FLQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.36Å | 1.21Å | |
| C1 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C1 | C13 | sing | 1.39Å | 1.41Å | Aromatic |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C2 | C3 | sing | 1.40Å | 1.41Å | Aromatic |
| C2 | H2 | sing | 1.09Å | 1.08Å | |
| C3 | O2 | sing | 1.37Å | 1.45Å | |
| C3 | C11 | doub | 1.40Å | 1.42Å | Aromatic |
| O2 | C4 | sing | 1.37Å | 1.45Å | |
| C4 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C4 | C9 | doub | 1.40Å | 1.46Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | H5 | sing | 1.09Å | 1.08Å | |
| C6 | O3 | sing | 1.36Å | 1.40Å | |
| C6 | C7 | sing | 1.39Å | 1.42Å | Aromatic |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C7 | C8 | doub | 1.40Å | 1.41Å | Aromatic |
| C7 | H7 | sing | 1.09Å | 1.08Å | |
| C8 | C9 | sing | 1.41Å | 1.42Å | Aromatic |
| C8 | H8 | sing | 1.09Å | 1.08Å | |
| C9 | C10 | sing | 1.52Å | 1.52Å | |
| C10 | C11 | sing | 1.52Å | 1.50Å | |
| C10 | C5' | sing | 1.49Å | 1.53Å | |
| C10 | O8' | sing | 1.46Å | 1.47Å | |
| C11 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | H12 | sing | 1.09Å | 1.08Å | |
| C13 | H13 | sing | 1.09Å | 1.08Å | |
| C14 | O4 | doub | 1.24Å | 1.21Å | |
| C14 | N1 | sing | 1.40Å | 1.33Å | |
| C14 | C1' | sing | 1.45Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.55Å | |
| C16 | C20 | sing | 1.53Å | 97.48Å | |
| C16 | H161 | sing | 1.10Å | 1.10Å | |
| C16 | H162 | sing | 1.10Å | 1.10Å | |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C17 | H171 | sing | 1.10Å | 1.10Å | |
| C17 | H172 | sing | 1.10Å | 1.10Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | H181 | sing | 1.10Å | 1.10Å | |
| C18 | H182 | sing | 1.10Å | 1.10Å | |
| C19 | N1 | sing | 1.45Å | 1.48Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| N1 | HN1 | sing | 1.01Å | 1.00Å | |
| C1' | C2' | sing | 1.41Å | 1.42Å | Aromatic |
| C1' | C6' | doub | 1.40Å | 1.33Å | Aromatic |
| C2' | C3' | doub | 1.40Å | 1.40Å | Aromatic |
| C2' | H2' | sing | 1.09Å | 1.08Å | |
| C3' | C4' | sing | 1.38Å | 1.36Å | Aromatic |
| C3' | H3' | sing | 1.08Å | 1.08Å | |
| C4' | C5' | doub | 1.38Å | 1.46Å | Aromatic |
| C4' | C9' | sing | 1.46Å | 1.48Å | |
| C5' | C6' | sing | 1.39Å | 1.32Å | Aromatic |
| C6' | H6' | sing | 1.08Å | 1.08Å | |
| O8' | C9' | sing | 1.37Å | 1.46Å | |
| C9' | O9' | doub | 1.21Å | 1.23Å | |
| C20 | C21 | sing | 1.53Å | 0.00Å | |
| C20 | H201 | sing | 1.10Å | 0.00Å | |
| C20 | H202 | sing | 1.10Å | 0.00Å | |
| C21 | N2 | sing | 1.44Å | 0.00Å | |
| C21 | H211 | sing | 1.09Å | 0.00Å | |
| C21 | H212 | sing | 1.09Å | 0.00Å | |
| N2 | C22 | sing | 1.39Å | 0.00Å | |
| N2 | HN2 | sing | 1.02Å | 0.00Å | |
| C22 | O5 | doub | 1.23Å | 0.00Å | |
| C22 | C23 | sing | 1.49Å | 0.00Å | |
| C23 | H231 | sing | 1.10Å | 0.00Å | |
| C23 | H232 | sing | 1.10Å | 0.00Å | |
| C23 | H233 | sing | 1.10Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 119.8° | 120.1° |
| O1 | C1 | C13 | 119.5° | 120.1° |
| C1 | O1 | HO1 | 109.5° | 110.3° |
| C2 | C1 | C13 | 120.7° | 119.8° |
| C1 | C2 | C3 | 120.1° | 120.1° |
| C1 | C2 | H2 | 119.9° | 119.3° |
| C1 | C13 | C12 | 119.4° | 120.1° |
| C1 | C13 | H13 | 120.3° | 119.9° |
| C3 | C2 | H2 | 119.9° | 120.6° |
| C2 | C3 | O2 | 117.7° | 115.6° |
| C2 | C3 | C11 | 119.5° | 120.8° |
| O2 | C3 | C11 | 122.8° | 123.6° |
| C3 | O2 | C4 | 116.6° | 118.5° |
| C3 | C11 | C10 | 123.0° | 120.0° |
| C3 | C11 | C12 | 119.6° | 118.3° |
| O2 | C4 | C5 | 117.7° | 115.7° |
| O2 | C4 | C9 | 122.9° | 123.6° |
| C5 | C4 | C9 | 119.4° | 120.8° |
| C4 | C5 | C6 | 121.1° | 120.2° |
| C4 | C5 | H5 | 119.4° | 120.5° |
| C4 | C9 | C8 | 118.9° | 118.3° |
| C4 | C9 | C10 | 120.8° | 120.0° |
| C6 | C5 | H5 | 119.4° | 119.3° |
| C5 | C6 | O3 | 118.2° | 120.1° |
| C5 | C6 | C7 | 120.0° | 119.8° |
| O3 | C6 | C7 | 121.8° | 120.1° |
| C6 | O3 | HO3 | 109.5° | 110.3° |
| C6 | C7 | C8 | 120.4° | 120.0° |
| C6 | C7 | H7 | 119.8° | 119.8° |
| C8 | C7 | H7 | 119.8° | 120.2° |
| C7 | C8 | C9 | 120.1° | 120.9° |
| C7 | C8 | H8 | 119.9° | 118.4° |
| C9 | C8 | H8 | 119.9° | 120.7° |
| C8 | C9 | C10 | 120.3° | 121.7° |
| C9 | C10 | C11 | 113.9° | 112.3° |
| C9 | C10 | C5' | 114.3° | 112.9° |
| C9 | C10 | O8' | 107.4° | 108.2° |
| C11 | C10 | C5' | 112.7° | 112.9° |
| C11 | C10 | O8' | 103.5° | 108.2° |
| C10 | C11 | C12 | 117.4° | 121.7° |
| C5' | C10 | O8' | 103.8° | 101.6° |
| C10 | C5' | C4' | 108.9° | 109.8° |
| C10 | C5' | C6' | 130.2° | 130.1° |
| C10 | O8' | C9' | 112.3° | 113.3° |
| C11 | C12 | C13 | 120.6° | 120.9° |
| C11 | C12 | H12 | 119.7° | 120.7° |
| C13 | C12 | H12 | 119.7° | 118.4° |
| C12 | C13 | H13 | 120.3° | 120.1° |
| O4 | C14 | N1 | 120.1° | 122.5° |
| O4 | C14 | C1' | 117.4° | 120.5° |
| N1 | C14 | C1' | 122.5° | 117.0° |
| C14 | N1 | C19 | 126.1° | 123.5° |
| C14 | N1 | HN1 | 116.9° | 119.3° |
| C14 | C1' | C2' | 116.0° | 119.6° |
| C14 | C1' | C6' | 122.4° | 119.7° |
| C17 | C16 | C20 | 116.7° | 113.4° |
| C17 | C16 | H161 | 107.1° | 109.0° |
| C17 | C16 | H162 | 105.4° | 109.7° |
| C16 | C17 | C18 | 113.0° | 111.1° |
| C16 | C17 | H171 | 108.3° | 109.6° |
| C16 | C17 | H172 | 107.5° | 109.8° |
| C20 | C16 | H161 | 107.1° | 107.9° |
| C20 | C16 | H162 | 105.5° | 110.0° |
| C16 | C20 | C21 | 90.0° | 114.9° |
| C16 | C20 | H201 | 90.0° | 109.1° |
| C16 | C20 | H202 | 90.0° | 108.1° |
| H161 | C16 | H162 | 115.3° | 106.5° |
| C18 | C17 | H171 | 108.3° | 109.5° |
| C18 | C17 | H172 | 107.5° | 109.4° |
| C17 | C18 | C19 | 112.9° | 112.5° |
| C17 | C18 | H181 | 108.4° | 109.1° |
| C17 | C18 | H182 | 107.6° | 109.6° |
| H171 | C17 | H172 | 112.3° | 107.4° |
| C19 | C18 | H181 | 108.3° | 108.5° |
| C19 | C18 | H182 | 107.6° | 109.8° |
| C18 | C19 | N1 | 108.1° | 112.6° |
| C18 | C19 | H191 | 109.9° | 111.1° |
| C18 | C19 | H192 | 110.2° | 110.0° |
| H181 | C18 | H182 | 112.2° | 107.1° |
| N1 | C19 | H191 | 109.9° | 107.8° |
| N1 | C19 | H192 | 110.2° | 106.9° |
| C19 | N1 | HN1 | 116.9° | 117.1° |
| H191 | C19 | H192 | 108.4° | 108.3° |
| C2' | C1' | C6' | 121.5° | 120.7° |
| C1' | C2' | C3' | 121.4° | 120.5° |
| C1' | C2' | H2' | 119.3° | 119.4° |
| C1' | C6' | C5' | 119.5° | 118.4° |
| C1' | C6' | H6' | 120.3° | 120.2° |
| C3' | C2' | H2' | 119.3° | 120.1° |
| C2' | C3' | C4' | 115.7° | 117.4° |
| C2' | C3' | H3' | 122.1° | 120.7° |
| C4' | C3' | H3' | 122.1° | 121.9° |
| C3' | C4' | C5' | 121.0° | 122.8° |
| C3' | C4' | C9' | 130.5° | 128.1° |
| C5' | C4' | C9' | 108.5° | 109.2° |
| C4' | C5' | C6' | 120.9° | 120.1° |
| C4' | C9' | O8' | 106.4° | 106.2° |
| C4' | C9' | O9' | 128.7° | 126.8° |
| C5' | C6' | H6' | 120.3° | 121.4° |
| O8' | C9' | O9' | 124.9° | 127.0° |
| C21 | C20 | H201 | 90.0° | 108.8° |
| C21 | C20 | H202 | 90.0° | 109.0° |
| C20 | C21 | N2 | 90.0° | 112.6° |
| C20 | C21 | H211 | 90.0° | 111.7° |
| C20 | C21 | H212 | 90.0° | 109.8° |
| H201 | C20 | H202 | 90.0° | 106.6° |
| N2 | C21 | H211 | 90.0° | 107.9° |
| N2 | C21 | H212 | 90.0° | 106.8° |
| C21 | N2 | C22 | 90.0° | 123.5° |
| C21 | N2 | HN2 | 90.0° | 118.3° |
| H211 | C21 | H212 | 90.0° | 107.7° |
| C22 | N2 | HN2 | 90.0° | 118.3° |
| N2 | C22 | O5 | 90.0° | 126.1° |
| N2 | C22 | C23 | 90.0° | 114.3° |
| O5 | C22 | C23 | 90.0° | 119.6° |
| C22 | C23 | H231 | 90.0° | 112.4° |
| C22 | C23 | H232 | 90.0° | 112.4° |
| C22 | C23 | H233 | 90.0° | 115.3° |
| H231 | C23 | H232 | 90.0° | 105.3° |
| H231 | C23 | H233 | 90.0° | 105.3° |
| H232 | C23 | H233 | 90.0° | 105.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | C13 | 179.7° | 179.9° |
| O1 | C1 | C2 | C3 | 179.6° | 179.9° |
| O1 | C1 | C2 | H2 | 0.4° | 0.2° |
| O1 | C1 | C13 | C12 | 179.9° | 179.7° |
| O1 | C1 | C13 | H13 | 0.1° | 0.0° |
| C2 | C1 | O1 | HO1 | 64.2° | 149.9° |
| C1 | C2 | C3 | H2 | 180.0° | 179.7° |
| C1 | C2 | C3 | O2 | 180.0° | 179.7° |
| C1 | C2 | C3 | C11 | 0.1° | 0.6° |
| C2 | C1 | C13 | C12 | 0.3° | 0.2° |
| C2 | C1 | C13 | H13 | 179.7° | 180.0° |
| C13 | C1 | O1 | HO1 | 116.1° | 30.2° |
| C13 | C1 | C2 | C3 | 0.0° | 0.2° |
| C13 | C1 | C2 | H2 | 179.9° | 179.9° |
| C1 | C13 | C12 | C11 | 0.7° | 0.1° |
| C1 | C13 | C12 | H13 | 180.0° | 179.8° |
| C1 | C13 | C12 | H12 | 179.3° | 179.5° |
| C2 | C3 | O2 | C11 | 179.9° | 179.7° |
| C2 | C3 | O2 | C4 | 179.9° | 169.7° |
| C2 | C3 | C11 | C10 | 179.0° | 178.1° |
| C2 | C3 | C11 | C12 | 0.5° | 0.6° |
| H2 | C2 | C3 | O2 | 0.1° | 0.1° |
| H2 | C2 | C3 | C11 | 180.0° | 179.7° |
| C3 | O2 | C4 | C5 | 179.9° | 169.7° |
| C3 | O2 | C4 | C9 | 0.2° | 10.5° |
| O2 | C3 | C11 | C10 | 1.1° | 1.7° |
| O2 | C3 | C11 | C12 | 179.7° | 179.7° |
| C11 | C3 | O2 | C4 | 0.2° | 10.5° |
| C3 | C11 | C10 | C9 | 1.7° | 12.7° |
| C3 | C11 | C10 | C12 | 178.6° | 178.6° |
| C3 | C11 | C10 | C5' | 134.0° | 116.3° |
| C3 | C11 | C10 | O8' | 114.5° | 132.1° |
| C3 | C11 | C12 | C13 | 0.8° | 0.2° |
| C3 | C11 | C12 | H12 | 179.2° | 179.8° |
| O2 | C4 | C5 | C9 | 179.7° | 179.9° |
| O2 | C4 | C5 | C6 | 180.0° | 179.6° |
| O2 | C4 | C5 | H5 | 0.0° | 0.0° |
| O2 | C4 | C9 | C8 | 179.7° | 179.7° |
| O2 | C4 | C9 | C10 | 0.9° | 1.8° |
| C4 | C5 | C6 | H5 | 180.0° | 179.6° |
| C4 | C5 | C6 | O3 | 179.8° | 179.9° |
| C4 | C5 | C6 | C7 | 0.0° | 0.2° |
| C5 | C4 | C9 | C8 | 0.6° | 0.4° |
| C5 | C4 | C9 | C10 | 179.3° | 178.1° |
| C9 | C4 | C5 | C6 | 0.3° | 0.5° |
| C9 | C4 | C5 | H5 | 179.7° | 179.9° |
| C4 | C9 | C8 | C7 | 0.6° | 0.1° |
| C4 | C9 | C8 | C10 | 178.8° | 178.5° |
| C4 | C9 | C8 | H8 | 179.4° | 179.8° |
| C4 | C9 | C10 | C11 | 1.6° | 12.8° |
| C4 | C9 | C10 | C5' | 133.1° | 116.2° |
| C4 | C9 | C10 | O8' | 112.4° | 132.1° |
| C5 | C6 | O3 | C7 | 179.8° | 180.0° |
| C5 | C6 | O3 | HO3 | 39.4° | 34.0° |
| C5 | C6 | C7 | C8 | 0.1° | 0.2° |
| C5 | C6 | C7 | H7 | 179.9° | 179.9° |
| H5 | C5 | C6 | O3 | 0.2° | 0.3° |
| H5 | C5 | C6 | C7 | 180.0° | 179.8° |
| O3 | C6 | C7 | C8 | 179.8° | 179.8° |
| O3 | C6 | C7 | H7 | 0.2° | 0.1° |
| C7 | C6 | O3 | HO3 | 140.7° | 146.0° |
| C6 | C7 | C8 | H7 | 180.0° | 179.7° |
| C6 | C7 | C8 | C9 | 0.3° | 0.3° |
| C6 | C7 | C8 | H8 | 179.8° | 179.4° |
| C7 | C8 | C9 | H8 | 180.0° | 179.7° |
| C7 | C8 | C9 | C10 | 179.3° | 178.4° |
| H7 | C7 | C8 | C9 | 179.8° | 179.9° |
| H7 | C7 | C8 | H8 | 0.2° | 0.2° |
| C8 | C9 | C10 | C11 | 179.6° | 168.8° |
| C8 | C9 | C10 | C5' | 48.1° | 62.2° |
| C8 | C9 | C10 | O8' | 66.4° | 49.4° |
| H8 | C8 | C9 | C10 | 0.7° | 1.3° |
| C9 | C10 | C11 | C5' | 132.3° | 129.0° |
| C9 | C10 | C11 | O8' | 116.2° | 119.3° |
| C9 | C10 | C5' | O8' | 116.6° | 115.7° |
| C9 | C10 | C11 | C12 | 179.7° | 168.7° |
| C9 | C10 | C5' | C4' | 118.0° | 115.7° |
| C9 | C10 | C5' | C6' | 63.5° | 64.3° |
| C9 | C10 | O8' | C9' | 122.8° | 119.1° |
| C11 | C10 | C5' | O8' | 111.3° | 115.7° |
| C10 | C11 | C12 | C13 | 179.4° | 178.4° |
| C10 | C11 | C12 | H12 | 0.6° | 1.2° |
| C11 | C10 | C5' | C4' | 110.0° | 115.6° |
| C11 | C10 | C5' | C6' | 68.6° | 64.4° |
| C11 | C10 | O8' | C9' | 116.4° | 119.0° |
| C5' | C10 | C11 | C12 | 47.4° | 62.3° |
| C10 | C5' | C6' | C1' | 179.0° | 180.0° |
| C10 | C5' | C4' | C3' | 179.5° | 180.0° |
| C10 | C5' | C4' | C6' | 178.7° | 180.0° |
| C10 | C5' | C4' | C9' | 0.8° | 0.0° |
| C10 | C5' | C6' | H6' | 1.0° | 0.0° |
| C5' | C10 | O8' | C9' | 1.4° | 0.0° |
| O8' | C10 | C11 | C12 | 64.1° | 49.3° |
| O8' | C10 | C5' | C4' | 1.3° | 0.0° |
| C10 | O8' | C9' | C4' | 1.0° | 0.0° |
| O8' | C10 | C5' | C6' | 179.9° | 180.0° |
| C10 | O8' | C9' | O9' | 179.4° | 180.0° |
| C11 | C12 | C13 | H12 | 180.0° | 179.6° |
| C11 | C12 | C13 | H13 | 179.3° | 179.9° |
| H12 | C12 | C13 | H13 | 0.7° | 0.3° |
| O4 | C14 | N1 | C1' | 179.7° | 178.9° |
| O4 | C14 | N1 | C19 | 0.6° | 0.0° |
| O4 | C14 | N1 | HN1 | 179.4° | 175.8° |
| O4 | C14 | C1' | C2' | 0.4° | 28.1° |
| O4 | C14 | C1' | C6' | 179.9° | 151.9° |
| C14 | N1 | C19 | C18 | 126.6° | 90.0° |
| C14 | N1 | C19 | HN1 | 180.0° | 175.9° |
| C14 | N1 | C19 | H191 | 6.6° | 147.1° |
| C14 | N1 | C19 | H192 | 112.8° | 30.9° |
| N1 | C14 | C1' | C2' | 179.3° | 153.0° |
| N1 | C14 | C1' | C6' | 0.4° | 27.0° |
| C1' | C14 | N1 | C19 | 179.7° | 178.9° |
| C1' | C14 | N1 | HN1 | 0.3° | 3.1° |
| C14 | C1' | C2' | C6' | 179.8° | 180.0° |
| C14 | C1' | C2' | C3' | 180.0° | 180.0° |
| C14 | C1' | C2' | H2' | 0.0° | 0.0° |
| C14 | C1' | C6' | C5' | 179.6° | 180.0° |
| C14 | C1' | C6' | H6' | 0.4° | 0.0° |
| C17 | C16 | C20 | H161 | 120.0° | 120.9° |
| C17 | C16 | C20 | H162 | 116.7° | 123.3° |
| C17 | C16 | H161 | H162 | 117.0° | 118.4° |
| C16 | C17 | C18 | H171 | 120.0° | 121.2° |
| C16 | C17 | C18 | H172 | 118.5° | 121.4° |
| C16 | C17 | H171 | H172 | 118.6° | 119.2° |
| C16 | C17 | C18 | C19 | 110.3° | 179.5° |
| C16 | C17 | C18 | H181 | 9.7° | 60.0° |
| C16 | C17 | C18 | H182 | 131.2° | 57.0° |
| C17 | C16 | C20 | C21 | 90.0° | 62.5° |
| C17 | C16 | C20 | H201 | 90.0° | 60.0° |
| C17 | C16 | C20 | H202 | 90.0° | 175.6° |
| C20 | C16 | H161 | H162 | 117.0° | 118.1° |
| C20 | C16 | C17 | C18 | 55.7° | 179.7° |
| C20 | C16 | C17 | H171 | 64.3° | 59.1° |
| C20 | C16 | C17 | H172 | 174.1° | 58.6° |
| C16 | C20 | C21 | H201 | 90.0° | 122.6° |
| C16 | C20 | C21 | H202 | 90.0° | 121.5° |
| C16 | C20 | H201 | H202 | 90.0° | 116.6° |
| C16 | C20 | C21 | N2 | 90.0° | 61.7° |
| C16 | C20 | C21 | H211 | 90.0° | 60.0° |
| C16 | C20 | C21 | H212 | 90.0° | 179.4° |
| H161 | C16 | C17 | C18 | 64.3° | 60.1° |
| H161 | C16 | C17 | H171 | 175.7° | 61.1° |
| H161 | C16 | C17 | H172 | 54.1° | 178.8° |
| H161 | C16 | C20 | C21 | 90.0° | 176.6° |
| H161 | C16 | C20 | H201 | 90.0° | 60.9° |
| H161 | C16 | C20 | H202 | 90.0° | 54.7° |
| H162 | C16 | C17 | C18 | 172.3° | 56.3° |
| H162 | C16 | C17 | H171 | 52.3° | 177.4° |
| H162 | C16 | C17 | H172 | 69.2° | 64.9° |
| H162 | C16 | C20 | C21 | 90.0° | 60.9° |
| H162 | C16 | C20 | H201 | 90.0° | 176.7° |
| H162 | C16 | C20 | H202 | 90.0° | 61.1° |
| C18 | C17 | H171 | H172 | 118.5° | 118.7° |
| C17 | C18 | C19 | H181 | 120.0° | 120.9° |
| C17 | C18 | C19 | H182 | 118.5° | 122.3° |
| C17 | C18 | H181 | H182 | 118.6° | 118.5° |
| C17 | C18 | C19 | N1 | 158.4° | 61.0° |
| C17 | C18 | C19 | H191 | 81.6° | 60.0° |
| C17 | C18 | C19 | H192 | 37.8° | 179.8° |
| H171 | C17 | C18 | C19 | 129.7° | 59.3° |
| H171 | C17 | C18 | H181 | 110.3° | 61.2° |
| H171 | C17 | C18 | H182 | 11.2° | 178.2° |
| H172 | C17 | C18 | C19 | 8.2° | 58.1° |
| H172 | C17 | C18 | H181 | 128.2° | 178.6° |
| H172 | C17 | C18 | H182 | 110.3° | 64.4° |
| C19 | C18 | H181 | H182 | 118.6° | 118.5° |
| C18 | C19 | N1 | H191 | 120.0° | 122.8° |
| C18 | C19 | N1 | H192 | 120.5° | 121.0° |
| C18 | C19 | H191 | H192 | 120.6° | 120.9° |
| C18 | C19 | N1 | HN1 | 53.4° | 85.9° |
| H181 | C18 | C19 | N1 | 38.4° | 178.1° |
| H181 | C18 | C19 | H191 | 158.4° | 60.9° |
| H181 | C18 | C19 | H192 | 82.2° | 58.9° |
| H182 | C18 | C19 | N1 | 83.1° | 61.3° |
| H182 | C18 | C19 | H191 | 36.9° | 177.7° |
| H182 | C18 | C19 | H192 | 156.4° | 57.8° |
| N1 | C19 | H191 | H192 | 120.5° | 115.3° |
| H191 | C19 | N1 | HN1 | 173.4° | 37.0° |
| H192 | C19 | N1 | HN1 | 67.2° | 153.2° |
| C1' | C2' | C3' | H2' | 180.0° | 179.9° |
| C1' | C2' | C3' | C4' | 0.1° | 0.1° |
| C1' | C2' | C3' | H3' | 180.0° | 180.0° |
| C2' | C1' | C6' | C5' | 0.2° | 0.0° |
| C2' | C1' | C6' | H6' | 179.9° | 180.0° |
| C6' | C1' | C2' | C3' | 0.2° | 0.0° |
| C6' | C1' | C2' | H2' | 179.8° | 180.0° |
| C1' | C6' | C5' | C4' | 0.7° | 0.0° |
| C1' | C6' | C5' | H6' | 180.0° | 180.0° |
| C2' | C3' | C4' | H3' | 180.0° | 179.9° |
| C2' | C3' | C4' | C5' | 0.4° | 0.0° |
| C2' | C3' | C4' | C9' | 180.0° | 180.0° |
| H2' | C2' | C3' | C4' | 180.0° | 180.0° |
| H2' | C2' | C3' | H3' | 0.0° | 0.1° |
| C3' | C4' | C5' | C9' | 179.7° | 179.9° |
| C3' | C4' | C5' | C6' | 0.8° | 0.0° |
| C3' | C4' | C9' | O8' | 179.6° | 180.0° |
| C3' | C4' | C9' | O9' | 0.0° | 0.1° |
| H3' | C3' | C4' | C5' | 179.5° | 180.0° |
| H3' | C3' | C4' | C9' | 0.0° | 0.1° |
| C4' | C5' | C6' | H6' | 179.4° | 180.0° |
| C5' | C4' | C9' | O8' | 0.1° | 0.0° |
| C5' | C4' | C9' | O9' | 179.7° | 180.0° |
| C9' | C4' | C5' | C6' | 179.5° | 180.0° |
| C4' | C9' | O8' | O9' | 179.6° | 180.0° |
| C21 | C20 | H201 | H202 | 90.0° | 117.4° |
| C20 | C21 | N2 | H211 | 90.0° | 123.8° |
| C20 | C21 | N2 | H212 | 90.0° | 120.6° |
| C20 | C21 | H211 | H212 | 90.0° | 120.7° |
| C20 | C21 | N2 | C22 | 90.0° | 120.0° |
| C20 | C21 | N2 | HN2 | 90.0° | 60.0° |
| H201 | C20 | C21 | N2 | 90.0° | 175.7° |
| H201 | C20 | C21 | H211 | 90.0° | 62.7° |
| H201 | C20 | C21 | H212 | 90.0° | 56.8° |
| H202 | C20 | C21 | N2 | 90.0° | 59.8° |
| H202 | C20 | C21 | H211 | 90.0° | 178.5° |
| H202 | C20 | C21 | H212 | 90.0° | 59.1° |
| N2 | C21 | H211 | H212 | 90.0° | 115.0° |
| C21 | N2 | C22 | HN2 | 90.0° | 180.0° |
| C21 | N2 | C22 | O5 | 90.0° | 0.0° |
| C21 | N2 | C22 | C23 | 90.0° | 179.9° |
| H211 | C21 | N2 | C22 | 90.0° | 3.8° |
| H211 | C21 | N2 | HN2 | 90.0° | 176.2° |
| H212 | C21 | N2 | C22 | 90.0° | 119.4° |
| H212 | C21 | N2 | HN2 | 90.0° | 60.6° |
| N2 | C22 | O5 | C23 | 90.0° | 179.9° |
| N2 | C22 | C23 | H231 | 90.0° | 120.8° |
| N2 | C22 | C23 | H232 | 90.0° | 120.5° |
| N2 | C22 | C23 | H233 | 90.0° | 0.1° |
| HN2 | N2 | C22 | O5 | 90.0° | 180.0° |
| HN2 | N2 | C22 | C23 | 90.0° | 0.1° |
| O5 | C22 | C23 | H231 | 90.0° | 59.3° |
| O5 | C22 | C23 | H232 | 90.0° | 59.4° |
| O5 | C22 | C23 | H233 | 90.0° | 180.0° |
| C22 | C23 | H231 | H232 | 90.0° | 122.8° |
| C22 | C23 | H231 | H233 | 90.0° | 126.3° |
| C22 | C23 | H232 | H233 | 90.0° | 126.3° |
| H231 | C23 | H232 | H233 | 90.0° | 110.9° |
