DUO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.47Å | 1.46Å | |
| N1 | C5 | sing | 1.39Å | 1.45Å | |
| N1 | H1 | sing | 1.01Å | 0.98Å | |
| C2 | C3 | sing | 1.51Å | 1.48Å | |
| C2 | C33 | sing | 1.53Å | 1.53Å | |
| C2 | C34 | sing | 1.51Å | 1.50Å | |
| C3 | C4 | sing | 1.47Å | 1.48Å | |
| C3 | O32 | doub | 1.21Å | 1.23Å | |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C4 | C9 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | O31 | sing | 1.36Å | 1.38Å | |
| C7 | C8 | sing | 1.40Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | N13 | sing | 1.40Å | 1.45Å | |
| C9 | C11 | sing | 1.51Å | 1.51Å | |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H103 | sing | 1.09Å | 1.12Å | |
| C11 | C12 | sing | 1.54Å | 1.48Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | N13 | sing | 1.46Å | 1.45Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| N13 | C14 | sing | 1.35Å | 1.46Å | |
| C14 | C15 | sing | 1.47Å | 1.51Å | |
| C14 | O30 | doub | 1.22Å | 1.23Å | |
| C15 | C16 | doub | 1.36Å | 1.39Å | Aromatic |
| C15 | N23 | sing | 1.38Å | 1.34Å | Aromatic |
| C16 | C17 | sing | 1.42Å | 1.38Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | C18 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C22 | sing | 1.41Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | C20 | doub | 1.40Å | 1.41Å | Aromatic |
| C19 | O24 | sing | 1.36Å | 1.39Å | |
| C20 | C21 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | O26 | sing | 1.36Å | 1.39Å | |
| C21 | C22 | doub | 1.40Å | 1.40Å | Aromatic |
| C21 | O28 | sing | 1.36Å | 1.39Å | |
| C22 | N23 | sing | 1.38Å | 1.33Å | Aromatic |
| N23 | H23 | sing | 0.97Å | 0.96Å | |
| O24 | C25 | sing | 1.43Å | 1.45Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| O26 | C27 | sing | 1.43Å | 1.43Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| O31 | H31 | sing | 0.97Å | 0.96Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C33 | H333 | sing | 1.09Å | 1.10Å | |
| C34 | O35 | doub | 1.21Å | 1.23Å | |
| C34 | O36 | sing | 1.34Å | 1.39Å | |
| O36 | C37 | sing | 1.45Å | 1.43Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C37 | H373 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C5 | 106.3° | 109.2° |
| C2 | N1 | H1 | 114.3° | 106.7° |
| N1 | C2 | C3 | 106.7° | 105.6° |
| N1 | C2 | C33 | 103.1° | 110.2° |
| N1 | C2 | C34 | 119.6° | 110.3° |
| C5 | N1 | H1 | 115.5° | 106.7° |
| N1 | C5 | C4 | 112.7° | 110.9° |
| N1 | C5 | C6 | 126.6° | 130.2° |
| C3 | C2 | C33 | 108.9° | 110.2° |
| C3 | C2 | C34 | 105.2° | 110.2° |
| C2 | C3 | C4 | 108.1° | 105.4° |
| C2 | C3 | O32 | 126.9° | 127.3° |
| C33 | C2 | C34 | 112.9° | 110.2° |
| C2 | C33 | H331 | 109.9° | 109.5° |
| C2 | C33 | H332 | 108.7° | 109.5° |
| C2 | C33 | H333 | 109.1° | 109.5° |
| C2 | C34 | O35 | 119.8° | 120.0° |
| C2 | C34 | O36 | 121.7° | 120.0° |
| C4 | C3 | O32 | 124.9° | 127.3° |
| C3 | C4 | C5 | 106.1° | 108.9° |
| C3 | C4 | C9 | 136.0° | 131.0° |
| C5 | C4 | C9 | 117.9° | 120.1° |
| C4 | C5 | C6 | 120.7° | 118.8° |
| C4 | C9 | C8 | 122.4° | 120.5° |
| C4 | C9 | C11 | 127.2° | 130.8° |
| C5 | C6 | C7 | 120.1° | 120.5° |
| C5 | C6 | O31 | 124.3° | 119.7° |
| C7 | C6 | O31 | 115.6° | 119.8° |
| C6 | C7 | C8 | 119.9° | 120.8° |
| C6 | C7 | H7 | 120.0° | 119.6° |
| C6 | O31 | H31 | 108.0° | 106.8° |
| C8 | C7 | H7 | 120.1° | 119.6° |
| C7 | C8 | C9 | 118.9° | 119.2° |
| C7 | C8 | N13 | 132.0° | 129.2° |
| C9 | C8 | N13 | 109.1° | 111.6° |
| C8 | C9 | C11 | 110.3° | 108.7° |
| C8 | N13 | C12 | 101.9° | 110.0° |
| C8 | N13 | C14 | 127.3° | 125.0° |
| C9 | C11 | C10 | 111.8° | 110.5° |
| C9 | C11 | C12 | 98.7° | 104.5° |
| C9 | C11 | H11 | 114.6° | 110.4° |
| C11 | C10 | H101 | 98.8° | 109.5° |
| C11 | C10 | H102 | 105.3° | 109.5° |
| C11 | C10 | H103 | 111.3° | 109.5° |
| C10 | C11 | C12 | 107.8° | 110.4° |
| C10 | C11 | H11 | 117.5° | 110.3° |
| H101 | C10 | H102 | 117.6° | 109.5° |
| H101 | C10 | H103 | 113.9° | 109.5° |
| H102 | C10 | H103 | 6.3° | 109.4° |
| C12 | C11 | H11 | 104.0° | 110.5° |
| C11 | C12 | N13 | 109.1° | 105.2° |
| C11 | C12 | H121 | 101.7° | 110.3° |
| C11 | C12 | H122 | 106.8° | 110.3° |
| N13 | C12 | H121 | 107.9° | 110.3° |
| N13 | C12 | H122 | 118.6° | 110.3° |
| C12 | N13 | C14 | 126.8° | 125.1° |
| H121 | C12 | H122 | 111.4° | 110.3° |
| N13 | C14 | C15 | 127.3° | 120.0° |
| N13 | C14 | O30 | 113.3° | 120.0° |
| C15 | C14 | O30 | 119.4° | 120.0° |
| C14 | C15 | C16 | 129.0° | 125.5° |
| C14 | C15 | N23 | 125.8° | 125.5° |
| C16 | C15 | N23 | 105.2° | 109.1° |
| C15 | C16 | C17 | 109.7° | 107.8° |
| C15 | C16 | H16 | 122.5° | 126.1° |
| C15 | N23 | C22 | 112.0° | 108.7° |
| C15 | N23 | H23 | 123.9° | 125.6° |
| C17 | C16 | H16 | 127.9° | 126.1° |
| C16 | C17 | C18 | 137.2° | 133.1° |
| C16 | C17 | C22 | 105.2° | 107.0° |
| C18 | C17 | C22 | 117.5° | 119.9° |
| C17 | C18 | C19 | 123.1° | 119.8° |
| C17 | C18 | H18 | 121.9° | 120.1° |
| C17 | C22 | C21 | 122.1° | 119.7° |
| C17 | C22 | N23 | 107.9° | 107.4° |
| C19 | C18 | H18 | 115.0° | 120.1° |
| C18 | C19 | C20 | 117.8° | 120.3° |
| C18 | C19 | O24 | 120.9° | 119.8° |
| C20 | C19 | O24 | 121.3° | 119.8° |
| C19 | C20 | C21 | 120.8° | 120.5° |
| C19 | C20 | O26 | 119.8° | 119.7° |
| C19 | O24 | C25 | 121.8° | 106.8° |
| C21 | C20 | O26 | 119.4° | 119.8° |
| C20 | C21 | C22 | 118.6° | 119.9° |
| C20 | C21 | O28 | 121.3° | 120.0° |
| C20 | O26 | C27 | 117.8° | 106.8° |
| C22 | C21 | O28 | 120.1° | 120.1° |
| C21 | C22 | N23 | 130.0° | 132.9° |
| C21 | O28 | C29 | 114.7° | 106.8° |
| C22 | N23 | H23 | 124.1° | 125.7° |
| O24 | C25 | H251 | 109.9° | 109.5° |
| O24 | C25 | H252 | 110.1° | 109.5° |
| O24 | C25 | H253 | 114.9° | 109.5° |
| H251 | C25 | H252 | 105.7° | 109.4° |
| H251 | C25 | H253 | 108.7° | 109.5° |
| H252 | C25 | H253 | 107.2° | 109.4° |
| O26 | C27 | H271 | 109.2° | 109.5° |
| O26 | C27 | H272 | 110.8° | 109.5° |
| O26 | C27 | H273 | 108.5° | 109.5° |
| H271 | C27 | H272 | 109.1° | 109.4° |
| H271 | C27 | H273 | 109.7° | 109.4° |
| H272 | C27 | H273 | 109.5° | 109.5° |
| O28 | C29 | H291 | 108.8° | 109.5° |
| O28 | C29 | H292 | 110.3° | 109.4° |
| O28 | C29 | H293 | 109.1° | 109.5° |
| H291 | C29 | H292 | 109.4° | 109.5° |
| H291 | C29 | H293 | 109.8° | 109.5° |
| H292 | C29 | H293 | 109.4° | 109.4° |
| H331 | C33 | H332 | 109.9° | 109.5° |
| H331 | C33 | H333 | 109.5° | 109.5° |
| H332 | C33 | H333 | 109.7° | 109.4° |
| O35 | C34 | O36 | 118.5° | 120.0° |
| C34 | O36 | C37 | 114.4° | 120.0° |
| O36 | C37 | H371 | 110.6° | 109.5° |
| O36 | C37 | H372 | 110.3° | 109.5° |
| O36 | C37 | H373 | 109.7° | 109.4° |
| H371 | C37 | H372 | 109.1° | 109.5° |
| H371 | C37 | H373 | 107.7° | 109.4° |
| H372 | C37 | H373 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C5 | H1 | 127.9° | 114.9° |
| N1 | C2 | C3 | C33 | 110.6° | 119.0° |
| N1 | C2 | C3 | C34 | 128.0° | 119.1° |
| N1 | C2 | C33 | C34 | 130.4° | 121.9° |
| N1 | C2 | C3 | C4 | 2.2° | 0.1° |
| N1 | C2 | C3 | O32 | 176.4° | 179.9° |
| C2 | N1 | C5 | C4 | 0.6° | 0.0° |
| C2 | N1 | C5 | C6 | 179.3° | 180.0° |
| N1 | C2 | C33 | H331 | 163.6° | 62.6° |
| N1 | C2 | C33 | H332 | 43.3° | 177.4° |
| N1 | C2 | C33 | H333 | 76.3° | 57.4° |
| N1 | C2 | C34 | O35 | 49.6° | 147.4° |
| N1 | C2 | C34 | O36 | 129.8° | 32.6° |
| C5 | N1 | C2 | C3 | 1.7° | 0.1° |
| C5 | N1 | C2 | C33 | 116.3° | 119.1° |
| C5 | N1 | C2 | C34 | 117.4° | 119.0° |
| N1 | C5 | C4 | C3 | 0.8° | 0.0° |
| N1 | C5 | C4 | C6 | 179.9° | 180.0° |
| N1 | C5 | C4 | C9 | 179.2° | 179.9° |
| N1 | C5 | C6 | C7 | 179.6° | 179.9° |
| N1 | C5 | C6 | O31 | 0.5° | 0.1° |
| H1 | N1 | C2 | C3 | 130.3° | 115.0° |
| H1 | N1 | C2 | C33 | 115.1° | 125.9° |
| H1 | N1 | C2 | C34 | 11.2° | 4.1° |
| H1 | N1 | C5 | C4 | 128.5° | 114.9° |
| H1 | N1 | C5 | C6 | 51.4° | 65.1° |
| C3 | C2 | C33 | C34 | 116.5° | 121.9° |
| C2 | C3 | C4 | O32 | 178.6° | 180.0° |
| C2 | C3 | C4 | C5 | 1.9° | 0.1° |
| C2 | C3 | C4 | C9 | 178.2° | 180.0° |
| C3 | C2 | C33 | H331 | 83.4° | 178.8° |
| C3 | C2 | C33 | H332 | 156.4° | 61.2° |
| C3 | C2 | C33 | H333 | 36.8° | 58.8° |
| C3 | C2 | C34 | O35 | 70.3° | 31.1° |
| C3 | C2 | C34 | O36 | 110.3° | 148.8° |
| C33 | C2 | C3 | C4 | 112.8° | 119.1° |
| C33 | C2 | C3 | O32 | 65.7° | 60.9° |
| C2 | C33 | H331 | H332 | 119.5° | 120.0° |
| C2 | C33 | H331 | H333 | 119.9° | 120.0° |
| C2 | C33 | H332 | H333 | 119.3° | 120.0° |
| C33 | C2 | C34 | O35 | 171.1° | 90.8° |
| C33 | C2 | C34 | O36 | 8.3° | 89.3° |
| C34 | C2 | C3 | C4 | 125.8° | 119.0° |
| C34 | C2 | C3 | O32 | 55.6° | 61.0° |
| C34 | C2 | C33 | H331 | 33.1° | 59.3° |
| C34 | C2 | C33 | H332 | 87.1° | 60.7° |
| C34 | C2 | C33 | H333 | 153.3° | 179.3° |
| C2 | C34 | O35 | O36 | 179.4° | 179.9° |
| C2 | C34 | O36 | C37 | 100.1° | 179.9° |
| C3 | C4 | C5 | C9 | 179.9° | 179.9° |
| C3 | C4 | C5 | C6 | 179.3° | 179.9° |
| C3 | C4 | C9 | C8 | 177.6° | 179.9° |
| C3 | C4 | C9 | C11 | 2.1° | 0.2° |
| O32 | C3 | C4 | C5 | 176.7° | 179.9° |
| O32 | C3 | C4 | C9 | 3.2° | 0.0° |
| C4 | C5 | C6 | C7 | 0.5° | 0.0° |
| C4 | C5 | C6 | O31 | 179.4° | 180.0° |
| C5 | C4 | C9 | C8 | 2.3° | 0.0° |
| C5 | C4 | C9 | C11 | 177.9° | 180.0° |
| C9 | C4 | C5 | C6 | 0.6° | 0.0° |
| C4 | C9 | C8 | C7 | 2.8° | 0.0° |
| C4 | C9 | C8 | C11 | 179.8° | 180.0° |
| C4 | C9 | C8 | N13 | 177.3° | 180.0° |
| C4 | C9 | C11 | C10 | 83.5° | 61.2° |
| C4 | C9 | C11 | C12 | 163.3° | 180.0° |
| C4 | C9 | C11 | H11 | 53.5° | 61.1° |
| C5 | C6 | C7 | O31 | 179.9° | 180.0° |
| C5 | C6 | C7 | C8 | 0.0° | 0.0° |
| C5 | C6 | C7 | H7 | 177.7° | 180.0° |
| C5 | C6 | O31 | H31 | 43.1° | 90.0° |
| C6 | C7 | C8 | H7 | 177.8° | 180.0° |
| C6 | C7 | C8 | C9 | 1.6° | 0.0° |
| C6 | C7 | C8 | N13 | 178.6° | 180.0° |
| C7 | C6 | O31 | H31 | 137.0° | 90.0° |
| O31 | C6 | C7 | C8 | 179.9° | 180.0° |
| O31 | C6 | C7 | H7 | 2.4° | 0.1° |
| C7 | C8 | C9 | N13 | 179.9° | 180.0° |
| C7 | C8 | C9 | C11 | 177.4° | 180.0° |
| C7 | C8 | N13 | C12 | 158.4° | 180.0° |
| C7 | C8 | N13 | C14 | 0.2° | 0.2° |
| H7 | C7 | C8 | C9 | 179.4° | 180.0° |
| H7 | C7 | C8 | N13 | 0.8° | 0.1° |
| C8 | C9 | C11 | C10 | 96.2° | 118.8° |
| C8 | C9 | C11 | C12 | 17.0° | 0.0° |
| C8 | C9 | C11 | H11 | 126.8° | 118.8° |
| C9 | C8 | N13 | C12 | 21.4° | 0.0° |
| C9 | C8 | N13 | C14 | 179.7° | 179.9° |
| N13 | C8 | C9 | C11 | 2.5° | 0.0° |
| C8 | N13 | C12 | C11 | 33.4° | 0.1° |
| C8 | N13 | C12 | C14 | 158.4° | 179.8° |
| C8 | N13 | C12 | H121 | 76.3° | 119.0° |
| C8 | N13 | C12 | H122 | 155.9° | 118.9° |
| C8 | N13 | C14 | C15 | 152.7° | 175.0° |
| C8 | N13 | C14 | O30 | 27.9° | 5.1° |
| C9 | C11 | C10 | C12 | 107.4° | 115.1° |
| C9 | C11 | C10 | H11 | 135.6° | 122.4° |
| C9 | C11 | C10 | H101 | 65.3° | 176.6° |
| C9 | C11 | C10 | H102 | 56.6° | 56.6° |
| C9 | C11 | C10 | H103 | 54.8° | 63.3° |
| C9 | C11 | C12 | H11 | 118.2° | 118.8° |
| C9 | C11 | C12 | N13 | 31.0° | 0.1° |
| C9 | C11 | C12 | H121 | 82.8° | 119.0° |
| C9 | C11 | C12 | H122 | 160.3° | 118.9° |
| C11 | C10 | H101 | H102 | 112.5° | 120.0° |
| C11 | C10 | H101 | H103 | 118.1° | 120.0° |
| C11 | C10 | H102 | H103 | 164.4° | 120.0° |
| C10 | C11 | C12 | H11 | 125.5° | 122.3° |
| C10 | C11 | C12 | N13 | 85.3° | 118.9° |
| C10 | C11 | C12 | H121 | 160.9° | 122.2° |
| C10 | C11 | C12 | H122 | 44.0° | 0.1° |
| H101 | C10 | H102 | H103 | 55.6° | 120.0° |
| H101 | C10 | C11 | C12 | 42.1° | 61.5° |
| H101 | C10 | C11 | H11 | 159.1° | 61.0° |
| H102 | C10 | C11 | C12 | 163.9° | 58.5° |
| H102 | C10 | C11 | H11 | 79.0° | 179.0° |
| H103 | C10 | C11 | C12 | 162.1° | 178.5° |
| H103 | C10 | C11 | H11 | 80.9° | 59.1° |
| C11 | C12 | N13 | H121 | 109.7° | 118.9° |
| C11 | C12 | N13 | H122 | 122.4° | 119.0° |
| C11 | C12 | H121 | H122 | 113.4° | 122.1° |
| C11 | C12 | N13 | C14 | 168.2° | 179.9° |
| H11 | C11 | C12 | N13 | 149.2° | 118.8° |
| H11 | C11 | C12 | H121 | 35.4° | 0.2° |
| H11 | C11 | C12 | H122 | 81.5° | 122.3° |
| N13 | C12 | H121 | H122 | 131.9° | 122.1° |
| C12 | N13 | C14 | C15 | 0.4° | 4.8° |
| C12 | N13 | C14 | O30 | 179.0° | 175.1° |
| H121 | C12 | N13 | C14 | 82.1° | 61.2° |
| H122 | C12 | N13 | C14 | 45.7° | 60.9° |
| N13 | C14 | C15 | O30 | 179.3° | 179.9° |
| N13 | C14 | C15 | C16 | 9.1° | 174.6° |
| N13 | C14 | C15 | N23 | 170.0° | 5.7° |
| C14 | C15 | C16 | N23 | 179.2° | 179.8° |
| C14 | C15 | C16 | C17 | 178.3° | 179.8° |
| C14 | C15 | C16 | H16 | 2.4° | 0.2° |
| C14 | C15 | N23 | C22 | 178.6° | 179.9° |
| C14 | C15 | N23 | H23 | 0.9° | 0.0° |
| O30 | C14 | C15 | C16 | 171.6° | 5.6° |
| O30 | C14 | C15 | N23 | 9.3° | 174.2° |
| C15 | C16 | C17 | H16 | 179.3° | 179.6° |
| C15 | C16 | C17 | C18 | 176.2° | 179.9° |
| C15 | C16 | C17 | C22 | 0.8° | 0.4° |
| C16 | C15 | N23 | C22 | 0.6° | 0.3° |
| C16 | C15 | N23 | H23 | 179.8° | 179.7° |
| N23 | C15 | C16 | C17 | 0.9° | 0.4° |
| N23 | C15 | C16 | H16 | 178.4° | 180.0° |
| C15 | N23 | C22 | C17 | 0.1° | 0.0° |
| C15 | N23 | C22 | C21 | 180.0° | 180.0° |
| C15 | N23 | C22 | H23 | 179.5° | 180.0° |
| C16 | C17 | C18 | C22 | 176.8° | 179.6° |
| C16 | C17 | C18 | C19 | 178.1° | 179.7° |
| C16 | C17 | C18 | H18 | 1.8° | 0.3° |
| C16 | C17 | C22 | C21 | 179.5° | 179.7° |
| C16 | C17 | C22 | N23 | 0.4° | 0.2° |
| H16 | C16 | C17 | C18 | 4.5° | 0.3° |
| H16 | C16 | C17 | C22 | 178.4° | 180.0° |
| C17 | C18 | C19 | H18 | 179.9° | 180.0° |
| C17 | C18 | C19 | C20 | 2.2° | 0.0° |
| C17 | C18 | C19 | O24 | 178.4° | 180.0° |
| C18 | C17 | C22 | C21 | 2.8° | 0.0° |
| C18 | C17 | C22 | N23 | 177.3° | 180.0° |
| C22 | C17 | C18 | C19 | 1.3° | 0.0° |
| C22 | C17 | C18 | H18 | 178.6° | 180.0° |
| C17 | C22 | C21 | C20 | 0.8° | 0.1° |
| C17 | C22 | C21 | N23 | 179.9° | 179.9° |
| C17 | C22 | C21 | O28 | 178.7° | 180.0° |
| C17 | C22 | N23 | H23 | 179.7° | 180.0° |
| C18 | C19 | C20 | O24 | 179.4° | 180.0° |
| C18 | C19 | C20 | C21 | 4.2° | 0.1° |
| C18 | C19 | C20 | O26 | 175.7° | 180.0° |
| C18 | C19 | O24 | C25 | 30.3° | 0.0° |
| H18 | C18 | C19 | C20 | 177.9° | 180.0° |
| H18 | C18 | C19 | O24 | 1.5° | 0.0° |
| C19 | C20 | C21 | O26 | 179.9° | 179.9° |
| C19 | C20 | C21 | C22 | 2.8° | 0.1° |
| C19 | C20 | C21 | O28 | 177.7° | 180.0° |
| C20 | C19 | O24 | C25 | 150.2° | 180.0° |
| C19 | C20 | O26 | C27 | 80.2° | 85.2° |
| O24 | C19 | C20 | C21 | 176.4° | 179.9° |
| O24 | C19 | C20 | O26 | 3.8° | 0.0° |
| C19 | O24 | C25 | H251 | 167.0° | 179.9° |
| C19 | O24 | C25 | H252 | 51.1° | 60.0° |
| C19 | O24 | C25 | H253 | 70.0° | 60.0° |
| C20 | C21 | C22 | O28 | 179.5° | 179.9° |
| C20 | C21 | C22 | N23 | 179.3° | 180.0° |
| C21 | C20 | O26 | C27 | 99.9° | 94.7° |
| C20 | C21 | O28 | C29 | 98.7° | 94.9° |
| O26 | C20 | C21 | C22 | 177.1° | 179.9° |
| O26 | C20 | C21 | O28 | 2.4° | 0.1° |
| C20 | O26 | C27 | H271 | 172.6° | 175.0° |
| C20 | O26 | C27 | H272 | 52.4° | 65.0° |
| C20 | O26 | C27 | H273 | 67.9° | 55.1° |
| C21 | C22 | N23 | H23 | 0.5° | 0.1° |
| C22 | C21 | O28 | C29 | 81.8° | 84.9° |
| O28 | C21 | C22 | N23 | 1.2° | 0.1° |
| C21 | O28 | C29 | H291 | 69.9° | 175.0° |
| C21 | O28 | C29 | H292 | 170.0° | 55.0° |
| C21 | O28 | C29 | H293 | 49.9° | 64.9° |
| O24 | C25 | H251 | H252 | 118.8° | 120.0° |
| O24 | C25 | H251 | H253 | 126.5° | 120.0° |
| O24 | C25 | H252 | H253 | 125.6° | 120.0° |
| H251 | C25 | H252 | H253 | 115.8° | 120.0° |
| O26 | C27 | H271 | H272 | 121.3° | 120.0° |
| O26 | C27 | H271 | H273 | 118.8° | 120.0° |
| O26 | C27 | H272 | H273 | 119.6° | 120.1° |
| H271 | C27 | H272 | H273 | 120.1° | 119.9° |
| O28 | C29 | H291 | H292 | 120.6° | 120.0° |
| O28 | C29 | H291 | H293 | 119.3° | 120.0° |
| O28 | C29 | H292 | H293 | 120.0° | 120.0° |
| H291 | C29 | H292 | H293 | 120.3° | 120.0° |
| H331 | C33 | H332 | H333 | 120.5° | 120.0° |
| O35 | C34 | O36 | C37 | 80.5° | 0.0° |
| C34 | O36 | C37 | H371 | 156.2° | 180.0° |
| C34 | O36 | C37 | H372 | 83.2° | 60.0° |
| C34 | O36 | C37 | H373 | 37.5° | 60.0° |
| O36 | C37 | H371 | H372 | 121.4° | 120.1° |
| O36 | C37 | H371 | H373 | 119.9° | 120.0° |
| O36 | C37 | H372 | H373 | 120.8° | 120.0° |
| H371 | C37 | H372 | H373 | 117.6° | 120.0° |
