2QA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | sing | 1.55Å | 1.53Å | |
| C20 | C19 | sing | 1.55Å | 1.52Å | |
| C21 | C17 | sing | 1.54Å | 1.54Å | |
| C9 | C7 | sing | 1.53Å | 1.53Å | |
| O1 | C22 | doub | 1.22Å | 1.23Å | |
| C19 | C18 | sing | 1.54Å | 1.51Å | |
| C17 | C18 | sing | 1.54Å | 1.55Å | |
| C17 | C15 | sing | 1.51Å | 1.52Å | |
| C10 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.53Å | 1.54Å | |
| C7 | C6 | sing | 1.53Å | 1.54Å | |
| C22 | C14 | sing | 1.48Å | 1.50Å | |
| C22 | N1 | sing | 1.35Å | 1.35Å | |
| C15 | C14 | doub | 1.39Å | 1.43Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.40Å | 1.43Å | Aromatic |
| C16 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C3 | sing | 1.51Å | 1.50Å | |
| N1 | C23 | sing | 1.46Å | 1.48Å | |
| C6 | C5 | sing | 1.52Å | 1.51Å | |
| C5 | O | doub | 1.21Å | 1.22Å | |
| C5 | C4 | sing | 1.47Å | 1.48Å | |
| C3 | C4 | doub | 1.39Å | 1.38Å | Aromatic |
| C3 | N | sing | 1.34Å | 1.40Å | Aromatic |
| C11 | N | sing | 1.40Å | 1.44Å | |
| C11 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | C12 | doub | 1.37Å | 1.39Å | Aromatic |
| C13 | C24 | sing | 1.51Å | 1.51Å | |
| C4 | C1 | sing | 1.45Å | 1.44Å | Aromatic |
| N | C2 | sing | 1.37Å | 1.38Å | Aromatic |
| C24 | C23 | sing | 1.53Å | 1.51Å | |
| C1 | C2 | doub | 1.35Å | 1.36Å | Aromatic |
| C1 | C | sing | 1.51Å | 1.51Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| N1 | H4 | sing | 0.97Å | 1.00Å | |
| C23 | H5 | sing | 1.09Å | 1.10Å | |
| C23 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C20 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C8 | H20 | sing | 1.09Å | 1.10Å | |
| C8 | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H22 | sing | 1.09Å | 1.10Å | |
| C10 | H23 | sing | 1.09Å | 1.10Å | |
| C10 | H24 | sing | 1.09Å | 1.10Å | |
| C9 | H25 | sing | 1.09Å | 1.10Å | |
| C9 | H26 | sing | 1.09Å | 1.10Å | |
| C9 | H27 | sing | 1.09Å | 1.10Å | |
| C | H28 | sing | 1.09Å | 1.10Å | |
| C | H29 | sing | 1.09Å | 1.10Å | |
| C | H30 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C19 | 107.1° | 102.8° |
| C20 | C21 | C17 | 104.7° | 104.2° |
| C20 | C21 | H11 | 110.6° | 110.6° |
| C20 | C21 | H12 | 110.6° | 110.6° |
| C21 | C20 | H13 | 110.1° | 110.7° |
| C21 | C20 | H14 | 110.1° | 110.8° |
| C20 | C19 | C18 | 106.2° | 104.1° |
| C19 | C20 | H13 | 110.1° | 110.7° |
| C19 | C20 | H14 | 110.0° | 110.8° |
| C20 | C19 | H15 | 110.3° | 110.5° |
| C20 | C19 | H16 | 110.3° | 110.5° |
| C21 | C17 | C18 | 101.6° | 106.6° |
| C21 | C17 | C15 | 116.7° | 110.0° |
| C21 | C17 | H10 | 106.7° | 110.1° |
| C17 | C21 | H11 | 110.7° | 110.4° |
| C17 | C21 | H12 | 110.6° | 110.5° |
| C9 | C7 | C10 | 108.7° | 109.2° |
| C9 | C7 | C8 | 110.2° | 109.2° |
| C9 | C7 | C6 | 110.1° | 109.2° |
| C7 | C9 | H25 | 109.5° | 109.5° |
| C7 | C9 | H26 | 109.5° | 109.5° |
| C7 | C9 | H27 | 109.5° | 109.5° |
| O1 | C22 | C14 | 123.0° | 120.4° |
| O1 | C22 | N1 | 119.8° | 120.5° |
| C19 | C18 | C17 | 104.1° | 106.6° |
| C18 | C19 | H15 | 110.3° | 110.5° |
| C18 | C19 | H16 | 110.3° | 110.5° |
| C19 | C18 | H17 | 110.8° | 110.1° |
| C19 | C18 | H18 | 110.8° | 110.0° |
| C18 | C17 | C15 | 117.5° | 110.0° |
| C18 | C17 | H10 | 106.6° | 110.0° |
| C17 | C18 | H17 | 110.8° | 110.1° |
| C17 | C18 | H18 | 110.8° | 110.0° |
| C17 | C15 | C14 | 121.8° | 120.1° |
| C17 | C15 | C16 | 119.3° | 120.2° |
| C15 | C17 | H10 | 106.9° | 110.0° |
| C10 | C7 | C8 | 109.3° | 109.2° |
| C10 | C7 | C6 | 109.8° | 109.2° |
| C7 | C10 | H22 | 109.5° | 109.4° |
| C7 | C10 | H23 | 109.5° | 109.5° |
| C7 | C10 | H24 | 109.4° | 109.5° |
| C8 | C7 | C6 | 108.7° | 110.7° |
| C7 | C8 | C3 | 114.7° | 109.2° |
| C7 | C8 | H20 | 108.2° | 109.5° |
| C7 | C8 | H21 | 108.1° | 109.6° |
| C7 | C6 | C5 | 115.8° | 108.4° |
| C7 | C6 | H2 | 107.9° | 109.7° |
| C7 | C6 | H3 | 107.9° | 109.7° |
| C14 | C22 | N1 | 117.0° | 119.1° |
| C22 | C14 | C15 | 125.6° | 121.1° |
| C22 | C14 | C13 | 114.5° | 118.9° |
| C22 | N1 | C23 | 125.4° | 121.3° |
| C22 | N1 | H4 | 117.3° | 119.3° |
| C14 | C15 | C16 | 118.8° | 119.7° |
| C15 | C14 | C13 | 119.7° | 120.0° |
| C15 | C16 | C11 | 120.6° | 120.3° |
| C15 | C16 | H19 | 119.7° | 119.9° |
| C14 | C13 | C12 | 119.7° | 119.9° |
| C14 | C13 | C24 | 121.2° | 119.1° |
| C16 | C11 | N | 119.5° | 119.9° |
| C16 | C11 | C12 | 120.8° | 120.2° |
| C11 | C16 | H19 | 119.7° | 119.8° |
| C8 | C3 | C4 | 124.3° | 122.8° |
| C8 | C3 | N | 126.9° | 129.5° |
| C3 | C8 | H20 | 108.2° | 109.5° |
| C3 | C8 | H21 | 108.1° | 109.5° |
| N1 | C23 | C24 | 107.1° | 111.0° |
| C23 | N1 | H4 | 117.3° | 119.4° |
| N1 | C23 | H5 | 110.0° | 109.2° |
| N1 | C23 | H6 | 110.1° | 109.2° |
| C6 | C5 | O | 119.6° | 122.4° |
| C6 | C5 | C4 | 118.3° | 115.1° |
| C5 | C6 | H2 | 107.8° | 109.7° |
| C5 | C6 | H3 | 107.9° | 109.7° |
| O | C5 | C4 | 122.1° | 122.5° |
| C5 | C4 | C3 | 118.5° | 122.0° |
| C5 | C4 | C1 | 134.5° | 131.3° |
| C4 | C3 | N | 108.8° | 107.7° |
| C3 | C4 | C1 | 107.0° | 106.8° |
| C3 | N | C11 | 127.0° | 124.8° |
| C3 | N | C2 | 107.1° | 110.3° |
| N | C11 | C12 | 119.6° | 119.9° |
| C11 | N | C2 | 124.7° | 124.9° |
| C11 | C12 | C13 | 120.1° | 119.9° |
| C11 | C12 | H9 | 120.0° | 120.0° |
| C12 | C13 | C24 | 119.0° | 120.9° |
| C13 | C12 | H9 | 119.9° | 120.1° |
| C13 | C24 | C23 | 111.2° | 109.9° |
| C13 | C24 | H7 | 109.0° | 109.3° |
| C13 | C24 | H8 | 109.0° | 109.4° |
| C4 | C1 | C2 | 106.7° | 106.0° |
| C4 | C1 | C | 128.5° | 127.0° |
| N | C2 | C1 | 110.4° | 109.3° |
| N | C2 | H1 | 124.8° | 125.3° |
| C24 | C23 | H5 | 110.0° | 109.1° |
| C24 | C23 | H6 | 110.0° | 109.1° |
| C23 | C24 | H7 | 109.0° | 109.4° |
| C23 | C24 | H8 | 109.0° | 109.4° |
| C2 | C1 | C | 124.8° | 127.0° |
| C1 | C2 | H1 | 124.8° | 125.4° |
| C1 | C | H28 | 109.5° | 109.4° |
| C1 | C | H29 | 109.5° | 109.5° |
| C1 | C | H30 | 109.5° | 109.4° |
| H2 | C6 | H3 | 109.5° | 109.7° |
| H5 | C23 | H6 | 109.5° | 109.2° |
| H7 | C24 | H8 | 109.5° | 109.4° |
| H11 | C21 | H12 | 109.5° | 110.4° |
| H13 | C20 | H14 | 109.5° | 110.8° |
| H15 | C19 | H16 | 109.5° | 110.6° |
| H17 | C18 | H18 | 109.5° | 110.0° |
| H20 | C8 | H21 | 109.5° | 109.5° |
| H22 | C10 | H23 | 109.5° | 109.4° |
| H22 | C10 | H24 | 109.5° | 109.5° |
| H23 | C10 | H24 | 109.5° | 109.5° |
| H25 | C9 | H26 | 109.4° | 109.5° |
| H25 | C9 | H27 | 109.5° | 109.5° |
| H26 | C9 | H27 | 109.4° | 109.4° |
| H28 | C | H29 | 109.5° | 109.5° |
| H28 | C | H30 | 109.5° | 109.5° |
| H29 | C | H30 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C19 | H13 | 119.6° | 118.3° |
| C21 | C20 | C19 | H14 | 119.6° | 118.4° |
| C20 | C21 | C17 | H11 | 119.2° | 118.7° |
| C20 | C21 | C17 | H12 | 119.2° | 118.8° |
| C21 | C20 | C19 | C18 | 6.8° | 38.0° |
| C20 | C21 | C17 | C18 | 35.6° | 23.6° |
| C20 | C21 | C17 | C15 | 164.6° | 142.9° |
| C20 | C21 | C17 | H10 | 75.9° | 95.7° |
| C20 | C21 | H11 | H12 | 122.2° | 122.8° |
| C21 | C20 | H13 | H14 | 121.1° | 123.3° |
| C21 | C20 | C19 | H15 | 126.3° | 80.6° |
| C21 | C20 | C19 | H16 | 112.6° | 156.7° |
| C19 | C20 | C21 | C17 | 18.4° | 38.0° |
| C20 | C19 | C18 | H15 | 119.5° | 118.7° |
| C20 | C19 | C18 | H16 | 119.5° | 118.7° |
| C20 | C19 | C18 | C17 | 29.3° | 23.6° |
| C19 | C20 | C21 | H11 | 137.7° | 80.7° |
| C19 | C20 | C21 | H12 | 100.8° | 156.7° |
| C19 | C20 | H13 | H14 | 121.0° | 123.4° |
| C20 | C19 | H15 | H16 | 121.5° | 122.6° |
| C20 | C19 | C18 | H17 | 89.8° | 95.7° |
| C20 | C19 | C18 | H18 | 148.5° | 142.9° |
| C21 | C17 | C18 | C19 | 40.0° | 0.0° |
| C21 | C17 | C18 | C15 | 128.6° | 119.3° |
| C21 | C17 | C18 | H10 | 111.6° | 119.4° |
| C21 | C17 | C15 | H10 | 119.3° | 121.4° |
| C21 | C17 | C15 | C14 | 111.4° | 115.4° |
| C21 | C17 | C15 | C16 | 72.1° | 64.6° |
| C17 | C21 | H11 | H12 | 122.2° | 122.5° |
| C17 | C21 | C20 | H13 | 138.1° | 156.3° |
| C17 | C21 | C20 | H14 | 101.2° | 80.4° |
| C21 | C17 | C18 | H17 | 79.1° | 119.3° |
| C21 | C17 | C18 | H18 | 159.2° | 119.3° |
| C9 | C7 | C10 | C8 | 120.3° | 119.4° |
| C9 | C7 | C10 | C6 | 120.5° | 119.4° |
| C9 | C7 | C8 | C6 | 120.8° | 120.3° |
| C9 | C7 | C8 | C3 | 76.4° | 67.7° |
| C9 | C7 | C6 | C5 | 70.9° | 55.6° |
| C9 | C7 | C6 | H2 | 168.2° | 64.1° |
| C9 | C7 | C6 | H3 | 50.0° | 175.3° |
| C9 | C7 | C8 | H20 | 44.4° | 172.4° |
| C9 | C7 | C8 | H21 | 162.9° | 52.3° |
| C9 | C7 | C10 | H22 | 180.0° | 59.4° |
| C9 | C7 | C10 | H23 | 60.0° | 60.6° |
| C9 | C7 | C10 | H24 | 60.0° | 179.4° |
| C7 | C9 | H25 | H26 | 120.0° | 120.0° |
| C7 | C9 | H25 | H27 | 120.0° | 120.0° |
| C7 | C9 | H26 | H27 | 120.0° | 120.0° |
| O1 | C22 | C14 | N1 | 175.5° | 179.8° |
| O1 | C22 | C14 | C15 | 27.5° | 17.7° |
| O1 | C22 | C14 | C13 | 148.2° | 162.6° |
| O1 | C22 | N1 | C23 | 173.4° | 177.2° |
| O1 | C22 | N1 | H4 | 6.6° | 2.8° |
| C19 | C18 | C17 | H17 | 119.1° | 119.3° |
| C19 | C18 | C17 | H18 | 119.2° | 119.3° |
| C19 | C18 | C17 | C15 | 168.6° | 119.3° |
| C19 | C18 | C17 | H10 | 71.5° | 119.4° |
| C18 | C19 | C20 | H13 | 112.8° | 156.3° |
| C18 | C19 | C20 | H14 | 126.5° | 80.4° |
| C18 | C19 | H15 | H16 | 121.5° | 122.6° |
| C19 | C18 | H17 | H18 | 122.5° | 121.4° |
| C18 | C17 | C15 | H10 | 119.7° | 121.4° |
| C18 | C17 | C15 | C14 | 127.6° | 127.5° |
| C18 | C17 | C15 | C16 | 48.9° | 52.5° |
| C18 | C17 | C21 | H11 | 154.8° | 95.1° |
| C18 | C17 | C21 | H12 | 83.7° | 142.4° |
| C17 | C18 | C19 | H15 | 148.8° | 95.0° |
| C17 | C18 | C19 | H16 | 90.2° | 142.3° |
| C17 | C18 | H17 | H18 | 122.5° | 121.4° |
| C17 | C15 | C14 | C22 | 12.3° | 0.1° |
| C17 | C15 | C14 | C16 | 176.5° | 180.0° |
| C17 | C15 | C14 | C13 | 172.2° | 179.8° |
| C17 | C15 | C16 | C11 | 174.9° | 179.3° |
| C15 | C17 | C21 | H11 | 76.1° | 24.2° |
| C15 | C17 | C21 | H12 | 45.4° | 98.3° |
| C15 | C17 | C18 | H17 | 49.5° | 121.4° |
| C15 | C17 | C18 | H18 | 72.2° | 0.0° |
| C17 | C15 | C16 | H19 | 5.1° | 0.0° |
| C10 | C7 | C8 | C6 | 119.8° | 120.3° |
| C10 | C7 | C8 | C3 | 164.2° | 172.9° |
| C10 | C7 | C6 | C5 | 169.4° | 175.0° |
| C10 | C7 | C6 | H2 | 48.5° | 55.2° |
| C10 | C7 | C6 | H3 | 69.6° | 65.3° |
| C10 | C7 | C8 | H20 | 75.0° | 53.0° |
| C10 | C7 | C8 | H21 | 43.5° | 67.1° |
| C7 | C10 | H22 | H23 | 120.0° | 120.0° |
| C7 | C10 | H22 | H24 | 120.0° | 120.1° |
| C7 | C10 | H23 | H24 | 120.0° | 120.1° |
| C10 | C7 | C9 | H25 | 180.0° | 179.4° |
| C10 | C7 | C9 | H26 | 60.0° | 60.6° |
| C10 | C7 | C9 | H27 | 60.0° | 59.4° |
| C7 | C8 | C3 | H20 | 120.8° | 119.9° |
| C7 | C8 | C3 | H21 | 120.7° | 120.0° |
| C8 | C7 | C6 | C5 | 49.9° | 64.7° |
| C7 | C8 | C3 | C4 | 19.6° | 20.3° |
| C7 | C8 | C3 | N | 157.7° | 159.5° |
| C8 | C7 | C6 | H2 | 71.0° | 175.5° |
| C8 | C7 | C6 | H3 | 170.9° | 55.0° |
| C7 | C8 | H20 | H21 | 117.6° | 120.1° |
| C8 | C7 | C10 | H22 | 59.7° | 60.1° |
| C8 | C7 | C10 | H23 | 60.3° | 180.0° |
| C8 | C7 | C10 | H24 | 179.7° | 60.0° |
| C8 | C7 | C9 | H25 | 60.3° | 60.0° |
| C8 | C7 | C9 | H26 | 179.8° | 180.0° |
| C8 | C7 | C9 | H27 | 59.8° | 60.0° |
| C6 | C7 | C8 | C3 | 44.4° | 52.6° |
| C7 | C6 | C5 | H2 | 120.9° | 119.8° |
| C7 | C6 | C5 | H3 | 120.9° | 119.7° |
| C7 | C6 | C5 | O | 149.3° | 137.4° |
| C7 | C6 | C5 | C4 | 29.5° | 42.4° |
| C7 | C6 | H2 | H3 | 117.1° | 120.6° |
| C6 | C7 | C8 | H20 | 165.2° | 67.3° |
| C6 | C7 | C8 | H21 | 76.4° | 172.6° |
| C6 | C7 | C10 | H22 | 59.5° | 178.7° |
| C6 | C7 | C10 | H23 | 179.5° | 58.8° |
| C6 | C7 | C10 | H24 | 60.5° | 61.2° |
| C6 | C7 | C9 | H25 | 59.7° | 61.2° |
| C6 | C7 | C9 | H26 | 60.3° | 58.8° |
| C6 | C7 | C9 | H27 | 179.7° | 178.7° |
| C22 | C14 | C15 | C13 | 175.5° | 179.7° |
| C22 | C14 | C15 | C16 | 171.2° | 179.9° |
| C14 | C22 | N1 | C23 | 2.3° | 3.0° |
| C22 | C14 | C13 | C12 | 172.5° | 179.7° |
| C22 | C14 | C13 | C24 | 9.8° | 0.6° |
| C14 | C22 | N1 | H4 | 177.7° | 177.0° |
| N1 | C22 | C14 | C15 | 156.9° | 162.6° |
| N1 | C22 | C14 | C13 | 27.3° | 17.2° |
| C22 | N1 | C23 | H4 | 180.0° | 180.0° |
| C22 | N1 | C23 | C24 | 37.6° | 37.8° |
| C22 | N1 | C23 | H5 | 82.0° | 82.6° |
| C22 | N1 | C23 | H6 | 157.3° | 158.1° |
| C14 | C15 | C16 | C11 | 1.7° | 0.7° |
| C15 | C14 | C13 | C12 | 3.5° | 0.0° |
| C15 | C14 | C13 | C24 | 174.2° | 179.6° |
| C14 | C15 | C17 | H10 | 7.9° | 6.1° |
| C14 | C15 | C16 | H19 | 178.3° | 180.0° |
| C16 | C15 | C14 | C13 | 4.3° | 0.2° |
| C15 | C16 | C11 | H19 | 180.0° | 179.3° |
| C15 | C16 | C11 | N | 175.8° | 179.9° |
| C15 | C16 | C11 | C12 | 1.8° | 1.0° |
| C16 | C15 | C17 | H10 | 168.6° | 173.9° |
| C14 | C13 | C12 | C11 | 0.1° | 0.2° |
| C14 | C13 | C12 | C24 | 177.8° | 179.7° |
| C14 | C13 | C24 | C23 | 30.3° | 34.3° |
| C14 | C13 | C24 | H7 | 89.9° | 154.4° |
| C14 | C13 | C24 | H8 | 150.6° | 85.8° |
| C14 | C13 | C12 | H9 | 179.9° | 179.7° |
| C16 | C11 | N | C3 | 123.7° | 130.0° |
| C16 | C11 | N | C12 | 177.7° | 179.1° |
| C16 | C11 | C12 | C13 | 2.7° | 0.7° |
| C16 | C11 | N | C2 | 42.2° | 50.4° |
| C16 | C11 | C12 | H9 | 177.4° | 179.2° |
| C8 | C3 | C4 | C5 | 3.8° | 0.5° |
| C8 | C3 | C4 | N | 177.7° | 179.8° |
| C8 | C3 | N | C11 | 8.8° | 0.3° |
| C8 | C3 | C4 | C1 | 176.6° | 179.5° |
| C8 | C3 | N | C2 | 176.8° | 179.3° |
| C3 | C8 | H20 | H21 | 117.6° | 120.1° |
| N1 | C23 | C24 | C13 | 50.6° | 51.2° |
| N1 | C23 | C24 | H5 | 119.6° | 120.4° |
| N1 | C23 | C24 | H6 | 119.6° | 120.4° |
| N1 | C23 | H5 | H6 | 121.1° | 119.3° |
| N1 | C23 | C24 | H7 | 69.7° | 171.2° |
| N1 | C23 | C24 | H8 | 170.8° | 68.9° |
| C6 | C5 | O | C4 | 178.7° | 179.8° |
| C6 | C5 | C4 | C3 | 1.1° | 11.2° |
| C6 | C5 | C4 | C1 | 178.4° | 168.9° |
| C5 | C6 | H2 | H3 | 117.1° | 120.5° |
| O | C5 | C4 | C3 | 177.6° | 168.7° |
| O | C5 | C4 | C1 | 2.9° | 11.3° |
| O | C5 | C6 | H2 | 89.8° | 17.7° |
| O | C5 | C6 | H3 | 28.3° | 102.8° |
| C5 | C4 | C3 | C1 | 179.6° | 180.0° |
| C5 | C4 | C3 | N | 178.5° | 179.7° |
| C5 | C4 | C1 | C2 | 178.5° | 179.9° |
| C5 | C4 | C1 | C | 2.8° | 0.3° |
| C4 | C5 | C6 | H2 | 91.4° | 162.2° |
| C4 | C5 | C6 | H3 | 150.4° | 77.3° |
| C4 | C3 | N | C11 | 168.9° | 179.9° |
| C4 | C3 | N | C2 | 0.9° | 0.5° |
| C3 | C4 | C1 | C2 | 1.0° | 0.1° |
| C3 | C4 | C1 | C | 177.7° | 179.7° |
| C4 | C3 | C8 | H20 | 140.4° | 99.6° |
| C4 | C3 | C8 | H21 | 101.2° | 140.3° |
| C3 | N | C11 | C2 | 166.0° | 179.6° |
| C3 | N | C11 | C12 | 53.9° | 50.9° |
| N | C3 | C4 | C1 | 1.1° | 0.3° |
| C3 | N | C2 | C1 | 0.2° | 0.4° |
| C3 | N | C2 | H1 | 179.8° | 179.5° |
| N | C3 | C8 | H20 | 36.9° | 80.6° |
| N | C3 | C8 | H21 | 81.5° | 39.4° |
| N | C11 | C12 | C13 | 175.0° | 179.8° |
| C11 | N | C2 | C1 | 168.6° | 179.9° |
| C11 | N | C2 | H1 | 11.4° | 0.1° |
| N | C11 | C12 | H9 | 5.0° | 0.1° |
| N | C11 | C16 | H19 | 4.2° | 0.6° |
| C11 | C12 | C13 | H9 | 180.0° | 180.0° |
| C11 | C12 | C13 | C24 | 177.7° | 179.9° |
| C12 | C11 | N | C2 | 140.1° | 128.7° |
| C12 | C11 | C16 | H19 | 178.2° | 179.7° |
| C12 | C13 | C24 | C23 | 147.4° | 146.0° |
| C12 | C13 | C24 | H7 | 92.3° | 26.0° |
| C12 | C13 | C24 | H8 | 27.2° | 93.8° |
| C13 | C24 | C23 | H7 | 120.3° | 120.0° |
| C13 | C24 | C23 | H8 | 120.2° | 120.1° |
| C13 | C24 | C23 | H5 | 69.1° | 69.2° |
| C13 | C24 | C23 | H6 | 170.2° | 171.6° |
| C13 | C24 | H7 | H8 | 119.2° | 119.8° |
| C24 | C13 | C12 | H9 | 2.3° | 0.1° |
| C4 | C1 | C2 | N | 0.4° | 0.2° |
| C4 | C1 | C2 | C | 178.8° | 179.8° |
| C4 | C1 | C2 | H1 | 179.5° | 179.8° |
| C4 | C1 | C | H28 | 89.2° | 90.3° |
| C4 | C1 | C | H29 | 150.8° | 29.7° |
| C4 | C1 | C | H30 | 30.8° | 149.7° |
| N | C2 | C1 | H1 | 180.0° | 180.0° |
| N | C2 | C1 | C | 178.3° | 180.0° |
| C24 | C23 | N1 | H4 | 142.4° | 142.2° |
| C24 | C23 | H5 | H6 | 121.1° | 119.2° |
| C23 | C24 | H7 | H8 | 119.2° | 119.9° |
| C2 | C1 | C | H28 | 89.3° | 90.0° |
| C2 | C1 | C | H29 | 30.8° | 150.0° |
| C2 | C1 | C | H30 | 150.7° | 30.0° |
| C | C1 | C2 | H1 | 1.7° | 0.0° |
| C1 | C | H28 | H29 | 120.0° | 120.0° |
| C1 | C | H28 | H30 | 120.0° | 119.9° |
| C1 | C | H29 | H30 | 119.9° | 119.9° |
| H4 | N1 | C23 | H5 | 98.0° | 97.4° |
| H4 | N1 | C23 | H6 | 22.8° | 21.9° |
| H5 | C23 | C24 | H7 | 170.7° | 50.8° |
| H5 | C23 | C24 | H8 | 51.2° | 170.7° |
| H6 | C23 | C24 | H7 | 49.9° | 68.4° |
| H6 | C23 | C24 | H8 | 69.5° | 51.4° |
| H10 | C17 | C21 | H11 | 43.3° | 145.6° |
| H10 | C17 | C21 | H12 | 164.9° | 23.1° |
| H10 | C17 | C18 | H17 | 169.3° | 0.0° |
| H10 | C17 | C18 | H18 | 47.6° | 121.3° |
| H11 | C21 | C20 | H13 | 102.7° | 37.6° |
| H11 | C21 | C20 | H14 | 18.1° | 161.0° |
| H12 | C21 | C20 | H13 | 18.8° | 85.1° |
| H12 | C21 | C20 | H14 | 139.6° | 38.3° |
| H13 | C20 | C19 | H15 | 6.7° | 37.6° |
| H13 | C20 | C19 | H16 | 127.7° | 85.1° |
| H14 | C20 | C19 | H15 | 114.0° | 161.0° |
| H14 | C20 | C19 | H16 | 7.0° | 38.3° |
| H15 | C19 | C18 | H17 | 29.7° | 145.6° |
| H15 | C19 | C18 | H18 | 92.0° | 24.2° |
| H16 | C19 | C18 | H17 | 150.7° | 23.0° |
| H16 | C19 | C18 | H18 | 29.0° | 98.5° |
| H22 | C10 | H23 | H24 | 120.0° | 120.0° |
| H25 | C9 | H26 | H27 | 120.0° | 120.0° |
| H28 | C | H29 | H30 | 120.0° | 120.1° |
