Q9H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | C | sing | 1.47Å | 1.46Å | |
| C | C1 | sing | 1.53Å | 1.56Å | |
| C1 | N1 | sing | 1.46Å | 1.45Å | |
| N1 | C2 | sing | 1.38Å | 1.34Å | |
| N2 | C2 | doub | 1.33Å | 1.34Å | Aromatic |
| N2 | C3 | sing | 1.32Å | 1.34Å | Aromatic |
| C2 | C6 | sing | 1.41Å | 1.42Å | Aromatic |
| C3 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
| C6 | C4 | doub | 1.41Å | 1.39Å | Aromatic |
| C6 | N5 | sing | 1.35Å | 1.38Å | Aromatic |
| N3 | C4 | sing | 1.33Å | 1.33Å | Aromatic |
| C4 | N4 | sing | 1.37Å | 1.38Å | Aromatic |
| N5 | C5 | doub | 1.30Å | 1.32Å | Aromatic |
| C24 | O7 | sing | 1.43Å | 1.42Å | |
| C24 | C23 | sing | 1.55Å | 1.53Å | |
| C24 | C7 | sing | 1.54Å | 1.54Å | |
| C5 | N4 | sing | 1.36Å | 1.36Å | Aromatic |
| N4 | C7 | sing | 1.47Å | 1.46Å | |
| O6 | C23 | sing | 1.43Å | 1.42Å | |
| C23 | C8 | sing | 1.54Å | 1.52Å | |
| C7 | O | sing | 1.44Å | 1.41Å | |
| O | C8 | sing | 1.44Å | 1.44Å | |
| C8 | C9 | sing | 1.53Å | 1.51Å | |
| C9 | O1 | sing | 1.43Å | 1.42Å | |
| N7 | C15 | sing | 1.38Å | 1.34Å | |
| O1 | C10 | sing | 1.43Å | 1.42Å | |
| C15 | N8 | doub | 1.33Å | 1.35Å | Aromatic |
| C15 | C14 | sing | 1.41Å | 1.41Å | Aromatic |
| N8 | C16 | sing | 1.32Å | 1.34Å | Aromatic |
| N6 | C14 | sing | 1.35Å | 1.39Å | Aromatic |
| N6 | C13 | doub | 1.31Å | 1.32Å | Aromatic |
| C14 | C17 | doub | 1.41Å | 1.38Å | Aromatic |
| O3 | C20 | sing | 1.43Å | 1.42Å | |
| C10 | C11 | sing | 1.47Å | 1.46Å | |
| C16 | N9 | doub | 1.32Å | 1.34Å | Aromatic |
| C13 | C12 | sing | 1.43Å | 1.42Å | |
| C13 | N10 | sing | 1.37Å | 1.38Å | Aromatic |
| C11 | C12 | trip | 1.17Å | 1.19Å | |
| C17 | N9 | sing | 1.33Å | 1.34Å | Aromatic |
| C17 | N10 | sing | 1.37Å | 1.38Å | Aromatic |
| O2 | C18 | sing | 1.44Å | 1.41Å | |
| O2 | C19 | sing | 1.44Å | 1.45Å | |
| N10 | C18 | sing | 1.46Å | 1.45Å | |
| C20 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | C22 | sing | 1.55Å | 1.52Å | |
| C19 | C21 | sing | 1.54Å | 1.53Å | |
| C22 | C21 | sing | 1.55Å | 1.53Å | |
| C22 | O5 | sing | 1.43Å | 1.42Å | |
| C21 | O4 | sing | 1.43Å | 1.42Å | |
| O3 | H1 | sing | 0.97Å | 0.95Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| O4 | H3 | sing | 0.97Å | 0.95Å | |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| O5 | H9 | sing | 0.97Å | 0.95Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| O6 | H12 | sing | 0.97Å | 0.95Å | |
| O7 | H13 | sing | 0.97Å | 0.95Å | |
| N | H14 | sing | 1.01Å | 1.00Å | |
| N | H15 | sing | 1.01Å | 1.00Å | |
| C | H17 | sing | 1.09Å | 1.10Å | |
| C | H18 | sing | 1.09Å | 1.10Å | |
| C1 | H19 | sing | 1.09Å | 1.10Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.08Å | 1.08Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| C3 | H30 | sing | 1.08Å | 1.08Å | |
| N7 | H31 | sing | 0.97Å | 1.00Å | |
| N7 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N | C | C1 | 114.4° | 109.5° |
| C | N | H14 | 109.5° | 111.0° |
| C | N | H15 | 109.5° | 111.0° |
| N | C | H17 | 108.2° | 109.5° |
| N | C | H18 | 108.2° | 109.5° |
| C | C1 | N1 | 108.5° | 109.5° |
| C1 | C | H17 | 108.2° | 109.4° |
| C1 | C | H18 | 108.2° | 109.5° |
| C | C1 | H19 | 109.7° | 109.5° |
| C | C1 | H20 | 109.7° | 109.4° |
| C1 | N1 | C2 | 122.8° | 120.0° |
| C1 | N1 | H4 | 106.0° | 120.0° |
| N1 | C1 | H19 | 109.7° | 109.5° |
| N1 | C1 | H20 | 109.7° | 109.5° |
| N1 | C2 | N2 | 118.9° | 120.8° |
| N1 | C2 | C6 | 122.4° | 120.8° |
| C2 | N1 | H4 | 106.0° | 120.0° |
| C2 | N2 | C3 | 118.3° | 121.2° |
| N2 | C2 | C6 | 118.7° | 118.4° |
| N2 | C3 | N3 | 128.8° | 122.5° |
| N2 | C3 | H30 | 115.6° | 118.7° |
| C2 | C6 | C4 | 115.4° | 118.1° |
| C2 | C6 | N5 | 132.8° | 134.7° |
| C3 | N3 | C4 | 111.1° | 120.6° |
| N3 | C3 | H30 | 115.6° | 118.8° |
| C4 | C6 | N5 | 111.8° | 107.2° |
| C6 | C4 | N3 | 127.6° | 119.1° |
| C6 | C4 | N4 | 104.6° | 106.0° |
| C6 | N5 | C5 | 103.4° | 109.5° |
| N3 | C4 | N4 | 127.8° | 134.9° |
| C4 | N4 | C5 | 106.2° | 107.4° |
| C4 | N4 | C7 | 127.3° | 126.3° |
| N5 | C5 | N4 | 114.0° | 110.0° |
| N5 | C5 | H2 | 123.0° | 125.1° |
| O7 | C24 | C23 | 111.7° | 110.5° |
| O7 | C24 | C7 | 110.6° | 110.5° |
| C24 | O7 | H13 | 109.5° | 114.0° |
| O7 | C24 | H29 | 111.6° | 110.5° |
| C23 | C24 | C7 | 102.7° | 104.0° |
| C24 | C23 | O6 | 111.9° | 110.5° |
| C24 | C23 | C8 | 102.4° | 104.1° |
| C24 | C23 | H28 | 109.8° | 110.6° |
| C23 | C24 | H29 | 110.0° | 110.5° |
| C24 | C7 | N4 | 115.2° | 110.4° |
| C24 | C7 | O | 107.8° | 104.8° |
| C24 | C7 | H5 | 107.6° | 110.3° |
| C7 | C24 | H29 | 109.9° | 110.6° |
| C5 | N4 | C7 | 126.5° | 126.3° |
| N4 | C5 | H2 | 123.0° | 125.0° |
| N4 | C7 | O | 108.2° | 110.4° |
| N4 | C7 | H5 | 108.6° | 110.3° |
| O6 | C23 | C8 | 111.2° | 110.5° |
| C23 | O6 | H12 | 109.5° | 114.0° |
| O6 | C23 | H28 | 111.3° | 110.4° |
| C23 | C8 | O | 104.5° | 104.8° |
| C23 | C8 | C9 | 116.3° | 110.4° |
| C23 | C8 | H6 | 108.5° | 110.5° |
| C8 | C23 | H28 | 109.9° | 110.5° |
| C7 | O | C8 | 109.6° | 105.3° |
| O | C7 | H5 | 109.3° | 110.4° |
| O | C8 | C9 | 109.1° | 110.4° |
| O | C8 | H6 | 109.6° | 110.3° |
| C8 | C9 | O1 | 109.9° | 109.5° |
| C9 | C8 | H6 | 108.7° | 110.3° |
| C8 | C9 | H7 | 109.4° | 109.4° |
| C8 | C9 | H8 | 109.4° | 109.4° |
| C9 | O1 | C10 | 112.2° | 114.0° |
| O1 | C9 | H7 | 109.3° | 109.5° |
| O1 | C9 | H8 | 109.3° | 109.5° |
| N7 | C15 | N8 | 118.5° | 120.7° |
| N7 | C15 | C14 | 123.8° | 120.8° |
| C15 | N7 | H31 | 109.5° | 120.0° |
| C15 | N7 | H32 | 109.5° | 120.0° |
| O1 | C10 | C11 | 112.2° | 109.4° |
| O1 | C10 | H10 | 108.8° | 109.5° |
| O1 | C10 | H11 | 108.8° | 109.5° |
| N8 | C15 | C14 | 117.7° | 118.5° |
| C15 | N8 | C16 | 118.8° | 121.2° |
| C15 | C14 | N6 | 131.9° | 134.4° |
| C15 | C14 | C17 | 116.8° | 118.2° |
| N8 | C16 | N9 | 128.8° | 122.5° |
| N8 | C16 | H21 | 115.6° | 118.8° |
| C14 | N6 | C13 | 103.7° | 109.4° |
| N6 | C14 | C17 | 111.3° | 107.4° |
| N6 | C13 | C12 | 124.3° | 125.2° |
| N6 | C13 | N10 | 113.7° | 109.6° |
| C14 | C17 | N9 | 126.9° | 119.0° |
| C14 | C17 | N10 | 105.7° | 106.3° |
| O3 | C20 | C19 | 111.4° | 109.5° |
| C20 | O3 | H1 | 109.5° | 114.0° |
| O3 | C20 | H24 | 109.0° | 109.5° |
| O3 | C20 | H25 | 109.0° | 109.5° |
| C10 | C11 | C12 | 175.9° | 180.0° |
| C11 | C10 | H10 | 108.8° | 109.4° |
| C11 | C10 | H11 | 108.8° | 109.4° |
| C16 | N9 | C17 | 111.0° | 120.7° |
| N9 | C16 | H21 | 115.6° | 118.7° |
| C12 | C13 | N10 | 122.0° | 125.2° |
| C13 | C12 | C11 | 172.2° | 180.0° |
| C13 | N10 | C17 | 105.6° | 107.3° |
| C13 | N10 | C18 | 128.1° | 126.4° |
| N9 | C17 | N10 | 127.5° | 134.7° |
| C17 | N10 | C18 | 126.3° | 126.3° |
| C18 | O2 | C19 | 109.3° | 106.9° |
| O2 | C18 | N10 | 109.4° | 110.7° |
| O2 | C18 | C22 | 105.8° | 103.5° |
| O2 | C18 | H22 | 109.3° | 110.6° |
| O2 | C19 | C20 | 109.3° | 110.0° |
| O2 | C19 | C21 | 106.2° | 107.4° |
| O2 | C19 | H23 | 109.4° | 109.9° |
| N10 | C18 | C22 | 115.6° | 110.6° |
| N10 | C18 | H22 | 108.8° | 110.6° |
| C20 | C19 | C21 | 115.0° | 109.8° |
| C20 | C19 | H23 | 108.5° | 109.8° |
| C19 | C20 | H24 | 109.0° | 109.4° |
| C19 | C20 | H25 | 109.0° | 109.5° |
| C18 | C22 | C21 | 100.4° | 102.1° |
| C18 | C22 | O5 | 110.7° | 110.9° |
| C22 | C18 | H22 | 107.8° | 110.7° |
| C18 | C22 | H27 | 110.6° | 110.9° |
| C19 | C21 | C22 | 102.7° | 104.1° |
| C19 | C21 | O4 | 110.7° | 110.5° |
| C21 | C19 | H23 | 108.3° | 109.9° |
| C19 | C21 | H26 | 110.0° | 110.5° |
| C21 | C22 | O5 | 112.0° | 110.9° |
| C22 | C21 | O4 | 111.5° | 110.5° |
| C22 | C21 | H26 | 110.0° | 110.6° |
| C21 | C22 | H27 | 110.5° | 110.9° |
| C22 | O5 | H9 | 109.5° | 114.1° |
| O5 | C22 | H27 | 112.1° | 110.8° |
| C21 | O4 | H3 | 109.5° | 114.0° |
| O4 | C21 | H26 | 111.6° | 110.5° |
| H7 | C9 | H8 | 109.5° | 109.4° |
| H10 | C10 | H11 | 109.5° | 109.5° |
| H14 | N | H15 | 109.5° | 111.0° |
| H17 | C | H18 | 109.5° | 109.4° |
| H19 | C1 | H20 | 109.5° | 109.4° |
| H24 | C20 | H25 | 109.5° | 109.5° |
| H31 | N7 | H32 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N | C | C1 | H17 | 120.7° | 120.0° |
| N | C | C1 | H18 | 120.7° | 120.1° |
| N | C | C1 | N1 | 152.1° | 180.0° |
| C | N | H14 | H15 | 120.0° | 124.0° |
| N | C | H17 | H18 | 117.8° | 120.0° |
| N | C | C1 | H19 | 32.3° | 60.0° |
| N | C | C1 | H20 | 88.0° | 60.0° |
| C | C1 | N1 | H19 | 119.8° | 120.1° |
| C | C1 | N1 | H20 | 119.9° | 120.0° |
| C | C1 | N1 | C2 | 104.8° | 180.0° |
| C | C1 | N1 | H4 | 133.4° | 0.0° |
| C1 | C | N | H14 | 180.0° | 180.0° |
| C1 | C | N | H15 | 60.0° | 56.0° |
| C1 | C | H17 | H18 | 117.7° | 120.0° |
| C | C1 | H19 | H20 | 120.4° | 120.0° |
| C1 | N1 | C2 | H4 | 121.8° | 180.0° |
| C1 | N1 | C2 | N2 | 5.6° | 0.0° |
| C1 | N1 | C2 | C6 | 172.5° | 180.0° |
| N1 | C1 | C | H17 | 87.1° | 60.0° |
| N1 | C1 | C | H18 | 31.4° | 60.0° |
| N1 | C1 | H19 | H20 | 120.5° | 120.0° |
| N1 | C2 | N2 | C6 | 178.2° | 180.0° |
| N1 | C2 | N2 | C3 | 177.5° | 179.8° |
| N1 | C2 | C6 | C4 | 176.4° | 179.9° |
| N1 | C2 | C6 | N5 | 4.5° | 0.0° |
| C2 | N1 | C1 | H19 | 15.0° | 60.0° |
| C2 | N1 | C1 | H20 | 135.3° | 60.0° |
| C2 | N2 | C3 | N3 | 0.6° | 0.2° |
| N2 | C2 | C6 | C4 | 1.6° | 0.0° |
| N2 | C2 | C6 | N5 | 177.4° | 180.0° |
| N2 | C2 | N1 | H4 | 116.2° | 180.0° |
| C2 | N2 | C3 | H30 | 179.4° | 180.0° |
| C3 | N2 | C2 | C6 | 0.7° | 0.2° |
| N2 | C3 | N3 | H30 | 180.0° | 179.8° |
| N2 | C3 | N3 | C4 | 0.7° | 0.0° |
| C2 | C6 | C4 | N5 | 179.2° | 179.9° |
| C2 | C6 | C4 | N3 | 1.6° | 0.3° |
| C2 | C6 | C4 | N4 | 179.9° | 180.0° |
| C2 | C6 | N5 | C5 | 179.4° | 179.9° |
| C6 | C2 | N1 | H4 | 65.7° | 0.0° |
| C3 | N3 | C4 | C6 | 0.5° | 0.3° |
| C3 | N3 | C4 | N4 | 178.6° | 179.9° |
| C6 | C4 | N3 | N4 | 178.1° | 179.7° |
| C4 | C6 | N5 | C5 | 0.3° | 0.0° |
| C6 | C4 | N4 | C5 | 1.1° | 0.0° |
| C6 | C4 | N4 | C7 | 177.7° | 179.9° |
| N5 | C6 | C4 | N3 | 177.6° | 179.8° |
| N5 | C6 | C4 | N4 | 0.9° | 0.0° |
| C6 | N5 | C5 | N4 | 0.4° | 0.0° |
| C6 | N5 | C5 | H2 | 179.6° | 179.9° |
| N3 | C4 | N4 | C5 | 177.4° | 179.7° |
| N3 | C4 | N4 | C7 | 3.8° | 0.2° |
| C4 | N3 | C3 | H30 | 179.3° | 179.7° |
| C4 | N4 | C5 | N5 | 1.0° | 0.0° |
| C4 | N4 | C7 | C24 | 48.3° | 88.1° |
| C4 | N4 | C5 | C7 | 178.8° | 180.0° |
| C4 | N4 | C7 | O | 72.4° | 156.4° |
| C4 | N4 | C5 | H2 | 179.0° | 180.0° |
| C4 | N4 | C7 | H5 | 169.1° | 34.2° |
| N5 | C5 | N4 | H2 | 180.0° | 179.9° |
| N5 | C5 | N4 | C7 | 177.9° | 179.9° |
| O7 | C24 | C23 | C7 | 118.5° | 118.6° |
| O7 | C24 | C23 | H29 | 124.5° | 122.6° |
| O7 | C24 | C7 | H29 | 123.6° | 122.7° |
| O7 | C24 | C7 | N4 | 134.8° | 98.5° |
| O7 | C24 | C23 | O6 | 31.2° | 0.0° |
| O7 | C24 | C23 | C8 | 87.9° | 118.7° |
| O7 | C24 | C7 | O | 104.3° | 142.6° |
| O7 | C24 | C7 | H5 | 13.5° | 23.7° |
| O7 | C24 | C23 | H28 | 155.3° | 122.7° |
| C23 | C24 | C7 | H29 | 117.0° | 118.7° |
| C23 | C24 | C7 | N4 | 105.9° | 142.9° |
| C24 | C23 | O6 | C8 | 113.8° | 114.7° |
| C24 | C23 | O6 | H28 | 123.2° | 122.8° |
| C24 | C23 | C8 | H28 | 116.6° | 118.8° |
| C23 | C24 | C7 | O | 15.0° | 24.0° |
| C24 | C23 | C8 | O | 36.2° | 23.9° |
| C24 | C23 | C8 | C9 | 156.5° | 142.8° |
| C23 | C24 | C7 | H5 | 132.8° | 94.9° |
| C24 | C23 | C8 | H6 | 80.7° | 94.9° |
| C24 | C23 | O6 | H12 | 180.0° | 65.4° |
| C23 | C24 | O7 | H13 | 180.0° | 61.5° |
| C24 | C7 | N4 | C5 | 130.3° | 92.0° |
| C24 | C7 | N4 | O | 120.7° | 115.5° |
| C24 | C7 | N4 | H5 | 120.8° | 122.2° |
| C7 | C24 | C23 | O6 | 149.8° | 118.7° |
| C7 | C24 | C23 | C8 | 30.6° | 0.0° |
| C24 | C7 | O | H5 | 116.7° | 118.8° |
| C24 | C7 | O | C8 | 7.9° | 40.5° |
| C7 | C24 | O7 | H13 | 66.3° | 176.1° |
| C7 | C24 | C23 | H28 | 86.1° | 118.7° |
| C5 | N4 | C7 | O | 109.1° | 23.5° |
| C5 | N4 | C7 | H5 | 9.5° | 145.8° |
| N4 | C7 | O | H5 | 118.1° | 122.2° |
| N4 | C7 | O | C8 | 133.1° | 159.4° |
| C7 | N4 | C5 | H2 | 2.2° | 0.0° |
| N4 | C7 | C24 | H29 | 11.2° | 24.2° |
| O6 | C23 | C8 | H28 | 123.8° | 122.6° |
| O6 | C23 | C8 | O | 155.8° | 142.6° |
| O6 | C23 | C8 | C9 | 83.9° | 98.5° |
| O6 | C23 | C8 | H6 | 39.0° | 23.8° |
| O6 | C23 | C24 | H29 | 93.3° | 122.6° |
| C23 | C8 | O | C7 | 28.0° | 40.5° |
| C23 | C8 | O | C9 | 125.0° | 118.9° |
| C23 | C8 | O | H6 | 116.1° | 118.9° |
| C23 | C8 | C9 | H6 | 122.8° | 122.4° |
| C23 | C8 | C9 | O1 | 105.1° | 176.6° |
| C23 | C8 | C9 | H7 | 15.0° | 56.6° |
| C23 | C8 | C9 | H8 | 134.8° | 63.3° |
| C8 | C23 | O6 | H12 | 66.2° | 180.0° |
| C8 | C23 | C24 | H29 | 147.5° | 118.7° |
| C7 | O | C8 | C9 | 153.0° | 159.3° |
| C7 | O | C8 | H6 | 88.1° | 78.4° |
| O | C7 | C24 | H29 | 132.0° | 94.7° |
| O | C8 | C9 | H6 | 119.5° | 122.2° |
| O | C8 | C9 | O1 | 137.1° | 68.0° |
| C8 | O | C7 | H5 | 108.8° | 78.3° |
| O | C8 | C9 | H7 | 102.8° | 172.0° |
| O | C8 | C9 | H8 | 17.1° | 52.1° |
| O | C8 | C23 | H28 | 80.4° | 94.9° |
| C8 | C9 | O1 | H7 | 120.1° | 120.0° |
| C8 | C9 | O1 | H8 | 120.1° | 120.0° |
| C8 | C9 | O1 | C10 | 86.0° | 180.0° |
| C8 | C9 | H7 | H8 | 119.8° | 119.9° |
| C9 | C8 | C23 | H28 | 39.9° | 24.0° |
| C9 | O1 | C10 | C11 | 84.7° | 180.0° |
| O1 | C9 | C8 | H6 | 17.7° | 54.2° |
| O1 | C9 | H7 | H8 | 119.8° | 120.1° |
| C9 | O1 | C10 | H10 | 154.9° | 60.0° |
| C9 | O1 | C10 | H11 | 35.7° | 60.1° |
| N7 | C15 | N8 | C14 | 179.3° | 179.9° |
| N7 | C15 | N8 | C16 | 179.4° | 179.9° |
| N7 | C15 | C14 | N6 | 0.5° | 0.1° |
| N7 | C15 | C14 | C17 | 179.2° | 179.9° |
| C15 | N7 | H31 | H32 | 120.0° | 180.0° |
| O1 | C10 | C11 | H10 | 120.4° | 120.0° |
| O1 | C10 | C11 | H11 | 120.4° | 120.0° |
| O1 | C10 | C11 | C12 | 12.0° | 50.8° |
| C10 | O1 | C9 | H7 | 153.9° | 60.0° |
| C10 | O1 | C9 | H8 | 34.0° | 60.0° |
| O1 | C10 | H10 | H11 | 118.7° | 120.1° |
| N8 | C15 | C14 | N6 | 178.8° | 180.0° |
| N8 | C15 | C14 | C17 | 0.1° | 0.1° |
| C15 | N8 | C16 | N9 | 0.0° | 0.0° |
| C15 | N8 | C16 | H21 | 180.0° | 179.9° |
| N8 | C15 | N7 | H31 | 0.0° | 0.0° |
| N8 | C15 | N7 | H32 | 120.0° | 180.0° |
| C14 | C15 | N8 | C16 | 0.1° | 0.1° |
| C15 | C14 | N6 | C17 | 178.8° | 179.9° |
| C15 | C14 | N6 | C13 | 178.5° | 179.9° |
| C15 | C14 | C17 | N9 | 0.3° | 0.0° |
| C15 | C14 | C17 | N10 | 178.8° | 179.9° |
| C14 | C15 | N7 | H31 | 179.3° | 179.9° |
| C14 | C15 | N7 | H32 | 59.3° | 0.1° |
| N8 | C16 | N9 | H21 | 180.0° | 180.0° |
| N8 | C16 | N9 | C17 | 0.1° | 0.0° |
| C14 | N6 | C13 | C12 | 177.8° | 179.9° |
| C14 | N6 | C13 | N10 | 0.3° | 0.3° |
| N6 | C14 | C17 | N9 | 179.3° | 180.0° |
| N6 | C14 | C17 | N10 | 0.2° | 0.0° |
| C13 | N6 | C14 | C17 | 0.3° | 0.2° |
| N6 | C13 | C12 | N10 | 178.0° | 179.6° |
| N6 | C13 | C12 | C11 | 9.9° | 29.2° |
| N6 | C13 | N10 | C17 | 0.2° | 0.3° |
| N6 | C13 | N10 | C18 | 179.4° | 179.8° |
| C14 | C17 | N9 | C16 | 0.3° | 0.0° |
| C14 | C17 | N10 | C13 | 0.0° | 0.2° |
| C14 | C17 | N9 | N10 | 178.9° | 180.0° |
| C14 | C17 | N10 | C18 | 179.2° | 179.9° |
| O3 | C20 | C19 | O2 | 57.3° | 67.0° |
| O3 | C20 | C19 | H24 | 120.3° | 120.0° |
| O3 | C20 | C19 | H25 | 120.3° | 120.0° |
| O3 | C20 | C19 | C21 | 176.6° | 175.0° |
| O3 | C20 | C19 | H23 | 61.9° | 54.0° |
| O3 | C20 | H24 | H25 | 119.1° | 120.0° |
| C10 | C11 | C12 | C13 | 24.0° | 40.3° |
| C11 | C10 | H10 | H11 | 118.8° | 119.9° |
| C16 | N9 | C17 | N10 | 178.6° | 180.0° |
| C12 | C13 | N10 | C17 | 177.9° | 179.9° |
| C12 | C13 | N10 | C18 | 1.2° | 0.1° |
| N10 | C13 | C12 | C11 | 168.0° | 151.1° |
| C13 | N10 | C17 | N9 | 179.0° | 179.9° |
| C13 | N10 | C17 | C18 | 179.2° | 180.0° |
| C13 | N10 | C18 | O2 | 50.7° | 39.2° |
| C13 | N10 | C18 | C22 | 68.6° | 74.9° |
| C13 | N10 | C18 | H22 | 170.0° | 162.1° |
| C12 | C11 | C10 | H10 | 108.4° | 69.2° |
| C12 | C11 | C10 | H11 | 132.4° | 170.8° |
| N9 | C17 | N10 | C18 | 0.1° | 0.1° |
| C17 | N9 | C16 | H21 | 179.9° | 180.0° |
| C17 | N10 | C18 | O2 | 128.3° | 140.8° |
| C17 | N10 | C18 | C22 | 112.5° | 105.0° |
| C17 | N10 | C18 | H22 | 9.0° | 17.9° |
| O2 | C18 | N10 | C22 | 119.2° | 114.1° |
| O2 | C18 | N10 | H22 | 119.3° | 122.9° |
| C18 | O2 | C19 | C20 | 125.7° | 146.0° |
| O2 | C18 | C22 | H22 | 116.8° | 118.5° |
| C18 | O2 | C19 | C21 | 1.0° | 26.5° |
| O2 | C18 | C22 | C21 | 38.4° | 37.0° |
| O2 | C18 | C22 | O5 | 156.8° | 155.2° |
| C18 | O2 | C19 | H23 | 115.6° | 93.0° |
| O2 | C18 | C22 | H27 | 78.3° | 81.2° |
| C19 | O2 | C18 | N10 | 150.3° | 158.6° |
| O2 | C19 | C20 | C21 | 119.3° | 118.0° |
| O2 | C19 | C20 | H23 | 119.2° | 121.1° |
| C19 | O2 | C18 | C22 | 25.1° | 40.0° |
| O2 | C19 | C21 | H23 | 117.4° | 119.5° |
| O2 | C19 | C21 | C22 | 23.0° | 2.0° |
| O2 | C19 | C21 | O4 | 96.0° | 120.6° |
| C19 | O2 | C18 | H22 | 90.7° | 78.5° |
| O2 | C19 | C20 | H24 | 63.0° | 52.9° |
| O2 | C19 | C20 | H25 | 177.6° | 173.0° |
| O2 | C19 | C21 | H26 | 140.1° | 116.8° |
| N10 | C18 | C22 | H22 | 121.9° | 122.9° |
| N10 | C18 | C22 | C21 | 159.6° | 155.7° |
| N10 | C18 | C22 | O5 | 82.0° | 86.2° |
| N10 | C18 | C22 | H27 | 42.9° | 37.4° |
| C20 | C19 | C21 | H23 | 121.6° | 120.9° |
| C20 | C19 | C21 | C22 | 98.0° | 121.6° |
| C20 | C19 | C21 | O4 | 142.9° | 119.7° |
| C19 | C20 | O3 | H1 | 180.0° | 180.0° |
| C19 | C20 | H24 | H25 | 119.1° | 120.0° |
| C20 | C19 | C21 | H26 | 19.1° | 2.8° |
| C18 | C22 | C21 | C19 | 36.3° | 20.9° |
| C18 | C22 | C21 | O5 | 117.4° | 118.2° |
| C18 | C22 | C21 | H27 | 116.7° | 118.2° |
| C18 | C22 | O5 | H27 | 124.0° | 123.7° |
| C18 | C22 | C21 | O4 | 82.3° | 97.7° |
| C18 | C22 | O5 | H9 | 180.0° | 180.0° |
| C18 | C22 | C21 | H26 | 153.4° | 139.6° |
| C19 | C21 | C22 | O4 | 118.5° | 118.6° |
| C19 | C21 | C22 | H26 | 117.1° | 118.7° |
| C19 | C21 | C22 | O5 | 153.7° | 139.1° |
| C19 | C21 | O4 | H26 | 122.9° | 122.6° |
| C19 | C21 | O4 | H3 | 180.0° | 61.6° |
| C21 | C19 | C20 | H24 | 56.3° | 65.1° |
| C21 | C19 | C20 | H25 | 63.1° | 55.0° |
| C19 | C21 | C22 | H27 | 80.4° | 97.3° |
| C21 | C22 | O5 | H27 | 124.9° | 123.6° |
| C22 | C21 | O4 | H26 | 123.5° | 122.7° |
| C22 | C21 | O4 | H3 | 66.4° | 176.3° |
| C21 | C22 | O5 | H9 | 68.9° | 67.3° |
| C21 | C22 | C18 | H22 | 78.5° | 81.4° |
| C22 | C21 | C19 | H23 | 140.4° | 117.4° |
| O5 | C22 | C21 | O4 | 35.2° | 20.5° |
| O5 | C22 | C18 | H22 | 40.0° | 36.7° |
| O5 | C22 | C21 | H26 | 89.2° | 102.2° |
| O4 | C21 | C19 | H23 | 21.3° | 1.2° |
| O4 | C21 | C22 | H27 | 161.0° | 144.0° |
| H1 | O3 | C20 | H24 | 59.7° | 60.0° |
| H1 | O3 | C20 | H25 | 59.8° | 60.0° |
| H3 | O4 | C21 | H26 | 57.1° | 61.0° |
| H4 | N1 | C1 | H19 | 106.8° | 120.1° |
| H4 | N1 | C1 | H20 | 13.5° | 120.0° |
| H5 | C7 | C24 | H29 | 110.2° | 146.4° |
| H6 | C8 | C9 | H7 | 137.7° | 65.8° |
| H6 | C8 | C9 | H8 | 102.4° | 174.3° |
| H6 | C8 | C23 | H28 | 162.7° | 146.3° |
| H9 | O5 | C22 | H27 | 56.1° | 56.3° |
| H12 | O6 | C23 | H28 | 56.7° | 57.4° |
| H13 | O7 | C24 | H29 | 56.3° | 61.1° |
| H14 | N | C | H17 | 59.3° | 60.0° |
| H14 | N | C | H18 | 59.3° | 59.9° |
| H15 | N | C | H17 | 60.7° | 64.0° |
| H15 | N | C | H18 | 179.3° | 176.0° |
| H17 | C | C1 | H19 | 153.0° | 60.0° |
| H17 | C | C1 | H20 | 32.7° | 180.0° |
| H18 | C | C1 | H19 | 88.5° | 180.0° |
| H18 | C | C1 | H20 | 151.3° | 60.1° |
| H22 | C18 | C22 | H27 | 164.8° | 160.3° |
| H23 | C19 | C20 | H24 | 177.8° | 174.0° |
| H23 | C19 | C20 | H25 | 58.3° | 66.0° |
| H23 | C19 | C21 | H26 | 102.5° | 123.8° |
| H26 | C21 | C22 | H27 | 36.6° | 21.4° |
| H28 | C23 | C24 | H29 | 30.8° | 0.0° |
