V38
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N | C10 | sing | 1.49Å | 1.46Å | |
| N | C11 | sing | 1.49Å | 1.48Å | |
| N | C15 | sing | 1.47Å | 1.47Å | |
| N | C23 | sing | 1.47Å | 1.47Å | |
| C1 | O1 | sing | 1.35Å | 1.46Å | |
| C1 | C2 | sing | 1.48Å | 1.50Å | |
| C1 | O2 | doub | 1.21Å | 1.23Å | |
| O1 | C8 | sing | 1.45Å | 1.42Å | |
| C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C2 | C7 | sing | 1.40Å | 1.41Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| O3 | C16 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | C12 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.54Å | 1.53Å | |
| C10 | C14 | sing | 1.55Å | 1.52Å | |
| C11 | C12 | sing | 1.54Å | 1.53Å | |
| C11 | C13 | sing | 1.55Å | 1.52Å | |
| C13 | C14 | sing | 1.54Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | sing | 1.51Å | 1.47Å | |
| C17 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C9 | H91C | sing | 1.09Å | 1.10Å | |
| C9 | H92C | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| O3 | HA | sing | 0.97Å | 0.95Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | N | C11 | 102.9° | 103.5° |
| C10 | N | C15 | 111.6° | 110.7° |
| C10 | N | C23 | 109.6° | 110.6° |
| N | C10 | C9 | 108.3° | 107.2° |
| N | C10 | C14 | 105.0° | 104.3° |
| N | C10 | H10 | 112.3° | 112.3° |
| C11 | N | C15 | 115.2° | 110.6° |
| C11 | N | C23 | 110.1° | 110.6° |
| N | C11 | C12 | 110.9° | 107.2° |
| N | C11 | C13 | 104.5° | 104.2° |
| N | C11 | H11 | 110.7° | 112.8° |
| C15 | N | C23 | 107.3° | 110.7° |
| N | C15 | C16 | 108.4° | 109.5° |
| N | C15 | H151 | 109.9° | 109.5° |
| N | C15 | H152 | 110.1° | 109.4° |
| N | C23 | H231 | 109.5° | 109.4° |
| N | C23 | H232 | 109.5° | 109.5° |
| N | C23 | H233 | 109.5° | 109.5° |
| O1 | C1 | C2 | 115.1° | 120.1° |
| O1 | C1 | O2 | 123.1° | 120.0° |
| C1 | O1 | C8 | 117.7° | 117.1° |
| C2 | C1 | O2 | 121.7° | 120.0° |
| C1 | C2 | C3 | 121.0° | 120.2° |
| C1 | C2 | C7 | 119.1° | 120.1° |
| O1 | C8 | C9 | 107.2° | 109.4° |
| O1 | C8 | C12 | 112.7° | 109.4° |
| O1 | C8 | H8 | 110.7° | 109.4° |
| C3 | C2 | C7 | 119.8° | 119.7° |
| C2 | C3 | C4 | 119.2° | 119.8° |
| C2 | C3 | H3 | 120.4° | 120.1° |
| C2 | C7 | C6 | 120.8° | 119.8° |
| C2 | C7 | H7 | 119.6° | 120.1° |
| C3 | C4 | C5 | 120.8° | 120.2° |
| C4 | C3 | H3 | 120.4° | 120.1° |
| C3 | C4 | H4 | 119.6° | 119.9° |
| O3 | C16 | C15 | 108.6° | 109.5° |
| O3 | C16 | C17 | 109.5° | 109.5° |
| O3 | C16 | H16 | 110.0° | 109.4° |
| C16 | O3 | HA | 109.5° | 114.0° |
| C4 | C5 | C6 | 120.2° | 120.3° |
| C4 | C5 | H5 | 119.9° | 119.8° |
| C5 | C4 | H4 | 119.6° | 119.9° |
| C5 | C6 | C7 | 119.2° | 120.2° |
| C5 | C6 | H6 | 120.4° | 120.0° |
| C6 | C5 | H5 | 119.9° | 119.9° |
| C6 | C7 | H7 | 119.6° | 120.1° |
| C7 | C6 | H6 | 120.4° | 119.9° |
| C9 | C8 | C12 | 114.3° | 109.8° |
| C8 | C9 | C10 | 115.8° | 108.9° |
| C9 | C8 | H8 | 109.0° | 109.4° |
| C8 | C9 | H91C | 107.4° | 109.6° |
| C8 | C9 | H92C | 106.0° | 109.6° |
| C8 | C12 | C11 | 113.2° | 108.9° |
| C12 | C8 | H8 | 103.0° | 109.4° |
| C8 | C12 | H121 | 108.3° | 109.5° |
| C8 | C12 | H122 | 107.4° | 109.6° |
| C9 | C10 | C14 | 106.9° | 107.8° |
| C10 | C9 | H91C | 107.4° | 109.6° |
| C10 | C9 | H92C | 105.9° | 109.6° |
| C9 | C10 | H10 | 110.5° | 112.6° |
| C10 | C14 | C13 | 104.3° | 104.8° |
| C10 | C14 | H141 | 111.2° | 110.4° |
| C10 | C14 | H142 | 112.3° | 110.5° |
| C14 | C10 | H10 | 113.5° | 112.2° |
| C12 | C11 | C13 | 106.1° | 107.8° |
| C11 | C12 | H121 | 108.2° | 109.6° |
| C11 | C12 | H122 | 107.4° | 109.7° |
| C12 | C11 | H11 | 109.3° | 112.1° |
| C11 | C13 | C14 | 105.3° | 104.8° |
| C13 | C11 | H11 | 115.2° | 112.2° |
| C11 | C13 | H131 | 110.9° | 110.4° |
| C11 | C13 | H132 | 111.8° | 110.3° |
| C14 | C13 | H131 | 110.9° | 110.4° |
| C14 | C13 | H132 | 111.8° | 110.4° |
| C13 | C14 | H141 | 111.2° | 110.3° |
| C13 | C14 | H142 | 112.4° | 110.4° |
| C15 | C16 | C17 | 109.3° | 109.5° |
| C16 | C15 | H151 | 109.8° | 109.5° |
| C16 | C15 | H152 | 110.1° | 109.5° |
| C15 | C16 | H16 | 110.2° | 109.4° |
| C16 | C17 | C18 | 119.6° | 120.0° |
| C16 | C17 | C22 | 118.9° | 120.0° |
| C17 | C16 | H16 | 109.3° | 109.5° |
| C18 | C17 | C22 | 121.5° | 120.0° |
| C17 | C18 | C19 | 118.1° | 120.0° |
| C17 | C18 | H18 | 121.0° | 120.0° |
| C17 | C22 | C21 | 120.5° | 120.0° |
| C17 | C22 | H22 | 119.8° | 120.0° |
| C18 | C19 | C20 | 120.7° | 120.0° |
| C19 | C18 | H18 | 121.0° | 120.0° |
| C18 | C19 | H19 | 119.7° | 120.0° |
| C19 | C20 | C21 | 120.9° | 120.0° |
| C19 | C20 | H20 | 119.5° | 120.0° |
| C20 | C19 | H19 | 119.6° | 120.0° |
| C20 | C21 | C22 | 118.4° | 120.0° |
| C20 | C21 | H21 | 120.8° | 119.9° |
| C21 | C20 | H20 | 119.5° | 120.0° |
| C21 | C22 | H22 | 119.8° | 120.0° |
| C22 | C21 | H21 | 120.8° | 120.0° |
| H121 | C12 | H122 | 112.5° | 109.6° |
| H91C | C9 | H92C | 114.6° | 109.7° |
| H131 | C13 | H132 | 106.3° | 110.5° |
| H141 | C14 | H142 | 105.6° | 110.3° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H231 | C23 | H233 | 109.5° | 109.5° |
| H232 | C23 | H233 | 109.5° | 109.5° |
| H151 | C15 | H152 | 108.6° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | N | C11 | C15 | 121.7° | 118.5° |
| C10 | N | C11 | C23 | 116.8° | 118.4° |
| C10 | N | C15 | C23 | 120.1° | 123.0° |
| N | C10 | C9 | C8 | 51.7° | 64.1° |
| N | C10 | C9 | C14 | 112.6° | 111.7° |
| N | C10 | C9 | H10 | 123.4° | 124.0° |
| N | C10 | C14 | H10 | 123.0° | 121.8° |
| C10 | N | C11 | C12 | 73.7° | 72.6° |
| C10 | N | C11 | C13 | 40.2° | 41.6° |
| N | C10 | C14 | C13 | 26.8° | 25.1° |
| C10 | N | C15 | C16 | 174.3° | 175.6° |
| N | C10 | C9 | H91C | 171.7° | 176.1° |
| N | C10 | C9 | H92C | 65.4° | 55.7° |
| C10 | N | C11 | H11 | 164.9° | 163.5° |
| N | C10 | C14 | H141 | 146.8° | 93.7° |
| N | C10 | C14 | H142 | 95.1° | 144.0° |
| C10 | N | C23 | H231 | 51.9° | 60.0° |
| C10 | N | C23 | H232 | 68.1° | 180.0° |
| C10 | N | C23 | H233 | 171.9° | 60.0° |
| C10 | N | C15 | H151 | 65.8° | 55.5° |
| C10 | N | C15 | H152 | 53.8° | 64.4° |
| C11 | N | C15 | C23 | 123.0° | 123.0° |
| N | C11 | C12 | C8 | 50.9° | 64.0° |
| C11 | N | C10 | C9 | 72.1° | 72.6° |
| C11 | N | C10 | C14 | 41.8° | 41.6° |
| N | C11 | C12 | C13 | 112.9° | 111.7° |
| N | C11 | C12 | H11 | 122.3° | 124.3° |
| N | C11 | C13 | H11 | 121.7° | 122.3° |
| N | C11 | C13 | C14 | 23.2° | 25.2° |
| C11 | N | C15 | C16 | 57.4° | 70.3° |
| N | C11 | C12 | H121 | 69.1° | 55.7° |
| N | C11 | C12 | H122 | 169.3° | 176.0° |
| N | C11 | C13 | H131 | 96.8° | 93.6° |
| N | C11 | C13 | H132 | 144.8° | 144.0° |
| C11 | N | C10 | H10 | 165.6° | 163.3° |
| C11 | N | C23 | H231 | 60.6° | 174.0° |
| C11 | N | C23 | H232 | 179.4° | 66.0° |
| C11 | N | C23 | H233 | 59.4° | 54.0° |
| C11 | N | C15 | H151 | 177.3° | 169.6° |
| C11 | N | C15 | H152 | 63.1° | 49.7° |
| N | C15 | C16 | O3 | 102.1° | 60.0° |
| C15 | N | C10 | C9 | 52.0° | 45.9° |
| C15 | N | C10 | C14 | 165.9° | 160.1° |
| C15 | N | C11 | C12 | 48.1° | 46.0° |
| C15 | N | C11 | C13 | 162.0° | 160.1° |
| N | C15 | C16 | H151 | 120.0° | 120.1° |
| N | C15 | C16 | H152 | 120.4° | 120.0° |
| N | C15 | C16 | C17 | 138.6° | 180.0° |
| C15 | N | C11 | H11 | 73.4° | 78.0° |
| C15 | N | C10 | H10 | 70.3° | 78.2° |
| C15 | N | C23 | H231 | 173.3° | 63.0° |
| C15 | N | C23 | H232 | 53.3° | 57.0° |
| C15 | N | C23 | H233 | 66.7° | 177.0° |
| N | C15 | H151 | H152 | 120.5° | 120.0° |
| N | C15 | C16 | H16 | 18.5° | 60.0° |
| C23 | N | C10 | C9 | 170.7° | 169.0° |
| C23 | N | C10 | C14 | 75.4° | 76.9° |
| C23 | N | C11 | C12 | 169.5° | 169.0° |
| C23 | N | C11 | C13 | 76.6° | 76.9° |
| C23 | N | C15 | C16 | 65.7° | 52.6° |
| C23 | N | C11 | H11 | 48.1° | 45.1° |
| C23 | N | C10 | H10 | 48.4° | 44.8° |
| N | C23 | H231 | H232 | 120.0° | 120.0° |
| N | C23 | H231 | H233 | 120.0° | 120.0° |
| N | C23 | H232 | H233 | 120.0° | 120.0° |
| C23 | N | C15 | H151 | 54.3° | 67.4° |
| C23 | N | C15 | H152 | 173.9° | 172.6° |
| O1 | C1 | C2 | O2 | 176.6° | 179.8° |
| O1 | C1 | C2 | C3 | 163.5° | 180.0° |
| O1 | C1 | C2 | C7 | 11.9° | 0.2° |
| C1 | O1 | C8 | C9 | 173.7° | 150.0° |
| C1 | O1 | C8 | C12 | 59.7° | 89.7° |
| C1 | O1 | C8 | H8 | 55.0° | 30.1° |
| C2 | C1 | O1 | C8 | 172.8° | 180.0° |
| C1 | C2 | C3 | C7 | 175.3° | 179.8° |
| C1 | C2 | C3 | C4 | 177.4° | 179.7° |
| C1 | C2 | C7 | C6 | 177.1° | 180.0° |
| C1 | C2 | C7 | H7 | 2.9° | 0.1° |
| C1 | C2 | C3 | H3 | 2.6° | 0.0° |
| O2 | C1 | O1 | C8 | 10.7° | 0.3° |
| O2 | C1 | C2 | C3 | 13.1° | 0.2° |
| O2 | C1 | C2 | C7 | 171.6° | 180.0° |
| O1 | C8 | C9 | C12 | 125.6° | 120.1° |
| O1 | C8 | C9 | H8 | 119.8° | 119.9° |
| O1 | C8 | C12 | H8 | 119.3° | 119.8° |
| O1 | C8 | C9 | C10 | 97.6° | 66.1° |
| O1 | C8 | C12 | C11 | 95.8° | 66.1° |
| O1 | C8 | C12 | H121 | 144.3° | 174.1° |
| O1 | C8 | C12 | H122 | 22.6° | 53.9° |
| O1 | C8 | C9 | H91C | 22.4° | 53.7° |
| O1 | C8 | C9 | H92C | 145.3° | 174.1° |
| C2 | C3 | C4 | H3 | 180.0° | 179.7° |
| C2 | C3 | C4 | C5 | 1.6° | 0.5° |
| C3 | C2 | C7 | C6 | 1.7° | 0.3° |
| C3 | C2 | C7 | H7 | 178.3° | 179.8° |
| C2 | C3 | C4 | H4 | 178.4° | 179.7° |
| C7 | C2 | C3 | C4 | 2.1° | 0.5° |
| C2 | C7 | C6 | C5 | 0.8° | 0.0° |
| C2 | C7 | C6 | H7 | 180.0° | 179.9° |
| C7 | C2 | C3 | H3 | 178.0° | 179.7° |
| C2 | C7 | C6 | H6 | 179.2° | 180.0° |
| C3 | C4 | C5 | H4 | 180.0° | 179.8° |
| C3 | C4 | C5 | C6 | 0.8° | 0.3° |
| C3 | C4 | C5 | H5 | 179.2° | 179.8° |
| O3 | C16 | C15 | C17 | 119.3° | 120.0° |
| O3 | C16 | C15 | H16 | 120.5° | 119.9° |
| O3 | C16 | C17 | H16 | 120.5° | 120.0° |
| O3 | C16 | C17 | C18 | 58.4° | 145.0° |
| O3 | C16 | C17 | C22 | 121.0° | 34.7° |
| O3 | C16 | C15 | H151 | 137.9° | 180.0° |
| O3 | C16 | C15 | H152 | 18.4° | 60.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 0.3° | 0.0° |
| C5 | C4 | C3 | H3 | 178.4° | 179.7° |
| C4 | C5 | C6 | H6 | 179.6° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | H7 | 179.2° | 179.9° |
| C6 | C5 | C4 | H4 | 179.2° | 180.0° |
| C7 | C6 | C5 | H5 | 179.7° | 180.0° |
| C9 | C8 | C12 | H8 | 118.0° | 120.1° |
| C8 | C9 | C10 | H91C | 120.0° | 119.8° |
| C8 | C9 | C10 | H92C | 117.1° | 119.8° |
| C8 | C9 | C10 | C14 | 60.9° | 47.6° |
| C9 | C8 | C12 | C11 | 26.9° | 54.0° |
| C9 | C8 | C12 | H121 | 93.1° | 65.8° |
| C9 | C8 | C12 | H122 | 145.3° | 174.0° |
| C8 | C9 | H91C | H92C | 117.4° | 120.3° |
| C8 | C9 | C10 | H10 | 175.0° | 172.0° |
| C12 | C8 | C9 | C10 | 28.0° | 54.0° |
| C8 | C12 | C11 | H121 | 120.0° | 119.8° |
| C8 | C12 | C11 | H122 | 118.4° | 119.9° |
| C8 | C12 | C11 | C13 | 62.0° | 47.6° |
| C8 | C12 | H121 | H122 | 118.5° | 120.3° |
| C12 | C8 | C9 | H91C | 148.0° | 173.8° |
| C12 | C8 | C9 | H92C | 89.0° | 65.8° |
| C8 | C12 | C11 | H11 | 173.2° | 171.7° |
| C9 | C10 | C14 | H10 | 122.1° | 124.5° |
| C9 | C10 | C14 | C13 | 88.1° | 88.6° |
| C10 | C9 | C8 | H8 | 142.6° | 174.0° |
| C10 | C9 | H91C | H92C | 117.4° | 120.3° |
| C9 | C10 | C14 | H141 | 31.9° | 152.6° |
| C9 | C10 | C14 | H142 | 150.0° | 30.3° |
| C10 | C14 | C13 | C11 | 2.0° | 0.0° |
| C10 | C14 | C13 | H141 | 120.0° | 118.8° |
| C10 | C14 | C13 | H142 | 121.9° | 119.0° |
| C14 | C10 | C9 | H91C | 59.1° | 72.2° |
| C14 | C10 | C9 | H92C | 178.1° | 167.5° |
| C10 | C14 | C13 | H131 | 122.0° | 118.8° |
| C10 | C14 | C13 | H132 | 119.6° | 118.8° |
| C10 | C14 | H141 | H142 | 122.1° | 122.4° |
| C12 | C11 | C13 | H11 | 121.0° | 124.0° |
| C12 | C11 | C13 | C14 | 94.1° | 88.5° |
| C11 | C12 | C8 | H8 | 144.9° | 174.1° |
| C11 | C12 | H121 | H122 | 118.5° | 120.4° |
| C12 | C11 | C13 | H131 | 145.9° | 152.6° |
| C12 | C11 | C13 | H132 | 27.5° | 30.3° |
| C11 | C13 | C14 | H131 | 120.0° | 118.8° |
| C11 | C13 | C14 | H132 | 121.6° | 118.8° |
| C13 | C11 | C12 | H121 | 178.0° | 167.4° |
| C13 | C11 | C12 | H122 | 56.4° | 72.3° |
| C11 | C13 | H131 | H132 | 121.7° | 122.3° |
| C11 | C13 | C14 | H141 | 122.0° | 118.9° |
| C11 | C13 | C14 | H142 | 119.9° | 118.9° |
| C14 | C13 | C11 | H11 | 144.9° | 147.5° |
| C14 | C13 | H131 | H132 | 121.7° | 122.3° |
| C13 | C14 | H141 | H142 | 122.1° | 122.2° |
| C13 | C14 | C10 | H10 | 149.8° | 146.9° |
| C15 | C16 | C17 | H16 | 120.7° | 120.0° |
| C15 | C16 | C17 | C18 | 60.4° | 95.0° |
| C15 | C16 | C17 | C22 | 120.2° | 85.3° |
| C16 | C15 | H151 | H152 | 120.5° | 120.0° |
| C15 | C16 | O3 | HA | 8.2° | 60.0° |
| C16 | C17 | C18 | C22 | 179.4° | 179.8° |
| C16 | C17 | C18 | C19 | 179.9° | 179.7° |
| C16 | C17 | C22 | C21 | 179.9° | 179.9° |
| C17 | C16 | C15 | H151 | 18.6° | 60.0° |
| C17 | C16 | C15 | H152 | 101.0° | 60.0° |
| C17 | C16 | O3 | HA | 127.4° | 60.0° |
| C16 | C17 | C22 | H22 | 0.1° | 0.0° |
| C16 | C17 | C18 | H18 | 0.1° | 0.1° |
| C17 | C18 | C19 | H18 | 180.0° | 179.8° |
| C17 | C18 | C19 | C20 | 0.3° | 0.5° |
| C18 | C17 | C22 | C21 | 0.5° | 0.3° |
| C18 | C17 | C16 | H16 | 178.9° | 25.1° |
| C18 | C17 | C22 | H22 | 179.5° | 179.8° |
| C17 | C18 | C19 | H19 | 179.7° | 179.8° |
| C22 | C17 | C18 | C19 | 0.5° | 0.5° |
| C17 | C22 | C21 | C20 | 0.3° | 0.0° |
| C17 | C22 | C21 | H22 | 180.0° | 180.0° |
| C22 | C17 | C16 | H16 | 0.5° | 154.7° |
| C22 | C17 | C18 | H18 | 179.5° | 179.7° |
| C17 | C22 | C21 | H21 | 179.7° | 180.0° |
| C18 | C19 | C20 | H19 | 180.0° | 179.7° |
| C18 | C19 | C20 | C21 | 0.2° | 0.3° |
| C18 | C19 | C20 | H20 | 179.8° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.2° | 0.0° |
| C20 | C19 | C18 | H18 | 179.7° | 179.7° |
| C19 | C20 | C21 | H21 | 179.8° | 180.0° |
| C20 | C21 | C22 | H21 | 180.0° | 180.0° |
| C20 | C21 | C22 | H22 | 179.7° | 180.0° |
| C21 | C20 | C19 | H19 | 179.8° | 180.0° |
| C22 | C21 | C20 | H20 | 179.8° | 179.9° |
| H7 | C7 | C6 | H6 | 0.8° | 0.1° |
| H3 | C3 | C4 | H4 | 1.6° | 0.0° |
| H6 | C6 | C5 | H5 | 0.4° | 0.0° |
| H5 | C5 | C4 | H4 | 0.8° | 0.0° |
| H8 | C8 | C12 | H121 | 25.0° | 54.3° |
| H8 | C8 | C12 | H122 | 96.7° | 66.0° |
| H8 | C8 | C9 | H91C | 97.4° | 66.2° |
| H8 | C8 | C9 | H92C | 25.5° | 54.2° |
| H121 | C12 | C11 | H11 | 53.3° | 68.6° |
| H122 | C12 | C11 | H11 | 68.4° | 51.7° |
| H91C | C9 | C10 | H10 | 64.9° | 52.1° |
| H92C | C9 | C10 | H10 | 57.9° | 68.2° |
| H11 | C11 | C13 | H131 | 24.9° | 28.7° |
| H11 | C11 | C13 | H132 | 93.5° | 93.7° |
| H131 | C13 | C14 | H141 | 118.0° | 0.0° |
| H131 | C13 | C14 | H142 | 0.1° | 122.2° |
| H132 | C13 | C14 | H141 | 0.4° | 122.3° |
| H132 | C13 | C14 | H142 | 118.5° | 0.2° |
| H141 | C14 | C10 | H10 | 90.2° | 28.1° |
| H142 | C14 | C10 | H10 | 27.9° | 94.2° |
| H231 | C23 | H232 | H233 | 120.0° | 120.1° |
| H151 | C15 | C16 | H16 | 101.5° | 60.1° |
| H152 | C15 | C16 | H16 | 138.9° | 180.0° |
| H16 | C16 | O3 | HA | 112.5° | 180.0° |
| H22 | C22 | C21 | H21 | 0.3° | 0.1° |
| H18 | C18 | C19 | H19 | 0.4° | 0.0° |
| H21 | C21 | C20 | H20 | 0.2° | 0.0° |
| H20 | C20 | C19 | H19 | 0.2° | 0.0° |
