KK4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.41Å | Aromatic |
| C26 | C21 | doub | 1.39Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.41Å | Aromatic |
| C22 | C1 | sing | 1.48Å | 1.47Å | |
| C30 | C27 | sing | 1.51Å | 1.51Å | |
| C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C10 | C9 | sing | 1.37Å | 1.42Å | Aromatic |
| C21 | O1 | sing | 1.35Å | 1.36Å | |
| C27 | C1 | doub | 1.36Å | 1.35Å | |
| C27 | C28 | sing | 1.46Å | 1.47Å | |
| C1 | C2 | sing | 1.48Å | 1.50Å | |
| N3 | C28 | doub | 1.31Å | 1.29Å | |
| N3 | O2 | sing | 1.21Å | 1.47Å | |
| C19 | C2 | doub | 1.40Å | 1.38Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C13 | sing | 1.51Å | 1.50Å | |
| C9 | C8 | doub | 1.40Å | 1.40Å | Aromatic |
| C28 | N4 | sing | 1.39Å | 1.33Å | |
| C2 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C18 | C5 | doub | 1.38Å | 1.37Å | Aromatic |
| O2 | C29 | sing | 1.34Å | 1.38Å | |
| O1 | C20 | sing | 1.41Å | 1.42Å | |
| C7 | C8 | sing | 1.41Å | 1.36Å | Aromatic |
| C7 | N1 | sing | 1.38Å | 1.35Å | Aromatic |
| C8 | N2 | sing | 1.36Å | 1.35Å | Aromatic |
| C3 | C20 | sing | 1.51Å | 1.51Å | |
| C3 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.37Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| N4 | C29 | sing | 1.36Å | 1.36Å | |
| C29 | O3 | doub | 1.22Å | 1.23Å | |
| N1 | C6 | sing | 1.46Å | 1.46Å | |
| N1 | C14 | sing | 1.36Å | 1.38Å | Aromatic |
| N2 | C14 | doub | 1.30Å | 1.29Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.49Å | |
| C17 | C16 | sing | 1.53Å | 1.50Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| N4 | H1 | sing | 0.97Å | 1.00Å | |
| C30 | H2 | sing | 1.09Å | 1.10Å | |
| C30 | H3 | sing | 1.09Å | 1.10Å | |
| C30 | H4 | sing | 1.09Å | 1.10Å | |
| C23 | H5 | sing | 1.08Å | 1.08Å | |
| C24 | H6 | sing | 1.08Å | 1.08Å | |
| C25 | H7 | sing | 1.08Å | 1.08Å | |
| C26 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.08Å | 1.08Å | |
| C18 | H12 | sing | 1.08Å | 1.08Å | |
| C4 | H13 | sing | 1.08Å | 1.08Å | |
| C6 | H14 | sing | 1.09Å | 1.10Å | |
| C6 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.08Å | 1.08Å | |
| C11 | H24 | sing | 1.08Å | 1.08Å | |
| C10 | H25 | sing | 1.08Å | 1.08Å | |
| C13 | H26 | sing | 1.09Å | 1.10Å | |
| C13 | H27 | sing | 1.09Å | 1.10Å | |
| C13 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C24 | C23 | 119.2° | 120.1° |
| C24 | C25 | C26 | 121.2° | 120.8° |
| C25 | C24 | H6 | 120.4° | 119.9° |
| C24 | C25 | H7 | 119.4° | 119.6° |
| C24 | C23 | C22 | 120.7° | 119.1° |
| C24 | C23 | H5 | 119.7° | 120.5° |
| C23 | C24 | H6 | 120.4° | 119.9° |
| C25 | C26 | C21 | 120.0° | 119.6° |
| C26 | C25 | H7 | 119.4° | 119.6° |
| C25 | C26 | H8 | 120.0° | 120.2° |
| C23 | C22 | C21 | 120.1° | 120.9° |
| C23 | C22 | C1 | 117.0° | 121.9° |
| C22 | C23 | H5 | 119.7° | 120.4° |
| C26 | C21 | C22 | 118.7° | 119.5° |
| C26 | C21 | O1 | 112.3° | 120.9° |
| C21 | C26 | H8 | 120.0° | 120.2° |
| C21 | C22 | C1 | 122.7° | 117.2° |
| C22 | C21 | O1 | 128.9° | 119.6° |
| C22 | C1 | C27 | 122.9° | 119.5° |
| C22 | C1 | C2 | 112.3° | 121.0° |
| C30 | C27 | C1 | 128.1° | 120.0° |
| C30 | C27 | C28 | 114.1° | 120.0° |
| C27 | C30 | H2 | 109.5° | 109.5° |
| C27 | C30 | H3 | 109.4° | 109.4° |
| C27 | C30 | H4 | 109.5° | 109.4° |
| C10 | C11 | C12 | 120.8° | 120.5° |
| C11 | C10 | C9 | 120.6° | 120.7° |
| C10 | C11 | H24 | 119.6° | 119.8° |
| C11 | C10 | H25 | 119.7° | 119.7° |
| C11 | C12 | C7 | 117.2° | 119.7° |
| C11 | C12 | H23 | 121.4° | 120.2° |
| C12 | C11 | H24 | 119.6° | 119.8° |
| C10 | C9 | C13 | 122.4° | 120.0° |
| C10 | C9 | C8 | 117.9° | 119.9° |
| C9 | C10 | H25 | 119.8° | 119.7° |
| C21 | O1 | C20 | 123.4° | 120.8° |
| C1 | C27 | C28 | 117.8° | 120.0° |
| C27 | C1 | C2 | 124.8° | 119.5° |
| C27 | C28 | N3 | 123.9° | 126.6° |
| C27 | C28 | N4 | 122.3° | 126.6° |
| C1 | C2 | C19 | 123.1° | 116.4° |
| C1 | C2 | C3 | 118.9° | 123.9° |
| C28 | N3 | O2 | 104.9° | 111.4° |
| N3 | C28 | N4 | 113.7° | 106.8° |
| N3 | O2 | C29 | 105.9° | 111.0° |
| C2 | C19 | C18 | 122.4° | 120.7° |
| C19 | C2 | C3 | 117.9° | 119.7° |
| C2 | C19 | H11 | 118.8° | 119.7° |
| C19 | C18 | C5 | 120.4° | 119.4° |
| C18 | C19 | H11 | 118.8° | 119.6° |
| C19 | C18 | H12 | 119.8° | 120.3° |
| C12 | C7 | C8 | 122.6° | 119.8° |
| C12 | C7 | N1 | 133.9° | 134.2° |
| C7 | C12 | H23 | 121.4° | 120.1° |
| C13 | C9 | C8 | 119.8° | 120.1° |
| C9 | C13 | H26 | 109.5° | 109.5° |
| C9 | C13 | H27 | 109.5° | 109.4° |
| C9 | C13 | H28 | 109.5° | 109.5° |
| C9 | C8 | C7 | 121.0° | 119.4° |
| C9 | C8 | N2 | 127.1° | 133.7° |
| C28 | N4 | C29 | 107.8° | 104.3° |
| C28 | N4 | H1 | 126.1° | 127.8° |
| C2 | C3 | C20 | 119.5° | 126.3° |
| C2 | C3 | C4 | 119.4° | 118.6° |
| C18 | C5 | C4 | 118.4° | 120.0° |
| C18 | C5 | C6 | 122.4° | 120.0° |
| C5 | C18 | H12 | 119.8° | 120.3° |
| O2 | C29 | N4 | 107.7° | 106.4° |
| O2 | C29 | O3 | 126.1° | 126.8° |
| O1 | C20 | C3 | 111.3° | 114.9° |
| O1 | C20 | H9 | 109.0° | 108.4° |
| O1 | C20 | H10 | 109.0° | 108.4° |
| C8 | C7 | N1 | 103.6° | 106.0° |
| C7 | C8 | N2 | 111.9° | 106.9° |
| C7 | N1 | C6 | 122.8° | 126.4° |
| C7 | N1 | C14 | 108.5° | 107.3° |
| C8 | N2 | C14 | 105.9° | 109.7° |
| C20 | C3 | C4 | 121.1° | 115.1° |
| C3 | C20 | H9 | 109.0° | 108.5° |
| C3 | C20 | H10 | 109.0° | 108.3° |
| C3 | C4 | C5 | 121.5° | 121.6° |
| C3 | C4 | H13 | 119.3° | 119.3° |
| C4 | C5 | C6 | 119.3° | 120.0° |
| C5 | C4 | H13 | 119.3° | 119.1° |
| C5 | C6 | N1 | 115.2° | 109.5° |
| C5 | C6 | H14 | 108.0° | 109.5° |
| C5 | C6 | H15 | 108.0° | 109.4° |
| N4 | C29 | O3 | 126.2° | 126.8° |
| C29 | N4 | H1 | 126.0° | 127.8° |
| C6 | N1 | C14 | 128.7° | 126.3° |
| N1 | C6 | H14 | 108.0° | 109.5° |
| N1 | C6 | H15 | 108.0° | 109.4° |
| N1 | C14 | N2 | 110.1° | 110.1° |
| N1 | C14 | C15 | 129.3° | 125.0° |
| N2 | C14 | C15 | 120.7° | 125.0° |
| C14 | C15 | C16 | 118.9° | 109.4° |
| C14 | C15 | H16 | 107.0° | 109.5° |
| C14 | C15 | H17 | 107.1° | 109.5° |
| C17 | C16 | C15 | 111.3° | 109.5° |
| C17 | C16 | H18 | 109.0° | 109.4° |
| C17 | C16 | H19 | 109.0° | 109.4° |
| C16 | C17 | H20 | 109.5° | 109.5° |
| C16 | C17 | H21 | 109.5° | 109.5° |
| C16 | C17 | H22 | 109.5° | 109.5° |
| C16 | C15 | H16 | 107.1° | 109.4° |
| C16 | C15 | H17 | 107.0° | 109.4° |
| C15 | C16 | H18 | 109.0° | 109.5° |
| C15 | C16 | H19 | 109.0° | 109.5° |
| H2 | C30 | H3 | 109.5° | 109.5° |
| H2 | C30 | H4 | 109.5° | 109.5° |
| H3 | C30 | H4 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 108.3° |
| H14 | C6 | H15 | 109.5° | 109.5° |
| H16 | C15 | H17 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.5° |
| H20 | C17 | H21 | 109.5° | 109.5° |
| H20 | C17 | H22 | 109.5° | 109.4° |
| H21 | C17 | H22 | 109.4° | 109.5° |
| H26 | C13 | H27 | 109.4° | 109.5° |
| H26 | C13 | H28 | 109.5° | 109.5° |
| H27 | C13 | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C24 | C23 | H6 | 180.0° | 179.9° |
| C24 | C25 | C26 | H7 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 3.0° | 0.1° |
| C24 | C25 | C26 | C21 | 0.1° | 0.1° |
| C25 | C24 | C23 | H5 | 177.0° | 180.0° |
| C24 | C25 | C26 | H8 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 1.2° | 0.5° |
| C24 | C23 | C22 | H5 | 180.0° | 179.9° |
| C24 | C23 | C22 | C21 | 3.7° | 0.7° |
| C24 | C23 | C22 | C1 | 177.8° | 178.7° |
| C23 | C24 | C25 | H7 | 178.8° | 179.6° |
| C25 | C26 | C21 | H8 | 180.0° | 180.0° |
| C25 | C26 | C21 | C22 | 0.7° | 0.6° |
| C25 | C26 | C21 | O1 | 178.5° | 177.7° |
| C26 | C25 | C24 | H6 | 178.8° | 179.6° |
| C23 | C22 | C21 | C26 | 2.5° | 1.0° |
| C23 | C22 | C21 | C1 | 173.7° | 179.5° |
| C23 | C22 | C21 | O1 | 179.9° | 177.3° |
| C23 | C22 | C1 | C27 | 54.2° | 59.4° |
| C23 | C22 | C1 | C2 | 124.1° | 121.0° |
| C22 | C23 | C24 | H6 | 177.0° | 180.0° |
| C26 | C21 | C22 | O1 | 177.4° | 178.4° |
| C26 | C21 | C22 | C1 | 176.2° | 178.4° |
| C26 | C21 | O1 | C20 | 179.1° | 106.0° |
| C21 | C26 | C25 | H7 | 179.9° | 180.0° |
| C21 | C22 | C1 | C27 | 131.9° | 120.1° |
| C21 | C22 | C1 | C2 | 49.8° | 59.6° |
| C22 | C21 | O1 | C20 | 3.4° | 72.3° |
| C21 | C22 | C23 | H5 | 176.3° | 179.2° |
| C22 | C21 | C26 | H8 | 179.3° | 179.4° |
| C22 | C1 | C27 | C30 | 1.9° | 6.7° |
| C1 | C22 | C21 | O1 | 6.4° | 3.2° |
| C22 | C1 | C27 | C2 | 178.1° | 179.6° |
| C22 | C1 | C27 | C28 | 176.9° | 173.4° |
| C22 | C1 | C2 | C19 | 112.6° | 137.8° |
| C22 | C1 | C2 | C3 | 65.5° | 42.1° |
| C1 | C22 | C23 | H5 | 2.2° | 1.3° |
| C30 | C27 | C1 | C28 | 178.7° | 179.9° |
| C30 | C27 | C1 | C2 | 179.9° | 173.7° |
| C30 | C27 | C28 | N3 | 94.2° | 114.8° |
| C30 | C27 | C28 | N4 | 89.6° | 65.5° |
| C27 | C30 | H2 | H3 | 120.0° | 119.9° |
| C27 | C30 | H2 | H4 | 120.0° | 120.0° |
| C27 | C30 | H3 | H4 | 120.0° | 119.9° |
| C10 | C11 | C12 | H24 | 180.0° | 179.7° |
| C11 | C10 | C9 | H25 | 180.0° | 179.7° |
| C10 | C11 | C12 | C7 | 0.2° | 0.0° |
| C11 | C10 | C9 | C13 | 179.6° | 180.0° |
| C11 | C10 | C9 | C8 | 1.5° | 0.5° |
| C10 | C11 | C12 | H23 | 179.8° | 180.0° |
| C12 | C11 | C10 | C9 | 0.7° | 0.3° |
| C11 | C12 | C7 | H23 | 180.0° | 180.0° |
| C11 | C12 | C7 | C8 | 0.2° | 0.0° |
| C11 | C12 | C7 | N1 | 178.5° | 179.5° |
| C12 | C11 | C10 | H25 | 179.3° | 180.0° |
| C10 | C9 | C13 | C8 | 178.1° | 179.4° |
| C10 | C9 | C8 | C7 | 1.5° | 0.5° |
| C10 | C9 | C8 | N2 | 178.1° | 179.8° |
| C9 | C10 | C11 | H24 | 179.4° | 180.0° |
| C10 | C9 | C13 | H26 | 91.0° | 90.0° |
| C10 | C9 | C13 | H27 | 149.0° | 150.0° |
| C10 | C9 | C13 | H28 | 29.0° | 30.1° |
| C21 | O1 | C20 | C3 | 54.5° | 70.0° |
| O1 | C21 | C26 | H8 | 1.5° | 2.3° |
| C21 | O1 | C20 | H9 | 174.8° | 51.5° |
| C21 | O1 | C20 | H10 | 65.7° | 168.8° |
| C1 | C27 | C28 | N3 | 84.7° | 65.4° |
| C27 | C1 | C2 | C19 | 65.6° | 42.6° |
| C1 | C27 | C28 | N4 | 91.5° | 114.4° |
| C27 | C1 | C2 | C3 | 116.3° | 137.6° |
| C1 | C27 | C30 | H2 | 180.0° | 90.0° |
| C1 | C27 | C30 | H3 | 60.0° | 150.1° |
| C1 | C27 | C30 | H4 | 60.0° | 30.1° |
| C28 | C27 | C1 | C2 | 1.2° | 6.2° |
| C27 | C28 | N3 | N4 | 176.5° | 179.8° |
| C27 | C28 | N3 | O2 | 177.5° | 180.0° |
| C27 | C28 | N4 | C29 | 177.8° | 179.8° |
| C27 | C28 | N4 | H1 | 2.2° | 0.0° |
| C28 | C27 | C30 | H2 | 1.3° | 89.9° |
| C28 | C27 | C30 | H3 | 121.2° | 30.1° |
| C28 | C27 | C30 | H4 | 118.8° | 150.0° |
| C1 | C2 | C19 | C3 | 178.1° | 179.9° |
| C1 | C2 | C19 | C18 | 179.9° | 179.9° |
| C1 | C2 | C3 | C20 | 0.4° | 0.2° |
| C1 | C2 | C3 | C4 | 178.0° | 180.0° |
| C1 | C2 | C19 | H11 | 0.2° | 0.1° |
| C28 | N3 | O2 | C29 | 0.4° | 0.0° |
| N3 | C28 | N4 | C29 | 1.2° | 0.4° |
| N3 | C28 | N4 | H1 | 178.7° | 179.8° |
| O2 | N3 | C28 | N4 | 1.0° | 0.2° |
| N3 | O2 | C29 | N4 | 0.3° | 0.3° |
| N3 | O2 | C29 | O3 | 178.3° | 180.0° |
| C2 | C19 | C18 | H11 | 180.0° | 180.0° |
| C2 | C19 | C18 | C5 | 2.5° | 0.0° |
| C19 | C2 | C3 | C20 | 178.6° | 180.0° |
| C19 | C2 | C3 | C4 | 0.2° | 0.1° |
| C2 | C19 | C18 | H12 | 177.6° | 180.0° |
| C18 | C19 | C2 | C3 | 2.0° | 0.3° |
| C19 | C18 | C5 | H12 | 180.0° | 180.0° |
| C19 | C18 | C5 | C4 | 0.7° | 0.5° |
| C19 | C18 | C5 | C6 | 179.2° | 179.9° |
| C12 | C7 | C8 | C9 | 0.7° | 0.2° |
| C12 | C7 | C8 | N1 | 179.0° | 179.6° |
| C12 | C7 | C8 | N2 | 179.0° | 180.0° |
| C12 | C7 | N1 | C6 | 1.2° | 0.3° |
| C12 | C7 | N1 | C14 | 179.6° | 179.9° |
| C7 | C12 | C11 | H24 | 179.8° | 179.7° |
| C13 | C9 | C8 | C7 | 179.7° | 179.9° |
| C13 | C9 | C8 | N2 | 0.1° | 0.4° |
| C13 | C9 | C10 | H25 | 0.4° | 0.3° |
| C9 | C13 | H26 | H27 | 120.0° | 120.0° |
| C9 | C13 | H26 | H28 | 120.0° | 120.1° |
| C9 | C13 | H27 | H28 | 120.0° | 120.0° |
| C9 | C8 | C7 | N2 | 179.6° | 179.7° |
| C9 | C8 | C7 | N1 | 179.7° | 179.9° |
| C9 | C8 | N2 | C14 | 179.5° | 179.9° |
| C8 | C9 | C10 | H25 | 178.5° | 179.8° |
| C8 | C9 | C13 | H26 | 90.9° | 89.5° |
| C8 | C9 | C13 | H27 | 29.1° | 30.5° |
| C8 | C9 | C13 | H28 | 149.1° | 150.4° |
| C28 | N4 | C29 | O2 | 0.9° | 0.4° |
| C28 | N4 | C29 | H1 | 180.0° | 179.9° |
| C28 | N4 | C29 | O3 | 177.7° | 179.8° |
| C2 | C3 | C20 | O1 | 69.0° | 11.7° |
| C2 | C3 | C20 | C4 | 178.4° | 179.9° |
| C2 | C3 | C4 | C5 | 1.9° | 0.3° |
| C2 | C3 | C20 | H9 | 170.7° | 109.7° |
| C2 | C3 | C20 | H10 | 51.3° | 132.9° |
| C3 | C2 | C19 | H11 | 178.0° | 179.8° |
| C2 | C3 | C4 | H13 | 178.1° | 179.7° |
| C18 | C5 | C4 | C3 | 1.4° | 0.6° |
| C18 | C5 | C4 | C6 | 179.9° | 179.6° |
| C18 | C5 | C6 | N1 | 11.8° | 90.0° |
| C5 | C18 | C19 | H11 | 177.5° | 180.0° |
| C18 | C5 | C4 | H13 | 178.6° | 180.0° |
| C18 | C5 | C6 | H14 | 109.1° | 150.0° |
| C18 | C5 | C6 | H15 | 132.6° | 30.0° |
| O2 | C29 | N4 | O3 | 178.6° | 179.7° |
| O2 | C29 | N4 | H1 | 179.1° | 179.7° |
| O1 | C20 | C3 | H9 | 120.3° | 121.5° |
| O1 | C20 | C3 | H10 | 120.3° | 121.2° |
| O1 | C20 | C3 | C4 | 109.4° | 168.2° |
| O1 | C20 | H9 | H10 | 119.2° | 117.4° |
| C8 | C7 | N1 | C6 | 179.9° | 179.9° |
| C8 | C7 | N1 | C14 | 0.7° | 0.4° |
| C7 | C8 | N2 | C14 | 0.9° | 0.2° |
| C8 | C7 | C12 | H23 | 179.8° | 180.0° |
| N1 | C7 | C8 | N2 | 0.1° | 0.4° |
| C7 | N1 | C6 | C5 | 88.7° | 90.3° |
| C7 | N1 | C6 | C14 | 179.0° | 179.7° |
| C7 | N1 | C14 | N2 | 1.3° | 0.2° |
| C7 | N1 | C14 | C15 | 177.9° | 179.8° |
| C7 | N1 | C6 | H14 | 32.2° | 149.7° |
| C7 | N1 | C6 | H15 | 150.5° | 29.6° |
| N1 | C7 | C12 | H23 | 1.5° | 0.5° |
| C8 | N2 | C14 | N1 | 1.3° | 0.0° |
| C8 | N2 | C14 | C15 | 178.0° | 180.0° |
| C20 | C3 | C4 | C5 | 179.7° | 179.6° |
| C3 | C20 | H9 | H10 | 119.2° | 117.3° |
| C20 | C3 | C4 | H13 | 0.3° | 0.2° |
| C3 | C4 | C5 | H13 | 180.0° | 179.4° |
| C3 | C4 | C5 | C6 | 178.7° | 179.7° |
| C4 | C3 | C20 | H9 | 10.9° | 70.4° |
| C4 | C3 | C20 | H10 | 130.3° | 46.9° |
| C4 | C5 | C6 | N1 | 168.4° | 89.7° |
| C4 | C5 | C18 | H12 | 179.3° | 179.6° |
| C4 | C5 | C6 | H14 | 70.8° | 30.4° |
| C4 | C5 | C6 | H15 | 47.5° | 150.4° |
| C5 | C6 | N1 | H14 | 120.8° | 120.1° |
| C5 | C6 | N1 | H15 | 120.9° | 119.9° |
| C5 | C6 | N1 | C14 | 92.3° | 90.0° |
| C6 | C5 | C18 | H12 | 0.8° | 0.1° |
| C6 | C5 | C4 | H13 | 1.3° | 0.3° |
| C5 | C6 | H14 | H15 | 117.4° | 120.0° |
| O3 | C29 | N4 | H1 | 2.3° | 0.0° |
| C6 | N1 | C14 | N2 | 179.6° | 180.0° |
| C6 | N1 | C14 | C15 | 1.3° | 0.0° |
| N1 | C6 | H14 | H15 | 117.4° | 120.0° |
| N1 | C14 | N2 | C15 | 179.2° | 180.0° |
| N1 | C14 | C15 | C16 | 54.1° | 90.0° |
| C14 | N1 | C6 | H14 | 146.9° | 30.0° |
| C14 | N1 | C6 | H15 | 28.6° | 150.0° |
| N1 | C14 | C15 | H16 | 175.5° | 150.0° |
| N1 | C14 | C15 | H17 | 67.2° | 30.0° |
| N2 | C14 | C15 | C16 | 126.8° | 90.0° |
| N2 | C14 | C15 | H16 | 5.4° | 30.0° |
| N2 | C14 | C15 | H17 | 111.9° | 150.0° |
| C14 | C15 | C16 | C17 | 64.8° | 180.0° |
| C14 | C15 | C16 | H16 | 121.3° | 120.0° |
| C14 | C15 | C16 | H17 | 121.3° | 120.0° |
| C14 | C15 | H16 | H17 | 115.7° | 120.1° |
| C14 | C15 | C16 | H18 | 55.5° | 60.0° |
| C14 | C15 | C16 | H19 | 174.9° | 60.0° |
| C17 | C16 | C15 | H18 | 120.3° | 120.0° |
| C17 | C16 | C15 | H19 | 120.3° | 120.0° |
| C17 | C16 | C15 | H16 | 56.5° | 60.0° |
| C17 | C16 | C15 | H17 | 173.9° | 60.0° |
| C17 | C16 | H18 | H19 | 119.2° | 119.9° |
| C16 | C17 | H20 | H21 | 120.0° | 120.0° |
| C16 | C17 | H20 | H22 | 120.0° | 120.0° |
| C16 | C17 | H21 | H22 | 120.0° | 120.0° |
| C16 | C15 | H16 | H17 | 115.7° | 119.9° |
| C15 | C16 | H18 | H19 | 119.2° | 120.1° |
| C15 | C16 | C17 | H20 | 180.0° | 180.0° |
| C15 | C16 | C17 | H21 | 60.0° | 60.0° |
| C15 | C16 | C17 | H22 | 60.0° | 60.0° |
| H2 | C30 | H3 | H4 | 120.0° | 120.1° |
| H5 | C23 | C24 | H6 | 3.0° | 0.1° |
| H6 | C24 | C25 | H7 | 1.2° | 0.3° |
| H7 | C25 | C26 | H8 | 0.0° | 0.0° |
| H11 | C19 | C18 | H12 | 2.5° | 0.0° |
| H16 | C15 | C16 | H18 | 176.8° | 179.9° |
| H16 | C15 | C16 | H19 | 63.7° | 60.0° |
| H17 | C15 | C16 | H18 | 65.8° | 60.0° |
| H17 | C15 | C16 | H19 | 53.6° | 179.9° |
| H18 | C16 | C17 | H20 | 59.7° | 60.0° |
| H18 | C16 | C17 | H21 | 60.3° | 180.0° |
| H18 | C16 | C17 | H22 | 179.7° | 60.0° |
| H19 | C16 | C17 | H20 | 59.8° | 60.0° |
| H19 | C16 | C17 | H21 | 179.8° | 60.0° |
| H19 | C16 | C17 | H22 | 60.3° | 180.0° |
| H20 | C17 | H21 | H22 | 120.0° | 120.0° |
| H23 | C12 | C11 | H24 | 0.2° | 0.3° |
| H24 | C11 | C10 | H25 | 0.6° | 0.3° |
| H26 | C13 | H27 | H28 | 120.0° | 120.0° |
