FMX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C6 | doub | 1.21Å | 1.20Å | |
| C6 | N2 | sing | 1.35Å | 1.39Å | |
| C6 | C5 | sing | 1.51Å | 1.50Å | |
| N2 | N1 | sing | 1.40Å | 1.41Å | |
| N2 | C3 | sing | 1.34Å | 1.37Å | |
| N1 | C21 | sing | 1.40Å | 1.41Å | |
| N1 | HN11 | sing | 0.97Å | 1.02Å | |
| C21 | C22 | doub | 1.39Å | 1.38Å | Aromatic |
| C21 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | H221 | sing | 1.08Å | 1.10Å | |
| C23 | C24 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | H231 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | H241 | sing | 1.08Å | 1.10Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | H251 | sing | 1.08Å | 1.10Å | |
| C26 | H261 | sing | 1.08Å | 1.10Å | |
| C3 | O4 | sing | 1.34Å | 1.33Å | |
| C3 | O3 | doub | 1.21Å | 1.20Å | |
| O4 | C5 | sing | 1.46Å | 1.47Å | |
| C5 | C7 | sing | 1.53Å | 1.46Å | |
| C5 | C8 | sing | 1.51Å | 1.51Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C7 | H73 | sing | 1.09Å | 1.12Å | |
| C8 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | H91 | sing | 1.08Å | 1.10Å | |
| C10 | C11 | doub | 1.39Å | 1.42Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | sing | 1.39Å | 1.37Å | Aromatic |
| C11 | O14 | sing | 1.36Å | 1.38Å | |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | H121 | sing | 1.08Å | 1.10Å | |
| C13 | H131 | sing | 1.08Å | 1.10Å | |
| O14 | C15 | sing | 1.36Å | 1.39Å | |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | H161 | sing | 1.08Å | 1.10Å | |
| C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | H171 | sing | 1.08Å | 1.10Å | |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | H181 | sing | 1.08Å | 1.10Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | H191 | sing | 1.08Å | 1.10Å | |
| C20 | H201 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C6 | N2 | 126.7° | 127.2° |
| O6 | C6 | C5 | 128.0° | 127.1° |
| N2 | C6 | C5 | 105.2° | 105.7° |
| C6 | N2 | N1 | 123.9° | 124.4° |
| C6 | N2 | C3 | 112.2° | 111.3° |
| C6 | C5 | O4 | 102.9° | 103.7° |
| C6 | C5 | C7 | 110.5° | 110.6° |
| C6 | C5 | C8 | 111.6° | 110.7° |
| N1 | N2 | C3 | 123.8° | 124.3° |
| N2 | N1 | C21 | 124.2° | 120.0° |
| N2 | N1 | HN11 | 107.0° | 120.0° |
| N2 | C3 | O4 | 108.7° | 112.4° |
| N2 | C3 | O3 | 127.0° | 123.8° |
| C21 | N1 | HN11 | 107.0° | 120.1° |
| N1 | C21 | C22 | 120.9° | 120.1° |
| N1 | C21 | C26 | 119.3° | 120.1° |
| C22 | C21 | C26 | 119.8° | 119.8° |
| C21 | C22 | C23 | 120.7° | 119.9° |
| C21 | C22 | H221 | 119.2° | 120.0° |
| C21 | C26 | C25 | 119.9° | 120.0° |
| C21 | C26 | H261 | 120.0° | 120.0° |
| C23 | C22 | H221 | 120.1° | 120.0° |
| C22 | C23 | C24 | 119.7° | 120.1° |
| C22 | C23 | H231 | 120.3° | 120.0° |
| C24 | C23 | H231 | 120.0° | 119.9° |
| C23 | C24 | C25 | 120.0° | 120.1° |
| C23 | C24 | H241 | 119.8° | 120.0° |
| C25 | C24 | H241 | 120.2° | 119.9° |
| C24 | C25 | C26 | 119.8° | 120.1° |
| C24 | C25 | H251 | 120.0° | 120.0° |
| C26 | C25 | H251 | 120.2° | 120.0° |
| C25 | C26 | H261 | 120.1° | 120.0° |
| O4 | C3 | O3 | 124.2° | 123.7° |
| C3 | O4 | C5 | 110.9° | 106.9° |
| O4 | C5 | C7 | 108.1° | 110.5° |
| O4 | C5 | C8 | 109.4° | 110.5° |
| C7 | C5 | C8 | 113.7° | 110.5° |
| C5 | C7 | H71 | 111.8° | 109.5° |
| C5 | C7 | H72 | 110.5° | 109.6° |
| C5 | C7 | H73 | 111.8° | 109.4° |
| C5 | C8 | C9 | 124.6° | 120.0° |
| C5 | C8 | C13 | 115.3° | 119.9° |
| H71 | C7 | H72 | 111.8° | 109.4° |
| H71 | C7 | H73 | 98.6° | 109.4° |
| H72 | C7 | H73 | 111.8° | 109.4° |
| C9 | C8 | C13 | 120.1° | 120.1° |
| C8 | C9 | C10 | 118.8° | 120.1° |
| C8 | C9 | H91 | 120.6° | 120.0° |
| C8 | C13 | C12 | 121.5° | 120.1° |
| C8 | C13 | H131 | 119.5° | 120.0° |
| C10 | C9 | H91 | 120.6° | 120.0° |
| C9 | C10 | C11 | 120.5° | 119.9° |
| C9 | C10 | H101 | 118.7° | 120.0° |
| C11 | C10 | H101 | 120.8° | 120.0° |
| C10 | C11 | C12 | 119.9° | 119.9° |
| C10 | C11 | O14 | 122.7° | 120.1° |
| C12 | C11 | O14 | 117.4° | 120.1° |
| C11 | C12 | C13 | 119.3° | 120.0° |
| C11 | C12 | H121 | 120.1° | 120.0° |
| C11 | O14 | C15 | 122.8° | 106.8° |
| C13 | C12 | H121 | 120.6° | 120.0° |
| C12 | C13 | H131 | 118.9° | 120.0° |
| O14 | C15 | C16 | 121.1° | 120.1° |
| O14 | C15 | C20 | 118.2° | 120.0° |
| C16 | C15 | C20 | 120.7° | 119.9° |
| C15 | C16 | C17 | 119.5° | 119.9° |
| C15 | C16 | H161 | 119.7° | 120.1° |
| C15 | C20 | C19 | 119.7° | 119.9° |
| C15 | C20 | H201 | 120.3° | 120.1° |
| C17 | C16 | H161 | 120.7° | 120.0° |
| C16 | C17 | C18 | 120.0° | 120.0° |
| C16 | C17 | H171 | 120.5° | 120.0° |
| C18 | C17 | H171 | 119.5° | 119.9° |
| C17 | C18 | C19 | 119.9° | 120.1° |
| C17 | C18 | H181 | 119.6° | 119.9° |
| C19 | C18 | H181 | 120.5° | 119.9° |
| C18 | C19 | C20 | 120.1° | 120.0° |
| C18 | C19 | H191 | 120.5° | 120.0° |
| C20 | C19 | H191 | 119.4° | 120.0° |
| C19 | C20 | H201 | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C6 | N2 | C5 | 176.0° | 179.9° |
| O6 | C6 | N2 | N1 | 1.5° | 0.1° |
| O6 | C6 | N2 | C3 | 174.3° | 180.0° |
| O6 | C6 | C5 | O4 | 176.6° | 180.0° |
| O6 | C6 | C5 | C7 | 61.3° | 61.5° |
| O6 | C6 | C5 | C8 | 66.2° | 61.4° |
| C6 | N2 | N1 | C3 | 175.3° | 179.9° |
| C6 | N2 | N1 | C21 | 85.1° | 90.1° |
| C6 | N2 | N1 | HN11 | 40.2° | 90.0° |
| C6 | N2 | C3 | O4 | 3.5° | 0.0° |
| C6 | N2 | C3 | O3 | 173.1° | 180.0° |
| N2 | C6 | C5 | O4 | 0.6° | 0.0° |
| N2 | C6 | C5 | C7 | 114.6° | 118.5° |
| N2 | C6 | C5 | C8 | 117.8° | 118.6° |
| C5 | C6 | N2 | N1 | 177.5° | 180.0° |
| C5 | C6 | N2 | C3 | 1.6° | 0.0° |
| C6 | C5 | O4 | C3 | 2.8° | 0.0° |
| C6 | C5 | O4 | C7 | 117.0° | 118.6° |
| C6 | C5 | O4 | C8 | 118.8° | 118.7° |
| C6 | C5 | C7 | C8 | 126.4° | 123.0° |
| C6 | C5 | C7 | H71 | 54.7° | 54.9° |
| C6 | C5 | C7 | H72 | 180.0° | 175.0° |
| C6 | C5 | C7 | H73 | 54.7° | 65.0° |
| C6 | C5 | C8 | C9 | 21.5° | 147.8° |
| C6 | C5 | C8 | C13 | 159.8° | 31.9° |
| N2 | N1 | C21 | HN11 | 125.3° | 179.9° |
| N2 | N1 | C21 | C22 | 18.4° | 180.0° |
| N2 | N1 | C21 | C26 | 162.8° | 0.2° |
| N1 | N2 | C3 | O4 | 179.3° | 180.0° |
| N1 | N2 | C3 | O3 | 2.7° | 0.0° |
| C3 | N2 | N1 | C21 | 99.6° | 90.0° |
| C3 | N2 | N1 | HN11 | 135.1° | 90.0° |
| N2 | C3 | O4 | O3 | 176.7° | 180.0° |
| N2 | C3 | O4 | C5 | 3.9° | 0.0° |
| N1 | C21 | C22 | C26 | 178.9° | 179.8° |
| N1 | C21 | C22 | C23 | 179.2° | 180.0° |
| N1 | C21 | C22 | H221 | 0.8° | 0.1° |
| N1 | C21 | C26 | C25 | 179.3° | 179.8° |
| N1 | C21 | C26 | H261 | 0.7° | 0.1° |
| HN11 | N1 | C21 | C22 | 143.6° | 0.0° |
| HN11 | N1 | C21 | C26 | 37.5° | 179.7° |
| C21 | C22 | C23 | H221 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.1° | 0.0° |
| C21 | C22 | C23 | H231 | 179.9° | 179.9° |
| C22 | C21 | C26 | C25 | 0.4° | 0.5° |
| C22 | C21 | C26 | H261 | 179.6° | 179.9° |
| C26 | C21 | C22 | C23 | 0.3° | 0.2° |
| C26 | C21 | C22 | H221 | 179.7° | 179.8° |
| C21 | C26 | C25 | C24 | 0.2° | 0.5° |
| C21 | C26 | C25 | H261 | 180.0° | 179.6° |
| C21 | C26 | C25 | H251 | 179.8° | 179.8° |
| C22 | C23 | C24 | H231 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 0.1° | 0.0° |
| C22 | C23 | C24 | H241 | 179.8° | 180.0° |
| H221 | C22 | C23 | C24 | 180.0° | 179.9° |
| H221 | C22 | C23 | H231 | 0.1° | 0.0° |
| C23 | C24 | C25 | H241 | 180.0° | 180.0° |
| C23 | C24 | C25 | C26 | 0.0° | 0.2° |
| C23 | C24 | C25 | H251 | 180.0° | 180.0° |
| H231 | C23 | C24 | C25 | 179.9° | 179.9° |
| H231 | C23 | C24 | H241 | 0.1° | 0.1° |
| C24 | C25 | C26 | H251 | 180.0° | 179.8° |
| C24 | C25 | C26 | H261 | 179.7° | 179.9° |
| H241 | C24 | C25 | C26 | 179.9° | 179.8° |
| H241 | C24 | C25 | H251 | 0.1° | 0.0° |
| H251 | C25 | C26 | H261 | 0.3° | 0.2° |
| C3 | O4 | C5 | C7 | 114.2° | 118.6° |
| C3 | O4 | C5 | C8 | 121.5° | 118.7° |
| O3 | C3 | O4 | C5 | 172.8° | 180.0° |
| O4 | C5 | C7 | C8 | 121.6° | 122.7° |
| O4 | C5 | C7 | H71 | 57.2° | 59.3° |
| O4 | C5 | C7 | H72 | 68.0° | 60.7° |
| O4 | C5 | C7 | H73 | 166.7° | 179.3° |
| O4 | C5 | C8 | C9 | 91.8° | 33.5° |
| O4 | C5 | C8 | C13 | 86.9° | 146.3° |
| C5 | C7 | H71 | H72 | 124.6° | 120.1° |
| C5 | C7 | H71 | H73 | 117.7° | 120.0° |
| C5 | C7 | H72 | H73 | 125.2° | 120.0° |
| C7 | C5 | C8 | C9 | 147.3° | 89.2° |
| C7 | C5 | C8 | C13 | 34.0° | 91.0° |
| C8 | C5 | C7 | H71 | 178.9° | 178.0° |
| C8 | C5 | C7 | H72 | 53.6° | 62.0° |
| C8 | C5 | C7 | H73 | 71.7° | 58.0° |
| C5 | C8 | C9 | C13 | 178.6° | 179.8° |
| C5 | C8 | C9 | C10 | 178.4° | 180.0° |
| C5 | C8 | C9 | H91 | 1.6° | 0.0° |
| C5 | C8 | C13 | C12 | 178.5° | 179.8° |
| C5 | C8 | C13 | H131 | 1.5° | 0.2° |
| H71 | C7 | H72 | H73 | 109.5° | 119.9° |
| C8 | C9 | C10 | H91 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 0.1° | 0.0° |
| C8 | C9 | C10 | H101 | 180.0° | 180.0° |
| C9 | C8 | C13 | C12 | 0.3° | 0.4° |
| C9 | C8 | C13 | H131 | 179.7° | 180.0° |
| C13 | C8 | C9 | C10 | 0.2° | 0.2° |
| C13 | C8 | C9 | H91 | 179.8° | 179.8° |
| C8 | C13 | C12 | C11 | 0.1° | 0.4° |
| C8 | C13 | C12 | H131 | 180.0° | 179.6° |
| C8 | C13 | C12 | H121 | 179.9° | 179.7° |
| C9 | C10 | C11 | H101 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 0.3° | 0.1° |
| C9 | C10 | C11 | O14 | 179.9° | 180.0° |
| H91 | C9 | C10 | C11 | 179.9° | 180.0° |
| H91 | C9 | C10 | H101 | 0.0° | 0.1° |
| C10 | C11 | C12 | O14 | 179.8° | 180.0° |
| C10 | C11 | C12 | C13 | 0.3° | 0.1° |
| C10 | C11 | C12 | H121 | 179.8° | 180.0° |
| C10 | C11 | O14 | C15 | 42.5° | 94.8° |
| H101 | C10 | C11 | C12 | 179.7° | 180.0° |
| H101 | C10 | C11 | O14 | 0.1° | 0.0° |
| C11 | C12 | C13 | H121 | 180.0° | 179.9° |
| C11 | C12 | C13 | H131 | 179.9° | 180.0° |
| C12 | C11 | O14 | C15 | 137.2° | 85.2° |
| O14 | C11 | C12 | C13 | 180.0° | 179.8° |
| O14 | C11 | C12 | H121 | 0.0° | 0.0° |
| C11 | O14 | C15 | C16 | 59.7° | 5.6° |
| C11 | O14 | C15 | C20 | 120.9° | 174.7° |
| H121 | C12 | C13 | H131 | 0.1° | 0.1° |
| O14 | C15 | C16 | C20 | 179.3° | 179.7° |
| O14 | C15 | C16 | C17 | 179.8° | 180.0° |
| O14 | C15 | C16 | H161 | 0.2° | 0.1° |
| O14 | C15 | C20 | C19 | 179.6° | 179.7° |
| O14 | C15 | C20 | H201 | 0.4° | 0.3° |
| C15 | C16 | C17 | H161 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.4° | 0.0° |
| C15 | C16 | C17 | H171 | 179.6° | 180.0° |
| C16 | C15 | C20 | C19 | 0.2° | 0.6° |
| C16 | C15 | C20 | H201 | 179.8° | 180.0° |
| C20 | C15 | C16 | C17 | 0.4° | 0.3° |
| C20 | C15 | C16 | H161 | 179.6° | 179.8° |
| C15 | C20 | C19 | C18 | 0.0° | 0.6° |
| C15 | C20 | C19 | H201 | 180.0° | 179.4° |
| C15 | C20 | C19 | H191 | 180.0° | 179.7° |
| C16 | C17 | C18 | H171 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.1° | 0.0° |
| C16 | C17 | C18 | H181 | 179.9° | 180.0° |
| H161 | C16 | C17 | C18 | 179.6° | 180.0° |
| H161 | C16 | C17 | H171 | 0.4° | 0.0° |
| C17 | C18 | C19 | H181 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.3° |
| C17 | C18 | C19 | H191 | 179.9° | 180.0° |
| H171 | C17 | C18 | C19 | 179.9° | 180.0° |
| H171 | C17 | C18 | H181 | 0.1° | 0.0° |
| C18 | C19 | C20 | H191 | 180.0° | 179.7° |
| C18 | C19 | C20 | H201 | 180.0° | 180.0° |
| H181 | C18 | C19 | C20 | 179.9° | 179.7° |
| H181 | C18 | C19 | H191 | 0.1° | 0.0° |
| H191 | C19 | C20 | H201 | 0.1° | 0.3° |
