KS7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | O1 | sing | 1.43Å | 1.43Å | |
| O1 | C3 | sing | 1.36Å | 1.38Å | |
| C17 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | N3 | sing | 1.32Å | 1.34Å | Aromatic |
| C3 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C18 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| N3 | C15 | doub | 1.32Å | 1.35Å | Aromatic |
| C2 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | N2 | sing | 1.39Å | 1.41Å | |
| C13 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C19 | N2 | sing | 1.47Å | 1.47Å | |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.51Å | 1.50Å | |
| C20 | C10 | sing | 1.53Å | 1.54Å | |
| N2 | C12 | sing | 1.47Å | 1.47Å | |
| C | O | sing | 1.43Å | 1.43Å | |
| C1 | O | sing | 1.36Å | 1.37Å | |
| C1 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.49Å | |
| C9 | C10 | sing | 1.53Å | 1.57Å | |
| C9 | N1 | sing | 1.47Å | 1.46Å | |
| N5 | C7 | sing | 1.35Å | 1.37Å | Aromatic |
| N5 | C8 | doub | 1.32Å | 1.30Å | Aromatic |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.54Å | |
| C10 | N4 | sing | 1.47Å | 1.52Å | |
| C7 | N | doub | 1.31Å | 1.31Å | Aromatic |
| C8 | N1 | sing | 1.37Å | 1.33Å | |
| C8 | O2 | sing | 1.34Å | 1.34Å | Aromatic |
| N1 | C23 | sing | 1.47Å | 1.47Å | |
| N4 | C21 | sing | 1.47Å | 1.47Å | |
| N4 | C22 | sing | 1.47Å | 1.48Å | |
| N | O2 | sing | 1.21Å | 1.43Å | Aromatic |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C11 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.08Å | 1.08Å | |
| C17 | H21 | sing | 1.08Å | 1.08Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C2 | H29 | sing | 1.08Å | 1.08Å | |
| C24 | H30 | sing | 1.08Å | 1.08Å | |
| C | H31 | sing | 1.09Å | 1.10Å | |
| C | H32 | sing | 1.09Å | 1.10Å | |
| C | H33 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | O1 | C3 | 119.1° | 117.0° |
| O1 | C4 | H1 | 109.5° | 109.5° |
| O1 | C4 | H2 | 109.5° | 109.5° |
| O1 | C4 | H3 | 109.5° | 109.5° |
| O1 | C3 | C2 | 127.7° | 119.9° |
| O1 | C3 | C5 | 111.4° | 120.0° |
| C18 | C17 | N3 | 123.8° | 120.8° |
| C17 | C18 | C13 | 119.1° | 119.1° |
| C17 | C18 | H20 | 120.5° | 120.5° |
| C18 | C17 | H21 | 118.1° | 119.6° |
| C17 | N3 | C15 | 117.9° | 121.9° |
| N3 | C17 | H21 | 118.1° | 119.6° |
| C2 | C3 | C5 | 120.9° | 120.1° |
| C3 | C2 | C1 | 118.7° | 120.1° |
| C3 | C2 | H29 | 120.6° | 119.9° |
| C3 | C5 | C6 | 119.8° | 119.9° |
| C3 | C5 | H4 | 120.1° | 120.0° |
| C18 | C13 | N2 | 121.5° | 120.9° |
| C18 | C13 | C14 | 117.2° | 118.2° |
| C13 | C18 | H20 | 120.5° | 120.4° |
| N3 | C15 | C14 | 121.7° | 120.9° |
| N3 | C15 | C16 | 117.0° | 119.5° |
| C2 | C1 | O | 127.6° | 120.0° |
| C2 | C1 | C24 | 121.2° | 120.1° |
| C1 | C2 | H29 | 120.7° | 120.0° |
| C5 | C6 | C24 | 119.7° | 119.9° |
| C5 | C6 | C7 | 120.0° | 120.1° |
| C6 | C5 | H4 | 120.1° | 120.0° |
| N2 | C13 | C14 | 121.3° | 120.9° |
| C13 | N2 | C19 | 114.3° | 111.0° |
| C13 | N2 | C12 | 115.8° | 111.0° |
| C13 | C14 | C15 | 120.3° | 119.1° |
| C13 | C14 | H11 | 119.8° | 120.5° |
| C20 | C19 | N2 | 111.7° | 109.5° |
| C19 | C20 | C10 | 112.6° | 109.3° |
| C19 | C20 | H16 | 108.7° | 109.5° |
| C19 | C20 | H17 | 108.7° | 109.5° |
| C20 | C19 | H18 | 108.9° | 109.5° |
| C20 | C19 | H19 | 108.9° | 109.5° |
| C19 | N2 | C12 | 111.2° | 111.2° |
| N2 | C19 | H18 | 108.9° | 109.5° |
| N2 | C19 | H19 | 108.9° | 109.5° |
| C14 | C15 | C16 | 121.3° | 119.6° |
| C15 | C14 | H11 | 119.8° | 120.5° |
| C15 | C16 | H22 | 109.5° | 109.5° |
| C15 | C16 | H23 | 109.4° | 109.5° |
| C15 | C16 | H24 | 109.5° | 109.4° |
| C20 | C10 | C9 | 105.0° | 109.5° |
| C20 | C10 | C11 | 109.0° | 109.2° |
| C20 | C10 | N4 | 111.5° | 109.5° |
| C10 | C20 | H16 | 108.7° | 109.5° |
| C10 | C20 | H17 | 108.7° | 109.5° |
| N2 | C12 | C11 | 113.0° | 109.5° |
| N2 | C12 | H9 | 108.6° | 109.4° |
| N2 | C12 | H10 | 108.6° | 109.5° |
| C | O | C1 | 118.6° | 117.0° |
| O | C | H31 | 109.5° | 109.5° |
| O | C | H32 | 109.5° | 109.5° |
| O | C | H33 | 109.4° | 109.4° |
| O | C1 | C24 | 111.1° | 120.0° |
| C1 | C24 | C6 | 119.6° | 119.9° |
| C1 | C24 | H30 | 120.2° | 120.0° |
| C24 | C6 | C7 | 120.2° | 120.1° |
| C6 | C24 | H30 | 120.2° | 120.0° |
| C6 | C7 | N5 | 122.2° | 126.4° |
| C6 | C7 | N | 123.0° | 126.3° |
| C10 | C9 | N1 | 110.9° | 109.4° |
| C9 | C10 | C11 | 110.6° | 109.6° |
| C9 | C10 | N4 | 103.9° | 109.5° |
| C10 | C9 | H5 | 109.1° | 109.5° |
| C10 | C9 | H6 | 109.1° | 109.5° |
| C9 | N1 | C8 | 117.6° | 111.0° |
| C9 | N1 | C23 | 112.9° | 110.8° |
| N1 | C9 | H5 | 109.1° | 109.5° |
| N1 | C9 | H6 | 109.1° | 109.4° |
| C7 | N5 | C8 | 102.9° | 105.5° |
| N5 | C7 | N | 114.7° | 107.3° |
| N5 | C8 | N1 | 125.8° | 126.6° |
| N5 | C8 | O2 | 113.3° | 106.8° |
| C12 | C11 | C10 | 117.5° | 109.3° |
| C12 | C11 | H7 | 107.4° | 109.5° |
| C12 | C11 | H8 | 107.4° | 109.6° |
| C11 | C12 | H9 | 108.6° | 109.5° |
| C11 | C12 | H10 | 108.6° | 109.5° |
| C11 | C10 | N4 | 116.2° | 109.5° |
| C10 | C11 | H7 | 107.5° | 109.5° |
| C10 | C11 | H8 | 107.4° | 109.5° |
| C10 | N4 | C21 | 119.2° | 111.0° |
| C10 | N4 | C22 | 115.6° | 110.9° |
| C7 | N | O2 | 103.3° | 110.3° |
| N1 | C8 | O2 | 120.9° | 126.5° |
| C8 | N1 | C23 | 122.7° | 111.0° |
| C8 | O2 | N | 105.8° | 110.0° |
| N1 | C23 | C22 | 110.4° | 109.4° |
| N1 | C23 | H27 | 109.2° | 109.5° |
| N1 | C23 | H28 | 109.2° | 109.5° |
| C21 | N4 | C22 | 112.2° | 111.0° |
| N4 | C21 | H13 | 109.5° | 109.5° |
| N4 | C21 | H14 | 109.4° | 109.5° |
| N4 | C21 | H15 | 109.5° | 109.5° |
| N4 | C22 | C23 | 111.6° | 109.4° |
| N4 | C22 | H25 | 108.9° | 109.5° |
| N4 | C22 | H26 | 108.9° | 109.5° |
| C23 | C22 | H25 | 108.9° | 109.5° |
| C23 | C22 | H26 | 108.9° | 109.5° |
| C22 | C23 | H27 | 109.2° | 109.5° |
| C22 | C23 | H28 | 109.3° | 109.5° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H1 | C4 | H3 | 109.5° | 109.5° |
| H2 | C4 | H3 | 109.4° | 109.5° |
| H5 | C9 | H6 | 109.5° | 109.5° |
| H7 | C11 | H8 | 109.5° | 109.5° |
| H9 | C12 | H10 | 109.5° | 109.4° |
| H13 | C21 | H14 | 109.5° | 109.4° |
| H13 | C21 | H15 | 109.5° | 109.5° |
| H14 | C21 | H15 | 109.5° | 109.4° |
| H16 | C20 | H17 | 109.5° | 109.5° |
| H18 | C19 | H19 | 109.5° | 109.5° |
| H22 | C16 | H23 | 109.5° | 109.5° |
| H22 | C16 | H24 | 109.5° | 109.5° |
| H23 | C16 | H24 | 109.5° | 109.5° |
| H25 | C22 | H26 | 109.5° | 109.5° |
| H27 | C23 | H28 | 109.5° | 109.5° |
| H31 | C | H32 | 109.5° | 109.5° |
| H31 | C | H33 | 109.5° | 109.5° |
| H32 | C | H33 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | O1 | C3 | C2 | 0.5° | 0.0° |
| C4 | O1 | C3 | C5 | 177.2° | 180.0° |
| O1 | C4 | H1 | H2 | 120.0° | 120.0° |
| O1 | C4 | H1 | H3 | 120.0° | 120.0° |
| O1 | C4 | H2 | H3 | 120.0° | 120.0° |
| O1 | C3 | C2 | C5 | 177.5° | 180.0° |
| O1 | C3 | C2 | C1 | 175.6° | 180.0° |
| O1 | C3 | C5 | C6 | 177.5° | 180.0° |
| C3 | O1 | C4 | H1 | 180.0° | 60.0° |
| C3 | O1 | C4 | H2 | 60.0° | 60.0° |
| C3 | O1 | C4 | H3 | 60.0° | 180.0° |
| O1 | C3 | C5 | H4 | 2.5° | 0.3° |
| O1 | C3 | C2 | H29 | 4.4° | 0.0° |
| C18 | C17 | N3 | H21 | 180.0° | 180.0° |
| C17 | C18 | C13 | H20 | 180.0° | 179.9° |
| C18 | C17 | N3 | C15 | 0.0° | 0.0° |
| C17 | C18 | C13 | N2 | 179.8° | 179.9° |
| C17 | C18 | C13 | C14 | 0.2° | 0.1° |
| N3 | C17 | C18 | C13 | 0.0° | 0.0° |
| C17 | N3 | C15 | C14 | 0.1° | 0.0° |
| C17 | N3 | C15 | C16 | 179.8° | 180.0° |
| N3 | C17 | C18 | H20 | 180.0° | 180.0° |
| C3 | C2 | C1 | H29 | 180.0° | 180.0° |
| C2 | C3 | C5 | C6 | 0.4° | 0.0° |
| C3 | C2 | C1 | O | 175.9° | 180.0° |
| C3 | C2 | C1 | C24 | 1.8° | 0.2° |
| C2 | C3 | C5 | H4 | 179.6° | 179.7° |
| C5 | C3 | C2 | C1 | 1.9° | 0.0° |
| C3 | C5 | C6 | H4 | 180.0° | 179.7° |
| C3 | C5 | C6 | C24 | 1.2° | 0.3° |
| C3 | C5 | C6 | C7 | 175.8° | 179.8° |
| C5 | C3 | C2 | H29 | 178.1° | 180.0° |
| C18 | C13 | N2 | C14 | 180.0° | 180.0° |
| C18 | C13 | N2 | C19 | 41.5° | 124.3° |
| C18 | C13 | C14 | C15 | 0.3° | 0.0° |
| C18 | C13 | N2 | C12 | 172.7° | 0.0° |
| C18 | C13 | C14 | H11 | 179.7° | 180.0° |
| C13 | C18 | C17 | H21 | 180.0° | 180.0° |
| N3 | C15 | C14 | C13 | 0.3° | 0.0° |
| N3 | C15 | C14 | C16 | 179.9° | 180.0° |
| N3 | C15 | C14 | H11 | 179.7° | 180.0° |
| C15 | N3 | C17 | H21 | 179.9° | 180.0° |
| N3 | C15 | C16 | H22 | 0.0° | 90.0° |
| N3 | C15 | C16 | H23 | 120.0° | 150.0° |
| N3 | C15 | C16 | H24 | 120.0° | 30.0° |
| C2 | C1 | O | C | 0.5° | 0.0° |
| C2 | C1 | O | C24 | 177.8° | 179.8° |
| C2 | C1 | C24 | C6 | 0.2° | 0.5° |
| C2 | C1 | C24 | H30 | 179.8° | 180.0° |
| C5 | C6 | C24 | C1 | 1.3° | 0.5° |
| C5 | C6 | C24 | C7 | 176.9° | 180.0° |
| C5 | C6 | C7 | N5 | 1.8° | 179.7° |
| C5 | C6 | C7 | N | 175.7° | 0.1° |
| C5 | C6 | C24 | H30 | 178.7° | 180.0° |
| C13 | N2 | C19 | C20 | 166.3° | 174.1° |
| C13 | N2 | C19 | C12 | 133.3° | 124.1° |
| N2 | C13 | C14 | C15 | 179.7° | 180.0° |
| C13 | N2 | C12 | C11 | 175.4° | 174.1° |
| C13 | N2 | C12 | H9 | 54.9° | 54.1° |
| C13 | N2 | C12 | H10 | 64.1° | 65.8° |
| N2 | C13 | C14 | H11 | 0.3° | 0.0° |
| C13 | N2 | C19 | H18 | 46.0° | 65.9° |
| C13 | N2 | C19 | H19 | 73.4° | 54.1° |
| N2 | C13 | C18 | H20 | 0.2° | 0.0° |
| C14 | C13 | N2 | C19 | 138.5° | 55.7° |
| C13 | C14 | C15 | H11 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 179.6° | 180.0° |
| C14 | C13 | N2 | C12 | 7.3° | 180.0° |
| C14 | C13 | C18 | H20 | 179.8° | 180.0° |
| C20 | C19 | N2 | H18 | 120.3° | 120.0° |
| C20 | C19 | N2 | H19 | 120.3° | 120.0° |
| C19 | C20 | C10 | H16 | 120.5° | 120.0° |
| C19 | C20 | C10 | H17 | 120.5° | 120.0° |
| C20 | C19 | N2 | C12 | 60.4° | 61.7° |
| C19 | C20 | C10 | C9 | 166.4° | 177.6° |
| C19 | C20 | C10 | C11 | 47.8° | 57.6° |
| C19 | C20 | C10 | N4 | 81.7° | 62.3° |
| C19 | C20 | H16 | H17 | 118.6° | 120.1° |
| C20 | C19 | H18 | H19 | 119.0° | 120.0° |
| N2 | C19 | C20 | C10 | 59.5° | 59.1° |
| C19 | N2 | C12 | C11 | 52.0° | 61.8° |
| C19 | N2 | C12 | H9 | 172.5° | 178.2° |
| C19 | N2 | C12 | H10 | 68.5° | 58.3° |
| N2 | C19 | C20 | H16 | 180.0° | 60.9° |
| N2 | C19 | C20 | H17 | 60.9° | 179.1° |
| N2 | C19 | H18 | H19 | 119.0° | 120.0° |
| C14 | C15 | C16 | H22 | 179.9° | 90.0° |
| C14 | C15 | C16 | H23 | 59.9° | 30.0° |
| C14 | C15 | C16 | H24 | 60.1° | 150.0° |
| C16 | C15 | C14 | H11 | 0.4° | 0.0° |
| C15 | C16 | H22 | H23 | 120.0° | 120.0° |
| C15 | C16 | H22 | H24 | 120.0° | 120.0° |
| C15 | C16 | H23 | H24 | 120.0° | 120.0° |
| C20 | C10 | C9 | C11 | 117.4° | 119.8° |
| C20 | C10 | C9 | N4 | 117.2° | 120.1° |
| C20 | C10 | C9 | N1 | 175.1° | 61.7° |
| C20 | C10 | C11 | C12 | 41.6° | 57.6° |
| C20 | C10 | C11 | N4 | 126.9° | 119.9° |
| C20 | C10 | N4 | C21 | 86.7° | 175.3° |
| C20 | C10 | N4 | C22 | 134.9° | 60.8° |
| C20 | C10 | C9 | H5 | 64.7° | 178.3° |
| C20 | C10 | C9 | H6 | 54.9° | 58.2° |
| C20 | C10 | C11 | H7 | 79.6° | 177.5° |
| C20 | C10 | C11 | H8 | 162.7° | 62.4° |
| C10 | C20 | H16 | H17 | 118.6° | 120.0° |
| C10 | C20 | C19 | H18 | 179.9° | 60.9° |
| C10 | C20 | C19 | H19 | 60.8° | 179.1° |
| N2 | C12 | C11 | H9 | 120.5° | 120.0° |
| N2 | C12 | C11 | H10 | 120.5° | 120.1° |
| N2 | C12 | C11 | C10 | 44.6° | 59.1° |
| N2 | C12 | C11 | H7 | 76.6° | 179.0° |
| N2 | C12 | C11 | H8 | 165.7° | 60.9° |
| N2 | C12 | H9 | H10 | 118.4° | 119.9° |
| C12 | N2 | C19 | H18 | 179.3° | 58.3° |
| C12 | N2 | C19 | H19 | 60.0° | 178.3° |
| C | O | C1 | C24 | 177.4° | 179.7° |
| O | C | H31 | H32 | 120.0° | 120.0° |
| O | C | H31 | H33 | 120.0° | 120.0° |
| O | C | H32 | H33 | 120.0° | 119.9° |
| O | C1 | C24 | C6 | 177.8° | 179.7° |
| O | C1 | C2 | H29 | 4.1° | 0.0° |
| O | C1 | C24 | H30 | 2.2° | 0.2° |
| C1 | O | C | H31 | 180.0° | 60.0° |
| C1 | O | C | H32 | 60.0° | 60.0° |
| C1 | O | C | H33 | 60.0° | 180.0° |
| C1 | C24 | C6 | H30 | 180.0° | 179.5° |
| C1 | C24 | C6 | C7 | 175.6° | 179.5° |
| C24 | C1 | C2 | H29 | 178.2° | 179.7° |
| C24 | C6 | C7 | N5 | 178.7° | 0.3° |
| C24 | C6 | C7 | N | 1.2° | 180.0° |
| C24 | C6 | C5 | H4 | 178.8° | 180.0° |
| C6 | C7 | N5 | N | 177.7° | 179.7° |
| C6 | C7 | N5 | C8 | 177.0° | 180.0° |
| C6 | C7 | N | O2 | 177.0° | 180.0° |
| C7 | C6 | C5 | H4 | 4.3° | 0.0° |
| C7 | C6 | C24 | H30 | 4.4° | 0.0° |
| C10 | C9 | N1 | H5 | 120.2° | 120.0° |
| C10 | C9 | N1 | H6 | 120.2° | 120.0° |
| C9 | C10 | C11 | C12 | 156.6° | 177.6° |
| C9 | C10 | C11 | N4 | 118.1° | 120.1° |
| C10 | C9 | N1 | C8 | 103.8° | 176.9° |
| C10 | C9 | N1 | C23 | 48.1° | 59.3° |
| C9 | C10 | N4 | C21 | 160.7° | 64.6° |
| C9 | C10 | N4 | C22 | 22.3° | 59.3° |
| C10 | C9 | H5 | H6 | 119.3° | 120.1° |
| C9 | C10 | C11 | H7 | 35.5° | 62.5° |
| C9 | C10 | C11 | H8 | 82.3° | 57.6° |
| C9 | C10 | C20 | H16 | 73.1° | 57.6° |
| C9 | C10 | C20 | H17 | 45.9° | 62.4° |
| C9 | N1 | C8 | N5 | 7.8° | 179.8° |
| N1 | C9 | C10 | C11 | 57.6° | 178.5° |
| N1 | C9 | C10 | N4 | 67.7° | 58.4° |
| C9 | N1 | C8 | C23 | 149.0° | 123.8° |
| C9 | N1 | C8 | O2 | 172.1° | 0.2° |
| C9 | N1 | C23 | C22 | 14.7° | 59.3° |
| N1 | C9 | H5 | H6 | 119.3° | 120.0° |
| C9 | N1 | C23 | H27 | 134.8° | 179.3° |
| C9 | N1 | C23 | H28 | 105.5° | 60.6° |
| C7 | N5 | C8 | N1 | 179.7° | 179.8° |
| C7 | N5 | C8 | O2 | 0.3° | 0.2° |
| N5 | C7 | N | O2 | 0.6° | 0.2° |
| C8 | N5 | C7 | N | 0.6° | 0.2° |
| N5 | C8 | N1 | O2 | 180.0° | 180.0° |
| N5 | C8 | N1 | C23 | 156.8° | 56.1° |
| N5 | C8 | O2 | N | 0.0° | 0.1° |
| C12 | C11 | C10 | H7 | 121.1° | 119.9° |
| C12 | C11 | C10 | H8 | 121.1° | 120.0° |
| C12 | C11 | C10 | N4 | 85.3° | 62.3° |
| C12 | C11 | H7 | H8 | 116.3° | 120.2° |
| C11 | C12 | H9 | H10 | 118.4° | 120.0° |
| C11 | C10 | N4 | C21 | 39.0° | 55.5° |
| C11 | C10 | N4 | C22 | 99.5° | 179.4° |
| C11 | C10 | C9 | H5 | 177.8° | 58.5° |
| C11 | C10 | C9 | H6 | 62.6° | 61.6° |
| C10 | C11 | H7 | H8 | 116.4° | 120.1° |
| C10 | C11 | C12 | H9 | 165.1° | 179.1° |
| C10 | C11 | C12 | H10 | 75.9° | 60.9° |
| C11 | C10 | C20 | H16 | 168.3° | 62.4° |
| C11 | C10 | C20 | H17 | 72.7° | 177.6° |
| C10 | N4 | C21 | C22 | 139.8° | 123.8° |
| C10 | N4 | C22 | C23 | 36.9° | 59.3° |
| N4 | C10 | C9 | H5 | 52.5° | 61.7° |
| N4 | C10 | C9 | H6 | 172.1° | 178.3° |
| N4 | C10 | C11 | H7 | 153.6° | 57.6° |
| N4 | C10 | C11 | H8 | 35.8° | 177.7° |
| C10 | N4 | C21 | H13 | 180.0° | 60.0° |
| C10 | N4 | C21 | H14 | 60.0° | 180.0° |
| C10 | N4 | C21 | H15 | 60.0° | 60.0° |
| N4 | C10 | C20 | H16 | 38.8° | 177.7° |
| N4 | C10 | C20 | H17 | 157.8° | 57.6° |
| C10 | N4 | C22 | H25 | 157.2° | 179.3° |
| C10 | N4 | C22 | H26 | 83.5° | 60.7° |
| C7 | N | O2 | C8 | 0.4° | 0.1° |
| N1 | C8 | O2 | N | 179.9° | 180.0° |
| C8 | N1 | C23 | C22 | 164.9° | 176.8° |
| C8 | N1 | C9 | H5 | 136.0° | 63.1° |
| C8 | N1 | C9 | H6 | 16.4° | 56.9° |
| C8 | N1 | C23 | H27 | 74.9° | 56.9° |
| C8 | N1 | C23 | H28 | 44.8° | 63.2° |
| O2 | C8 | N1 | C23 | 23.2° | 123.9° |
| N1 | C23 | C22 | N4 | 59.1° | 58.4° |
| N1 | C23 | C22 | H27 | 120.1° | 119.9° |
| N1 | C23 | C22 | H28 | 120.1° | 120.0° |
| C23 | N1 | C9 | H5 | 72.1° | 60.8° |
| C23 | N1 | C9 | H6 | 168.3° | 179.2° |
| N1 | C23 | C22 | H25 | 179.4° | 178.4° |
| N1 | C23 | C22 | H26 | 61.3° | 61.6° |
| N1 | C23 | H27 | H28 | 119.5° | 120.1° |
| C21 | N4 | C22 | C23 | 104.4° | 64.6° |
| N4 | C21 | H13 | H14 | 120.0° | 120.1° |
| N4 | C21 | H13 | H15 | 120.0° | 120.0° |
| N4 | C21 | H14 | H15 | 120.0° | 120.0° |
| C21 | N4 | C22 | H25 | 15.9° | 55.4° |
| C21 | N4 | C22 | H26 | 135.2° | 175.4° |
| N4 | C22 | C23 | H25 | 120.3° | 120.0° |
| N4 | C22 | C23 | H26 | 120.3° | 120.0° |
| C22 | N4 | C21 | H13 | 40.2° | 176.2° |
| C22 | N4 | C21 | H14 | 79.8° | 56.2° |
| C22 | N4 | C21 | H15 | 160.2° | 63.8° |
| N4 | C22 | H25 | H26 | 119.0° | 120.1° |
| N4 | C22 | C23 | H27 | 179.2° | 178.4° |
| N4 | C22 | C23 | H28 | 61.1° | 61.5° |
| C23 | C22 | H25 | H26 | 119.0° | 120.0° |
| C22 | C23 | H27 | H28 | 119.6° | 120.1° |
| H1 | C4 | H2 | H3 | 120.0° | 120.0° |
| H7 | C11 | C12 | H9 | 43.9° | 61.0° |
| H7 | C11 | C12 | H10 | 162.9° | 59.0° |
| H8 | C11 | C12 | H9 | 73.7° | 59.1° |
| H8 | C11 | C12 | H10 | 45.2° | 179.1° |
| H13 | C21 | H14 | H15 | 120.0° | 119.9° |
| H16 | C20 | C19 | H18 | 59.7° | 179.1° |
| H16 | C20 | C19 | H19 | 59.7° | 59.1° |
| H17 | C20 | C19 | H18 | 59.4° | 59.1° |
| H17 | C20 | C19 | H19 | 178.7° | 60.9° |
| H20 | C18 | C17 | H21 | 0.0° | 0.0° |
| H22 | C16 | H23 | H24 | 120.0° | 120.0° |
| H25 | C22 | C23 | H27 | 60.5° | 61.6° |
| H25 | C22 | C23 | H28 | 59.2° | 58.5° |
| H26 | C22 | C23 | H27 | 58.8° | 58.4° |
| H26 | C22 | C23 | H28 | 178.6° | 178.5° |
| H31 | C | H32 | H33 | 120.0° | 120.0° |
