 | N2 | C6 | 113.1° | 117.7° |
| N2 | C12 | C7 | 112.2° | 113.0° |
| N2 | C13 | C14 | 113.1° | 109.5° |
| C13 | N2 | C6 | 123.3° | 121.2° |
| N2 | C13 | H12 | 108.6° | 109.5° |
| N2 | C13 | H11 | 108.6° | 109.5° |
| C13 | C14 | O1 | 122.2° | 120.0° |
| C13 | C14 | N3 | 113.8° | 120.0° |
| C14 | C13 | H12 | 108.6° | 109.5° |
| C14 | C13 | H11 | 108.6° | 109.5° |
| O1 | C14 | N3 | 124.0° | 120.0° |
| C14 | N3 | C15 | 122.5° | 120.0° |
| C14 | N3 | H13 | 118.7° | 120.0° |
| N3 | C15 | C16 | 112.6° | 109.5° |
| N3 | C15 | H15 | 108.7° | 109.4° |
| N3 | C15 | H14 | 108.7° | 109.5° |
| C15 | N3 | H13 | 118.7° | 120.0° |
| C15 | C16 | C17 | 120.5° | 120.0° |
| C15 | C16 | C21 | 120.7° | 120.0° |
| C16 | C15 | H15 | 108.7° | 109.5° |
| C16 | C15 | H14 | 108.7° | 109.5° |
| C16 | C17 | C18 | 120.8° | 120.1° |
| C17 | C16 | C21 | 118.8° | 119.9° |
| C16 | C17 | H16 | 119.6° | 120.0° |
| C17 | C18 | C19 | 119.8° | 120.1° |
| C18 | C17 | H16 | 119.6° | 120.0° |
| C17 | C18 | H17 | 120.1° | 119.9° |
| C18 | C19 | C20 | 120.4° | 120.0° |
| C19 | C18 | H17 | 120.1° | 119.9° |
| C18 | C19 | H18 | 119.8° | 120.0° |
| C19 | C20 | C21 | 120.0° | 119.9° |
| C20 | C19 | H18 | 119.8° | 120.0° |
| C19 | C20 | H19 | 120.0° | 120.0° |
| C20 | C21 | N4 | 120.5° | 120.0° |
| C20 | C21 | C16 | 120.1° | 119.9° |
| C21 | C20 | H19 | 120.0° | 120.1° |
| C21 | N4 | C22 | 128.9° | 126.0° |
| N4 | C21 | C16 | 119.3° | 120.1° |
| C21 | N4 | N5 | 119.8° | 126.0° |
| N4 | C22 | C23 | 107.5° | 107.7° |
| C22 | N4 | N5 | 111.3° | 107.9° |
| N4 | C22 | H20 | 126.3° | 126.2° |
| C22 | C23 | C24 | 105.2° | 108.0° |
| C23 | C22 | H20 | 126.2° | 126.1° |
| C22 | C23 | H21 | 127.4° | 126.1° |
| C23 | C24 | N5 | 111.6° | 108.2° |
| C23 | C24 | H22 | 124.2° | 125.9° |
| C24 | C23 | H21 | 127.4° | 126.0° |
| C24 | N5 | N4 | 104.3° | 108.2° |
| N5 | C24 | H22 | 124.2° | 125.9° |
| C4 | C25 | C26 | 123.3° | 121.6° |
| C4 | C25 | C30 | 118.5° | 118.1° |
| C25 | C26 | C27 | 121.0° | 119.5° |
| C26 | C25 | C30 | 118.2° | 120.3° |
| C25 | C26 | H23 | 119.5° | 120.3° |
| C26 | C27 | C28 | 120.1° | 120.3° |
| C27 | C26 | H23 | 119.5° | 120.2° |
| C26 | C27 | H24 | 120.0° | 119.8° |
| C27 | C28 | C29 | 120.9° | 120.7° |
| C28 | C27 | H24 | 119.9° | 119.8° |
| C27 | C28 | H25 | 119.6° | 119.6° |
| C28 | C29 | C30 | 119.9° | 119.8° |
| C29 | C28 | H25 | 119.6° | 119.7° |
| C28 | C29 | H26 | 120.0° | 120.1° |
| C29 | C30 | N1 | 120.7° | 121.1° |
| C29 | C30 | C25 | 119.9° | 119.4° |
| C30 | C29 | H26 | 120.1° | 120.1° |
| N1 | C30 | C25 | 119.3° | 119.5° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H12 | C13 | H11 | 109.4° | 109.5° |
| H15 | C15 | H14 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N1 | C2 | C30 | 179.8° | 179.5° |
| C1 | N1 | C2 | C3 | 176.9° | 165.8° |
| C1 | N1 | C30 | C29 | 3.1° | 14.1° |
| C1 | N1 | C30 | C25 | 176.7° | 166.0° |
| N1 | C1 | H3 | H1 | 120.0° | 120.0° |
| N1 | C1 | H3 | H2 | 120.0° | 119.9° |
| N1 | C1 | H1 | H2 | 120.0° | 120.0° |
| C1 | N1 | C2 | H4 | 3.1° | 14.5° |
| N1 | C2 | C3 | H4 | 180.0° | 179.7° |
| N1 | C2 | C3 | C4 | 0.7° | 0.1° |
| C2 | N1 | C30 | C29 | 176.6° | 166.4° |
| C2 | N1 | C30 | C25 | 3.5° | 13.5° |
| C2 | N1 | C1 | H3 | 180.0° | 0.0° |
| C2 | N1 | C1 | H1 | 60.0° | 120.0° |
| C2 | N1 | C1 | H2 | 60.0° | 120.0° |
| N1 | C2 | C3 | H5 | 179.3° | 180.0° |
| C2 | C3 | C4 | H5 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 174.7° | 167.3° |
| C2 | C3 | C4 | C25 | 4.4° | 12.7° |
| C3 | C2 | N1 | C30 | 3.4° | 13.7° |
| C3 | C4 | C5 | C25 | 179.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.8° | 11.5° |
| C3 | C4 | C25 | C26 | 176.5° | 167.5° |
| C3 | C4 | C25 | C30 | 4.1° | 12.4° |
| C4 | C3 | C2 | H4 | 179.3° | 179.7° |
| C3 | C4 | C5 | H6 | 179.2° | 168.5° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C4 | C5 | C6 | S1 | 24.1° | 7.5° |
| C5 | C4 | C25 | C26 | 4.4° | 12.5° |
| C4 | C5 | C6 | N2 | 152.8° | 172.8° |
| C5 | C4 | C25 | C30 | 175.0° | 167.6° |
| C5 | C4 | C3 | H5 | 5.3° | 12.6° |
| C5 | C6 | S1 | N2 | 177.3° | 179.7° |
| C5 | C6 | S1 | C7 | 168.1° | 180.0° |
| C5 | C6 | N2 | C12 | 164.5° | 179.8° |
| C5 | C6 | N2 | C13 | 15.1° | 0.0° |
| C6 | C5 | C4 | C25 | 179.9° | 168.5° |
| C6 | S1 | C7 | C8 | 172.0° | 180.0° |
| S1 | C6 | N2 | C12 | 18.1° | 0.4° |
| S1 | C6 | N2 | C13 | 162.3° | 179.7° |
| C6 | S1 | C7 | C12 | 7.5° | 0.0° |
| S1 | C6 | C5 | H6 | 155.8° | 172.5° |
| S1 | C7 | C8 | C12 | 179.5° | 180.0° |
| S1 | C7 | C8 | C9 | 179.8° | 180.0° |
| S1 | C7 | C12 | C11 | 179.6° | 180.0° |
| S1 | C7 | C12 | N2 | 1.1° | 0.2° |
| C7 | S1 | C6 | N2 | 14.6° | 0.2° |
| S1 | C7 | C8 | H7 | 0.2° | 0.3° |
| C7 | C8 | C9 | H7 | 180.0° | 179.8° |
| C7 | C8 | C9 | C10 | 0.1° | 0.3° |
| C8 | C7 | C12 | C11 | 0.9° | 0.0° |
| C8 | C7 | C12 | N2 | 179.3° | 179.8° |
| C7 | C8 | C9 | H8 | 179.9° | 179.7° |
| C8 | C9 | C10 | H8 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 0.0° | 0.6° |
| C9 | C8 | C7 | C12 | 0.3° | 0.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C9 | C10 | C11 | H9 | 180.0° | 179.4° |
| C9 | C10 | C11 | C12 | 0.6° | 0.6° |
| C10 | C9 | C8 | H7 | 179.9° | 180.0° |
| C9 | C10 | C11 | H10 | 179.4° | 179.5° |
| C10 | C11 | C12 | H10 | 180.0° | 179.9° |
| C10 | C11 | C12 | N2 | 179.2° | 180.0° |
| C10 | C11 | C12 | C7 | 1.0° | 0.3° |
| C11 | C10 | C9 | H8 | 179.9° | 179.4° |
| C11 | C12 | N2 | C7 | 178.4° | 179.7° |
| C11 | C12 | N2 | C13 | 10.5° | 0.0° |
| C11 | C12 | N2 | C6 | 169.1° | 179.8° |
| C12 | C11 | C10 | H9 | 179.5° | 180.0° |
| C12 | N2 | C13 | C6 | 179.6° | 179.8° |
| C12 | N2 | C13 | C14 | 96.1° | 90.0° |
| N2 | C12 | C11 | H10 | 0.8° | 0.0° |
| C12 | N2 | C13 | H12 | 24.4° | 30.0° |
| C12 | N2 | C13 | H11 | 143.3° | 150.0° |
| N2 | C13 | C14 | H12 | 120.6° | 120.0° |
| N2 | C13 | C14 | H11 | 120.6° | 120.0° |
| N2 | C13 | C14 | O1 | 25.6° | 0.0° |
| N2 | C13 | C14 | N3 | 154.3° | 180.0° |
| C13 | N2 | C12 | C7 | 167.8° | 179.7° |
| N2 | C13 | H12 | H11 | 118.3° | 120.0° |
| C13 | C14 | O1 | N3 | 179.9° | 179.9° |
| C13 | C14 | N3 | C15 | 92.6° | 180.0° |
| C14 | C13 | N2 | C6 | 83.4° | 89.8° |
| C14 | C13 | H12 | H11 | 118.3° | 120.0° |
| C13 | C14 | N3 | H13 | 87.5° | 0.1° |
| O1 | C14 | N3 | C15 | 87.5° | 0.1° |
| O1 | C14 | C13 | H12 | 146.2° | 120.0° |
| O1 | C14 | C13 | H11 | 94.9° | 120.0° |
| O1 | C14 | N3 | H13 | 92.5° | 180.0° |
| C14 | N3 | C15 | H13 | 180.0° | 179.9° |
| C14 | N3 | C15 | C16 | 68.2° | 180.0° |
| N3 | C14 | C13 | H12 | 33.8° | 60.0° |
| N3 | C14 | C13 | H11 | 85.1° | 59.9° |
| C14 | N3 | C15 | H15 | 171.3° | 60.1° |
| C14 | N3 | C15 | H14 | 52.3° | 60.0° |
| N3 | C15 | C16 | H15 | 120.5° | 119.9° |
| N3 | C15 | C16 | H14 | 120.5° | 120.0° |
| N3 | C15 | C16 | C17 | 107.1° | 99.9° |
| N3 | C15 | C16 | C21 | 72.0° | 79.7° |
| N3 | C15 | H15 | H14 | 118.6° | 120.0° |
| C15 | C16 | C17 | C21 | 179.2° | 179.6° |
| C15 | C16 | C17 | C18 | 180.0° | 180.0° |
| C15 | C16 | C21 | C20 | 179.8° | 179.7° |
| C15 | C16 | C21 | N4 | 0.6° | 0.1° |
| C16 | C15 | H15 | H14 | 118.6° | 120.0° |
| C15 | C16 | C17 | H16 | 0.0° | 0.1° |
| C16 | C15 | N3 | H13 | 111.8° | 0.0° |
| C16 | C17 | C18 | H16 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 0.3° | 0.1° |
| C17 | C16 | C21 | C20 | 1.1° | 0.7° |
| C17 | C16 | C21 | N4 | 179.7° | 179.7° |
| C17 | C16 | C15 | H15 | 132.4° | 20.0° |
| C17 | C16 | C15 | H14 | 13.3° | 140.1° |
| C16 | C17 | C18 | H17 | 179.7° | 179.9° |
| C17 | C18 | C19 | H17 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.0° |
| C18 | C17 | C16 | C21 | 0.8° | 0.4° |
| C17 | C18 | C19 | H18 | 179.9° | 180.0° |
| C18 | C19 | C20 | H18 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.4° | 0.3° |
| C19 | C18 | C17 | H16 | 179.7° | 179.9° |
| C18 | C19 | C20 | H19 | 179.6° | 180.0° |
| C19 | C20 | C21 | H19 | 180.0° | 179.7° |
| C19 | C20 | C21 | N4 | 180.0° | 179.7° |
| C19 | C20 | C21 | C16 | 0.8° | 0.6° |
| C20 | C19 | C18 | H17 | 179.9° | 180.0° |
| C20 | C21 | N4 | C16 | 179.2° | 179.6° |
| C20 | C21 | N4 | C22 | 100.2° | 0.3° |
| C20 | C21 | N4 | N5 | 81.3° | 179.2° |
| C21 | C20 | C19 | H18 | 179.6° | 179.7° |
| C21 | N4 | C22 | N5 | 178.6° | 179.6° |
| C21 | N4 | C22 | C23 | 179.3° | 180.0° |
| C21 | N4 | N5 | C24 | 179.4° | 180.0° |
| N4 | C21 | C20 | H19 | 0.1° | 0.0° |
| C21 | N4 | C22 | H20 | 0.7° | 0.3° |
| N4 | C22 | C23 | H20 | 180.0° | 179.7° |
| N4 | C22 | C23 | C24 | 0.4° | 0.3° |
| C22 | N4 | N5 | C24 | 0.6° | 0.5° |
| C22 | N4 | C21 | C16 | 80.6° | 179.9° |
| N4 | C22 | C23 | H21 | 179.7° | 179.7° |
| C22 | C23 | C24 | H21 | 180.0° | 180.0° |
| C22 | C23 | C24 | N5 | 0.0° | 0.0° |
| C23 | C22 | N4 | N5 | 0.6° | 0.5° |
| C22 | C23 | C24 | H22 | 180.0° | 179.7° |
| C23 | C24 | N5 | H22 | 180.0° | 179.8° |
| C23 | C24 | N5 | N4 | 0.4° | 0.2° |
| C24 | C23 | C22 | H20 | 179.6° | 180.0° |
| N5 | C24 | C23 | H21 | 179.9° | 180.0° |
| C4 | C25 | C26 | C30 | 179.4° | 180.0° |
| C4 | C25 | C26 | C27 | 179.8° | 179.9° |
| C4 | C25 | C30 | C29 | 179.6° | 179.8° |
| C4 | C25 | C30 | N1 | 0.2° | 0.1° |
| C25 | C4 | C3 | H5 | 175.6° | 167.4° |
| C25 | C4 | C5 | H6 | 0.2° | 11.5° |
| C4 | C25 | C26 | H23 | 0.2° | 0.1° |
| C25 | C26 | C27 | H23 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.3° | 0.0° |
| C26 | C25 | C30 | C29 | 0.2° | 0.1° |
| C26 | C25 | C30 | N1 | 179.6° | 179.9° |
| C25 | C26 | C27 | H24 | 179.7° | 180.0° |
| C26 | C27 | C28 | H24 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.0° | 0.0° |
| C27 | C26 | C25 | C30 | 0.4° | 0.0° |
| C26 | C27 | C28 | H25 | 180.0° | 179.9° |
| C27 | C28 | C29 | H25 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.2° | 0.1° |
| C28 | C27 | C26 | H23 | 179.7° | 180.0° |
| C27 | C28 | C29 | H26 | 179.8° | 180.0° |
| C28 | C29 | C30 | H26 | 180.0° | 179.9° |
| C28 | C29 | C30 | N1 | 179.9° | 179.9° |
| C28 | C29 | C30 | C25 | 0.1° | 0.1° |
| C29 | C28 | C27 | H24 | 180.0° | 180.0° |
| C29 | C30 | N1 | C25 | 179.9° | 179.9° |
| C30 | C29 | C28 | H25 | 179.8° | 180.0° |
| C30 | N1 | C1 | H3 | 0.2° | 179.5° |
| C30 | N1 | C1 | H1 | 120.3° | 59.5° |
| C30 | N1 | C1 | H2 | 119.8° | 60.5° |
| C30 | N1 | C2 | H4 | 176.6° | 166.0° |
| N1 | C30 | C29 | H26 | 0.1° | 0.0° |
| C6 | N2 | C12 | C7 | 12.5° | 0.5° |
| N2 | C6 | C5 | H6 | 27.2° | 7.2° |
| C6 | N2 | C13 | H12 | 156.0° | 150.2° |
| C6 | N2 | C13 | H11 | 37.1° | 30.2° |
| C16 | C21 | N4 | N5 | 97.9° | 0.4° |
| C21 | C16 | C15 | H15 | 48.4° | 160.4° |
| C21 | C16 | C15 | H14 | 167.5° | 40.3° |
| C21 | C16 | C17 | H16 | 179.2° | 179.7° |
| C16 | C21 | C20 | H19 | 179.1° | 179.6° |
| N4 | N5 | C24 | H22 | 179.6° | 180.0° |
| N5 | N4 | C22 | H20 | 179.4° | 179.9° |
| C30 | C25 | C26 | H23 | 179.6° | 179.9° |
| C25 | C30 | C29 | H26 | 180.0° | 180.0° |
| C12 | C7 | C8 | H7 | 179.7° | 179.7° |
| C7 | C12 | C11 | H10 | 179.0° | 179.8° |
| H3 | C1 | H1 | H2 | 120.0° | 120.1° |
| H4 | C2 | C3 | H5 | 0.7° | 0.3° |
| H7 | C8 | C9 | H8 | 0.1° | 0.0° |
| H10 | C11 | C10 | H9 | 0.6° | 0.1° |
| H15 | C15 | N3 | H13 | 8.7° | 120.0° |
| H14 | C15 | N3 | H13 | 127.7° | 120.0° |
| H16 | C17 | C18 | H17 | 0.3° | 0.0° |
| H17 | C18 | C19 | H18 | 0.1° | 0.0° |
| H18 | C19 | C20 | H19 | 0.4° | 0.0° |
| H22 | C24 | C23 | H21 | 0.1° | 0.3° |
| H9 | C10 | C9 | H8 | 0.0° | 0.0° |
| H20 | C22 | C23 | H21 | 0.3° | 0.0° |
| H23 | C26 | C27 | H24 | 0.3° | 0.0° |
| H24 | C27 | C28 | H25 | 0.0° | 0.0° |
| H25 | C28 | C29 | H26 | 0.1° | 0.1° |
