897
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N3 | C9 | sing | 1.38Å | 1.38Å | |
| C9 | C10 | sing | 1.40Å | 1.40Å | |
| C10 | C11 | doub | 1.39Å | 1.39Å | |
| C11 | N4 | sing | 1.35Å | 1.36Å | |
| N4 | C12 | doub | 1.35Å | 1.34Å | |
| C9 | C13 | doub | 1.40Å | 1.42Å | |
| C12 | C13 | sing | 1.39Å | 1.40Å | |
| C7 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | O3 | sing | 1.43Å | 1.46Å | |
| O3 | C14 | sing | 1.36Å | 1.37Å | |
| C14 | C15 | sing | 1.40Å | 1.38Å | |
| C15 | C19 | doub | 1.40Å | 1.43Å | |
| C19 | C20 | sing | 1.49Å | 1.47Å | |
| C19 | C18 | sing | 1.40Å | 1.41Å | |
| C14 | C16 | doub | 1.39Å | 1.41Å | |
| C18 | C17 | doub | 1.39Å | 1.33Å | |
| C16 | C17 | sing | 1.39Å | 1.42Å | |
| C17 | C21 | sing | 1.47Å | 1.49Å | |
| C21 | O2 | doub | 1.23Å | 1.29Å | |
| C21 | N2 | sing | 1.41Å | 1.34Å | |
| N2 | C22 | sing | 1.47Å | 1.47Å | |
| C22 | C23 | sing | 1.52Å | 1.54Å | |
| C22 | C24 | sing | 1.52Å | 1.53Å | |
| N2 | C6 | sing | 1.44Å | 1.48Å | |
| C6 | C5 | sing | 1.52Å | 1.44Å | |
| C5 | C4 | sing | 1.52Å | 1.42Å | |
| C4 | O1 | doub | 1.23Å | 1.20Å | |
| C4 | N1 | sing | 1.39Å | 1.31Å | |
| N1 | C3 | sing | 1.44Å | 1.50Å | |
| C3 | C25 | sing | 1.53Å | 1.54Å | |
| C3 | C26 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | sing | 1.53Å | 1.59Å | |
| C8 | H8C1 | sing | 1.10Å | 1.10Å | |
| C8 | H8C2 | sing | 1.10Å | 1.10Å | |
| C8 | H8C3 | sing | 1.10Å | 1.10Å | |
| C7 | H7 | sing | 1.10Å | 1.10Å | |
| N3 | H3 | sing | 1.01Å | 1.00Å | |
| C1 | H1C1 | sing | 1.10Å | 1.10Å | |
| C1 | H1C2 | sing | 1.10Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.09Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.08Å | |
| C15 | H15 | sing | 1.09Å | 1.08Å | |
| C16 | H16 | sing | 1.09Å | 1.08Å | |
| C20 | H201 | sing | 1.10Å | 1.10Å | |
| C20 | H202 | sing | 1.10Å | 1.10Å | |
| C20 | H203 | sing | 1.10Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.08Å | |
| C22 | H22 | sing | 1.10Å | 1.10Å | |
| C6 | H6C1 | sing | 1.10Å | 1.10Å | |
| C6 | H6C2 | sing | 1.10Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.10Å | 1.10Å | |
| C23 | H233 | sing | 1.10Å | 1.10Å | |
| C24 | H241 | sing | 1.10Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.10Å | 1.10Å | |
| C5 | H5C1 | sing | 1.10Å | 1.10Å | |
| C5 | H5C2 | sing | 1.10Å | 1.10Å | |
| N1 | H1 | sing | 1.02Å | 1.00Å | |
| C25 | H251 | sing | 1.10Å | 1.10Å | |
| C25 | H252 | sing | 1.10Å | 1.10Å | |
| C25 | H253 | sing | 1.10Å | 1.10Å | |
| C26 | H261 | sing | 1.10Å | 1.10Å | |
| C26 | H262 | sing | 1.10Å | 1.10Å | |
| C26 | H263 | sing | 1.10Å | 1.10Å | |
| C2 | H2C1 | sing | 1.10Å | 1.10Å | |
| C8 | C7 | sing | 1.52Å | 1.56Å | |
| C7 | N3 | sing | 1.45Å | 1.43Å | |
| C2 | H2C2 | sing | 1.10Å | 1.10Å | |
| C2 | H2C3 | sing | 1.10Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N3 | C9 | C10 | 116.5° | 121.1° |
| N3 | C9 | C13 | 123.3° | 121.1° |
| C9 | N3 | H3 | 105.1° | 118.7° |
| C9 | N3 | C7 | 123.3° | 123.5° |
| C9 | C10 | C11 | 123.0° | 118.9° |
| C10 | C9 | C13 | 120.3° | 117.9° |
| C9 | C10 | H10 | 118.5° | 120.7° |
| C10 | C11 | N4 | 112.0° | 124.0° |
| C11 | C10 | H10 | 118.5° | 120.5° |
| C10 | C11 | H11 | 124.0° | 120.8° |
| C11 | N4 | C12 | 130.1° | 116.4° |
| N4 | C11 | H11 | 124.0° | 115.2° |
| N4 | C12 | C13 | 117.5° | 124.1° |
| N4 | C12 | H12 | 121.2° | 115.2° |
| C9 | C13 | C12 | 116.8° | 118.8° |
| C9 | C13 | H13 | 121.6° | 120.7° |
| C12 | C13 | H13 | 121.6° | 120.5° |
| C13 | C12 | H12 | 121.3° | 120.7° |
| C7 | C1 | O3 | 103.8° | 109.4° |
| C1 | C7 | H7 | 110.2° | 109.5° |
| C7 | C1 | H1C1 | 111.4° | 110.6° |
| C7 | C1 | H1C2 | 112.6° | 111.7° |
| C1 | C7 | C8 | 107.5° | 111.3° |
| C1 | C7 | N3 | 111.0° | 109.6° |
| C1 | O3 | C14 | 115.1° | 117.1° |
| O3 | C1 | H1C1 | 111.4° | 107.8° |
| O3 | C1 | H1C2 | 112.6° | 108.5° |
| O3 | C14 | C15 | 125.5° | 119.9° |
| O3 | C14 | C16 | 115.5° | 120.0° |
| C14 | C15 | C19 | 123.2° | 120.0° |
| C15 | C14 | C16 | 118.9° | 120.0° |
| C14 | C15 | H15 | 118.4° | 119.9° |
| C15 | C19 | C20 | 121.2° | 120.0° |
| C15 | C19 | C18 | 114.6° | 120.0° |
| C19 | C15 | H15 | 118.4° | 120.2° |
| C20 | C19 | C18 | 124.1° | 120.0° |
| C19 | C20 | H201 | 109.5° | 110.4° |
| C19 | C20 | H202 | 109.5° | 111.3° |
| C19 | C20 | H203 | 109.5° | 111.3° |
| C19 | C18 | C17 | 124.5° | 119.4° |
| C19 | C18 | H18 | 117.7° | 119.9° |
| C14 | C16 | C17 | 119.0° | 119.4° |
| C14 | C16 | H16 | 120.5° | 119.8° |
| C18 | C17 | C16 | 119.7° | 121.2° |
| C18 | C17 | C21 | 123.6° | 119.4° |
| C17 | C18 | H18 | 117.8° | 120.7° |
| C16 | C17 | C21 | 116.5° | 119.4° |
| C17 | C16 | H16 | 120.5° | 120.8° |
| C17 | C21 | O2 | 115.1° | 116.3° |
| C17 | C21 | N2 | 121.5° | 118.8° |
| O2 | C21 | N2 | 122.7° | 124.9° |
| C21 | N2 | C22 | 122.5° | 124.0° |
| C21 | N2 | C6 | 117.1° | 119.9° |
| N2 | C22 | C23 | 110.1° | 109.1° |
| N2 | C22 | C24 | 111.9° | 108.9° |
| C22 | N2 | C6 | 119.9° | 116.1° |
| N2 | C22 | H22 | 108.3° | 108.0° |
| C23 | C22 | C24 | 112.2° | 111.7° |
| C23 | C22 | H22 | 108.0° | 109.6° |
| C22 | C23 | H231 | 109.5° | 110.8° |
| C22 | C23 | H232 | 109.5° | 111.5° |
| C22 | C23 | H233 | 109.5° | 110.8° |
| C24 | C22 | H22 | 106.0° | 109.5° |
| C22 | C24 | H241 | 109.5° | 110.7° |
| C22 | C24 | H242 | 109.5° | 110.9° |
| C22 | C24 | H243 | 109.5° | 111.5° |
| N2 | C6 | C5 | 111.7° | 109.8° |
| N2 | C6 | H6C1 | 108.7° | 109.3° |
| N2 | C6 | H6C2 | 108.2° | 109.3° |
| C6 | C5 | C4 | 112.4° | 112.5° |
| C5 | C6 | H6C1 | 108.7° | 110.6° |
| C5 | C6 | H6C2 | 108.2° | 110.5° |
| C6 | C5 | H5C1 | 108.5° | 110.0° |
| C6 | C5 | H5C2 | 107.9° | 110.0° |
| C5 | C4 | O1 | 122.5° | 123.2° |
| C5 | C4 | N1 | 119.8° | 111.6° |
| C4 | C5 | H5C1 | 108.5° | 108.3° |
| C4 | C5 | H5C2 | 107.8° | 108.4° |
| O1 | C4 | N1 | 117.6° | 125.2° |
| C4 | N1 | C3 | 129.8° | 122.9° |
| C4 | N1 | H1 | 115.1° | 118.6° |
| N1 | C3 | C25 | 108.1° | 109.3° |
| N1 | C3 | C26 | 108.4° | 109.1° |
| N1 | C3 | C2 | 107.2° | 109.3° |
| C3 | N1 | H1 | 115.1° | 118.5° |
| C25 | C3 | C26 | 108.4° | 109.8° |
| C25 | C3 | C2 | 112.2° | 109.5° |
| C3 | C25 | H251 | 109.5° | 111.2° |
| C3 | C25 | H252 | 109.5° | 111.3° |
| C3 | C25 | H253 | 109.5° | 111.1° |
| C26 | C3 | C2 | 112.3° | 109.8° |
| C3 | C26 | H261 | 109.5° | 111.1° |
| C3 | C26 | H262 | 109.5° | 111.1° |
| C3 | C26 | H263 | 109.4° | 111.3° |
| C3 | C2 | H2C1 | 109.5° | 111.1° |
| C3 | C2 | H2C2 | 109.5° | 111.4° |
| C3 | C2 | H2C3 | 109.5° | 111.1° |
| H8C1 | C8 | H8C2 | 109.4° | 108.1° |
| H8C1 | C8 | H8C3 | 109.5° | 107.9° |
| H8C1 | C8 | C7 | 109.5° | 110.9° |
| H8C2 | C8 | H8C3 | 109.5° | 107.5° |
| H8C2 | C8 | C7 | 109.5° | 111.4° |
| H8C3 | C8 | C7 | 109.4° | 110.8° |
| H7 | C7 | C8 | 110.6° | 109.6° |
| H7 | C7 | N3 | 107.1° | 108.0° |
| H3 | N3 | C7 | 105.1° | 117.8° |
| H1C1 | C1 | H1C2 | 105.2° | 108.7° |
| H201 | C20 | H202 | 109.5° | 108.5° |
| H201 | C20 | H203 | 109.5° | 108.5° |
| H202 | C20 | H203 | 109.5° | 106.8° |
| H6C1 | C6 | H6C2 | 111.3° | 107.3° |
| H231 | C23 | H232 | 109.4° | 108.1° |
| H231 | C23 | H233 | 109.5° | 108.0° |
| H232 | C23 | H233 | 109.5° | 107.4° |
| H241 | C24 | H242 | 109.5° | 108.0° |
| H241 | C24 | H243 | 109.5° | 107.5° |
| H242 | C24 | H243 | 109.5° | 108.2° |
| H5C1 | C5 | H5C2 | 111.8° | 107.4° |
| H251 | C25 | H252 | 109.4° | 107.9° |
| H251 | C25 | H253 | 109.4° | 107.2° |
| H252 | C25 | H253 | 109.5° | 108.0° |
| H261 | C26 | H262 | 109.4° | 107.2° |
| H261 | C26 | H263 | 109.5° | 107.9° |
| H262 | C26 | H263 | 109.5° | 108.0° |
| H2C1 | C2 | H2C2 | 109.4° | 108.0° |
| H2C1 | C2 | H2C3 | 109.4° | 107.2° |
| C8 | C7 | N3 | 110.5° | 108.8° |
| H2C2 | C2 | H2C3 | 109.5° | 107.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N3 | C9 | C10 | C13 | 179.9° | 179.9° |
| N3 | C9 | C10 | C11 | 178.7° | 180.0° |
| N3 | C9 | C13 | C12 | 177.2° | 180.0° |
| C9 | N3 | C7 | C1 | 158.2° | 159.3° |
| C9 | N3 | C7 | H7 | 37.9° | 40.0° |
| C9 | N3 | H3 | C7 | 131.4° | 179.9° |
| N3 | C9 | C10 | H10 | 1.3° | 0.0° |
| N3 | C9 | C13 | H13 | 2.8° | 0.1° |
| C9 | N3 | C7 | C8 | 82.6° | 78.9° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | N4 | 1.4° | 0.1° |
| C10 | C9 | C13 | C12 | 2.7° | 0.0° |
| C10 | C9 | N3 | H3 | 57.6° | 0.0° |
| C10 | C9 | C13 | H13 | 177.3° | 180.0° |
| C9 | C10 | C11 | H11 | 178.6° | 179.9° |
| C10 | C9 | N3 | C7 | 177.6° | 179.9° |
| C10 | C11 | N4 | H11 | 180.0° | 179.9° |
| C10 | C11 | N4 | C12 | 3.2° | 0.1° |
| C11 | C10 | C9 | C13 | 1.4° | 0.0° |
| C11 | N4 | C12 | C13 | 7.4° | 0.0° |
| N4 | C11 | C10 | H10 | 178.6° | 179.9° |
| C11 | N4 | C12 | H12 | 172.6° | 180.0° |
| N4 | C12 | C13 | C9 | 6.5° | 0.0° |
| N4 | C12 | C13 | H12 | 180.0° | 179.9° |
| N4 | C12 | C13 | H13 | 173.5° | 180.0° |
| C12 | N4 | C11 | H11 | 176.8° | 179.9° |
| C9 | C13 | C12 | H13 | 180.0° | 180.0° |
| C13 | C9 | N3 | H3 | 122.5° | 179.9° |
| C13 | C9 | C10 | H10 | 178.6° | 179.9° |
| C9 | C13 | C12 | H12 | 173.5° | 180.0° |
| C13 | C9 | N3 | C7 | 2.5° | 0.2° |
| C7 | C1 | O3 | H1C1 | 120.0° | 120.3° |
| C7 | C1 | O3 | H1C2 | 122.1° | 122.1° |
| C7 | C1 | O3 | C14 | 173.7° | 149.7° |
| C1 | C7 | C8 | H8C1 | 176.6° | 60.7° |
| C1 | C7 | C8 | H8C2 | 63.4° | 59.8° |
| C1 | C7 | C8 | H8C3 | 56.6° | 179.5° |
| C1 | C7 | H7 | C8 | 118.7° | 122.3° |
| C1 | C7 | H7 | N3 | 120.8° | 119.3° |
| C1 | C7 | N3 | H3 | 81.8° | 20.6° |
| C7 | C1 | H1C1 | H1C2 | 122.3° | 123.0° |
| C1 | C7 | C8 | N3 | 121.3° | 120.8° |
| C1 | O3 | C14 | C15 | 17.3° | 149.9° |
| C1 | O3 | C14 | C16 | 164.0° | 29.9° |
| O3 | C1 | C7 | H7 | 43.2° | 57.3° |
| O3 | C1 | H1C1 | H1C2 | 122.3° | 117.4° |
| O3 | C1 | C7 | C8 | 163.8° | 178.6° |
| O3 | C1 | C7 | N3 | 75.2° | 61.1° |
| O3 | C14 | C15 | C16 | 178.6° | 179.9° |
| O3 | C14 | C15 | C19 | 177.5° | 180.0° |
| O3 | C14 | C16 | C17 | 176.8° | 180.0° |
| C14 | O3 | C1 | H1C1 | 53.7° | 90.0° |
| C14 | O3 | C1 | H1C2 | 64.2° | 27.6° |
| O3 | C14 | C15 | H15 | 2.5° | 0.1° |
| O3 | C14 | C16 | H16 | 3.3° | 0.1° |
| C14 | C15 | C19 | H15 | 180.0° | 180.0° |
| C14 | C15 | C19 | C20 | 179.7° | 180.0° |
| C14 | C15 | C19 | C18 | 0.6° | 0.1° |
| C15 | C14 | C16 | C17 | 2.0° | 0.1° |
| C15 | C14 | C16 | H16 | 178.0° | 180.0° |
| C15 | C19 | C20 | C18 | 179.0° | 179.9° |
| C19 | C15 | C14 | C16 | 1.1° | 0.1° |
| C15 | C19 | C18 | C17 | 1.2° | 0.1° |
| C15 | C19 | C20 | H201 | 36.0° | 87.7° |
| C15 | C19 | C20 | H202 | 84.0° | 151.8° |
| C15 | C19 | C20 | H203 | 156.0° | 32.8° |
| C15 | C19 | C18 | H18 | 178.8° | 180.0° |
| C20 | C19 | C18 | C17 | 179.8° | 180.0° |
| C20 | C19 | C15 | H15 | 0.3° | 0.0° |
| C19 | C20 | H201 | H202 | 120.0° | 122.2° |
| C19 | C20 | H201 | H203 | 120.0° | 122.2° |
| C19 | C20 | H202 | H203 | 120.0° | 121.6° |
| C20 | C19 | C18 | H18 | 0.2° | 0.0° |
| C19 | C18 | C17 | H18 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 2.2° | 0.1° |
| C19 | C18 | C17 | C21 | 177.2° | 180.0° |
| C18 | C19 | C15 | H15 | 179.4° | 179.9° |
| C18 | C19 | C20 | H201 | 142.9° | 92.4° |
| C18 | C19 | C20 | H202 | 97.1° | 28.1° |
| C18 | C19 | C20 | H203 | 22.9° | 147.1° |
| C14 | C16 | C17 | C18 | 2.5° | 0.1° |
| C14 | C16 | C17 | H16 | 180.0° | 180.0° |
| C14 | C16 | C17 | C21 | 177.8° | 180.0° |
| C16 | C14 | C15 | H15 | 178.9° | 180.0° |
| C18 | C17 | C16 | C21 | 175.3° | 179.9° |
| C18 | C17 | C21 | O2 | 113.4° | 89.3° |
| C18 | C17 | C21 | N2 | 57.3° | 90.0° |
| C18 | C17 | C16 | H16 | 177.4° | 180.0° |
| C16 | C17 | C21 | O2 | 61.7° | 90.8° |
| C16 | C17 | C21 | N2 | 127.6° | 89.9° |
| C16 | C17 | C18 | H18 | 177.8° | 180.0° |
| C17 | C21 | O2 | N2 | 170.6° | 179.2° |
| C17 | C21 | N2 | C22 | 20.1° | 179.1° |
| C17 | C21 | N2 | C6 | 167.7° | 0.8° |
| C21 | C17 | C16 | H16 | 2.1° | 0.1° |
| C21 | C17 | C18 | H18 | 2.8° | 0.1° |
| O2 | C21 | N2 | C22 | 169.9° | 0.1° |
| O2 | C21 | N2 | C6 | 2.3° | 180.0° |
| C21 | N2 | C22 | C6 | 172.0° | 179.9° |
| C21 | N2 | C22 | C23 | 108.2° | 61.0° |
| C21 | N2 | C22 | C24 | 126.3° | 61.2° |
| C21 | N2 | C6 | C5 | 77.6° | 90.0° |
| C21 | N2 | C22 | H22 | 9.7° | 180.0° |
| C21 | N2 | C6 | H6C1 | 162.4° | 31.4° |
| C21 | N2 | C6 | H6C2 | 41.4° | 148.6° |
| N2 | C22 | C23 | C24 | 125.4° | 120.4° |
| N2 | C22 | C23 | H22 | 118.1° | 118.0° |
| N2 | C22 | C24 | H22 | 117.9° | 117.9° |
| C22 | N2 | C6 | C5 | 109.9° | 90.1° |
| C22 | N2 | C6 | H6C1 | 10.0° | 148.5° |
| C22 | N2 | C6 | H6C2 | 131.0° | 31.4° |
| N2 | C22 | C23 | H231 | 150.1° | 179.1° |
| N2 | C22 | C23 | H232 | 30.1° | 60.4° |
| N2 | C22 | C23 | H233 | 89.9° | 59.1° |
| N2 | C22 | C24 | H241 | 73.5° | 59.0° |
| N2 | C22 | C24 | H242 | 166.5° | 178.8° |
| N2 | C22 | C24 | H243 | 46.5° | 60.7° |
| C23 | C22 | C24 | H22 | 117.7° | 121.6° |
| C23 | C22 | N2 | C6 | 63.9° | 119.1° |
| C22 | C23 | H231 | H232 | 120.0° | 122.5° |
| C22 | C23 | H231 | H233 | 120.0° | 121.5° |
| C22 | C23 | H232 | H233 | 120.0° | 121.5° |
| C23 | C22 | C24 | H241 | 162.0° | 179.5° |
| C23 | C22 | C24 | H242 | 42.0° | 60.6° |
| C23 | C22 | C24 | H243 | 78.0° | 59.9° |
| C24 | C22 | N2 | C6 | 61.7° | 118.7° |
| C24 | C22 | C23 | H231 | 84.5° | 60.5° |
| C24 | C22 | C23 | H232 | 155.5° | 60.0° |
| C24 | C22 | C23 | H233 | 35.5° | 179.6° |
| C22 | C24 | H241 | H242 | 120.0° | 121.6° |
| C22 | C24 | H241 | H243 | 120.0° | 122.0° |
| C22 | C24 | H242 | H243 | 120.0° | 122.5° |
| N2 | C6 | C5 | H6C1 | 120.0° | 120.6° |
| N2 | C6 | C5 | H6C2 | 119.0° | 120.7° |
| N2 | C6 | C5 | C4 | 178.9° | 179.4° |
| C6 | N2 | C22 | H22 | 178.2° | 0.1° |
| N2 | C6 | H6C1 | H6C2 | 119.1° | 118.4° |
| N2 | C6 | C5 | H5C1 | 58.9° | 59.7° |
| N2 | C6 | C5 | H5C2 | 62.4° | 58.4° |
| C6 | C5 | C4 | H5C1 | 120.0° | 121.9° |
| C6 | C5 | C4 | H5C2 | 118.8° | 121.9° |
| C6 | C5 | C4 | O1 | 75.5° | 0.0° |
| C6 | C5 | C4 | N1 | 101.1° | 180.0° |
| C5 | C6 | H6C1 | H6C2 | 119.1° | 120.6° |
| C6 | C5 | H5C1 | H5C2 | 118.8° | 119.8° |
| C5 | C4 | O1 | N1 | 176.7° | 180.0° |
| C5 | C4 | N1 | C3 | 174.7° | 179.9° |
| C4 | C5 | C6 | H6C1 | 61.1° | 60.0° |
| C4 | C5 | C6 | H6C2 | 59.8° | 58.7° |
| C4 | C5 | H5C1 | H5C2 | 118.8° | 116.9° |
| C5 | C4 | N1 | H1 | 5.3° | 0.0° |
| O1 | C4 | N1 | C3 | 8.5° | 0.1° |
| O1 | C4 | C5 | H5C1 | 164.5° | 121.8° |
| O1 | C4 | C5 | H5C2 | 43.3° | 122.0° |
| O1 | C4 | N1 | H1 | 171.5° | 180.0° |
| C4 | N1 | C3 | H1 | 180.0° | 179.9° |
| C4 | N1 | C3 | C25 | 63.4° | 180.0° |
| C4 | N1 | C3 | C26 | 53.9° | 59.9° |
| C4 | N1 | C3 | C2 | 175.4° | 60.2° |
| N1 | C4 | C5 | H5C1 | 18.9° | 58.2° |
| N1 | C4 | C5 | H5C2 | 140.1° | 58.1° |
| N1 | C3 | C25 | C26 | 117.3° | 119.6° |
| N1 | C3 | C25 | C2 | 118.0° | 119.8° |
| N1 | C3 | C26 | C2 | 118.3° | 119.8° |
| N1 | C3 | C25 | H251 | 105.0° | 60.0° |
| N1 | C3 | C25 | H252 | 14.9° | 179.7° |
| N1 | C3 | C25 | H253 | 135.0° | 59.4° |
| N1 | C3 | C26 | H261 | 64.8° | 59.7° |
| N1 | C3 | C26 | H262 | 55.2° | 59.7° |
| N1 | C3 | C26 | H263 | 175.2° | 180.0° |
| N1 | C3 | C2 | H2C1 | 101.4° | 59.3° |
| N1 | C3 | C2 | H2C2 | 18.6° | 179.7° |
| N1 | C3 | C2 | H2C3 | 138.6° | 60.0° |
| C25 | C3 | C26 | C2 | 124.6° | 120.5° |
| C25 | C3 | N1 | H1 | 116.6° | 0.1° |
| C3 | C25 | H251 | H252 | 120.0° | 122.3° |
| C3 | C25 | H251 | H253 | 120.0° | 121.6° |
| C3 | C25 | H252 | H253 | 120.0° | 122.2° |
| C25 | C3 | C26 | H261 | 178.0° | 179.4° |
| C25 | C3 | C26 | H262 | 62.0° | 60.1° |
| C25 | C3 | C26 | H263 | 58.0° | 60.3° |
| C25 | C3 | C2 | H2C1 | 17.2° | 60.5° |
| C25 | C3 | C2 | H2C2 | 137.2° | 60.0° |
| C25 | C3 | C2 | H2C3 | 102.8° | 179.7° |
| C26 | C3 | N1 | H1 | 126.1° | 120.0° |
| C26 | C3 | C25 | H251 | 12.3° | 59.7° |
| C26 | C3 | C25 | H252 | 132.3° | 60.6° |
| C26 | C3 | C25 | H253 | 107.7° | 179.0° |
| C3 | C26 | H261 | H262 | 120.0° | 121.6° |
| C3 | C26 | H261 | H263 | 120.0° | 122.3° |
| C3 | C26 | H262 | H263 | 120.0° | 122.3° |
| C26 | C3 | C2 | H2C1 | 139.6° | 178.9° |
| C26 | C3 | C2 | H2C2 | 100.4° | 60.6° |
| C26 | C3 | C2 | H2C3 | 19.6° | 59.7° |
| C2 | C3 | N1 | H1 | 4.6° | 119.9° |
| C2 | C3 | C25 | H251 | 136.9° | 179.7° |
| C2 | C3 | C25 | H252 | 103.1° | 60.0° |
| C2 | C3 | C25 | H253 | 16.9° | 60.4° |
| C2 | C3 | C26 | H261 | 53.5° | 60.1° |
| C2 | C3 | C26 | H262 | 173.5° | 179.5° |
| C2 | C3 | C26 | H263 | 66.5° | 60.2° |
| C3 | C2 | H2C1 | H2C2 | 120.0° | 122.5° |
| C3 | C2 | H2C1 | H2C3 | 120.0° | 121.6° |
| C3 | C2 | H2C2 | H2C3 | 120.0° | 122.2° |
| H8C1 | C8 | H8C2 | H8C3 | 120.0° | 116.3° |
| H8C1 | C8 | H8C2 | C7 | 120.0° | 122.1° |
| H8C1 | C8 | H8C3 | C7 | 120.0° | 121.6° |
| H8C1 | C8 | C7 | H7 | 56.3° | 60.6° |
| H8C1 | C8 | C7 | N3 | 62.1° | 178.5° |
| H8C2 | C8 | H8C3 | C7 | 120.0° | 122.0° |
| H8C2 | C8 | C7 | H7 | 176.3° | 178.9° |
| H8C2 | C8 | C7 | N3 | 57.9° | 61.1° |
| H8C3 | C8 | C7 | H7 | 63.7° | 59.2° |
| H8C3 | C8 | C7 | N3 | 177.9° | 58.6° |
| H7 | C7 | N3 | H3 | 157.9° | 139.9° |
| H7 | C7 | C1 | H1C1 | 76.7° | 61.3° |
| H7 | C7 | C1 | H1C2 | 165.3° | 177.4° |
| H7 | C7 | C8 | N3 | 118.4° | 117.9° |
| H3 | N3 | C7 | C8 | 37.4° | 101.2° |
| H1C1 | C1 | C7 | C8 | 43.8° | 60.0° |
| H1C1 | C1 | C7 | N3 | 164.8° | 179.7° |
| H1C2 | C1 | C7 | C8 | 74.1° | 61.3° |
| H1C2 | C1 | C7 | N3 | 46.9° | 59.1° |
| H10 | C10 | C11 | H11 | 1.4° | 0.0° |
| H13 | C13 | C12 | H12 | 6.5° | 0.0° |
| H201 | C20 | H202 | H203 | 120.0° | 116.7° |
| H22 | C22 | C23 | H231 | 32.0° | 61.0° |
| H22 | C22 | C23 | H232 | 88.0° | 178.4° |
| H22 | C22 | C23 | H233 | 152.0° | 58.9° |
| H22 | C22 | C24 | H241 | 44.4° | 58.9° |
| H22 | C22 | C24 | H242 | 75.6° | 61.0° |
| H22 | C22 | C24 | H243 | 164.4° | 178.5° |
| H6C1 | C6 | C5 | H5C1 | 178.9° | 60.9° |
| H6C1 | C6 | C5 | H5C2 | 57.6° | 179.0° |
| H6C2 | C6 | C5 | H5C1 | 60.1° | 179.6° |
| H6C2 | C6 | C5 | H5C2 | 178.6° | 62.3° |
| H231 | C23 | H232 | H233 | 120.0° | 116.4° |
| H241 | C24 | H242 | H243 | 120.0° | 116.1° |
| H251 | C25 | H252 | H253 | 119.9° | 115.5° |
| H261 | C26 | H262 | H263 | 120.0° | 116.0° |
| H2C1 | C2 | H2C2 | H2C3 | 120.0° | 115.5° |
