G6M
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C30 | doub | 1.21Å | 1.22Å | |
| C20 | C10 | sing | 1.53Å | 1.53Å | |
| C20 | N29 | sing | 1.46Å | 1.45Å | |
| C10 | O11 | sing | 1.46Å | 1.44Å | |
| C10 | C9 | sing | 1.54Å | 1.53Å | |
| C30 | N29 | sing | 1.35Å | 1.33Å | |
| C30 | C31 | sing | 1.51Å | 1.51Å | |
| O11 | C12 | sing | 1.34Å | 1.45Å | |
| C9 | N8 | sing | 1.47Å | 1.44Å | |
| C31 | CL33 | sing | 1.80Å | 1.79Å | |
| C12 | N8 | sing | 1.34Å | 1.31Å | |
| C12 | O13 | doub | 1.21Å | 1.22Å | |
| N8 | C4 | sing | 1.40Å | 1.39Å | |
| C4 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C4 | C5 | sing | 1.39Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | F7 | sing | 1.35Å | 1.34Å | |
| C2 | C1 | doub | 1.39Å | 1.37Å | Aromatic |
| C6 | C1 | sing | 1.39Å | 1.38Å | Aromatic |
| C1 | N14 | sing | 1.40Å | 1.39Å | |
| N14 | C19 | sing | 1.47Å | 1.44Å | |
| N14 | C15 | sing | 1.47Å | 1.45Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C18 | O17 | sing | 1.43Å | 1.42Å | |
| C16 | O17 | sing | 1.43Å | 1.42Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| N29 | HN29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C30 | N29 | 121.9° | 120.0° |
| O32 | C30 | C31 | 119.5° | 120.0° |
| C10 | C20 | N29 | 116.1° | 109.4° |
| C20 | C10 | O11 | 111.2° | 110.5° |
| C20 | C10 | C9 | 113.3° | 110.5° |
| C20 | C10 | H10 | 107.9° | 110.6° |
| C10 | C20 | H20 | 107.8° | 109.4° |
| C10 | C20 | H201 | 107.8° | 109.5° |
| C20 | N29 | C30 | 121.0° | 120.0° |
| N29 | C20 | H20 | 107.8° | 109.5° |
| N29 | C20 | H201 | 107.8° | 109.5° |
| C20 | N29 | HN29 | 119.5° | 120.0° |
| O11 | C10 | C9 | 107.3° | 104.0° |
| C10 | O11 | C12 | 105.7° | 109.5° |
| O11 | C10 | H10 | 109.0° | 110.5° |
| C10 | C9 | N8 | 99.7° | 103.8° |
| C9 | C10 | H10 | 108.0° | 110.5° |
| C10 | C9 | H91 | 111.9° | 110.5° |
| C10 | C9 | H9 | 111.9° | 110.6° |
| N29 | C30 | C31 | 118.7° | 120.0° |
| C30 | N29 | HN29 | 119.5° | 120.0° |
| C30 | C31 | CL33 | 113.2° | 109.4° |
| C30 | C31 | H311 | 108.5° | 109.4° |
| C30 | C31 | H31 | 108.5° | 109.5° |
| O11 | C12 | N8 | 108.9° | 113.8° |
| O11 | C12 | O13 | 123.5° | 123.1° |
| C9 | N8 | C12 | 114.1° | 108.9° |
| C9 | N8 | C4 | 122.1° | 125.6° |
| N8 | C9 | H91 | 111.9° | 110.6° |
| N8 | C9 | H9 | 111.8° | 110.6° |
| CL33 | C31 | H311 | 108.5° | 109.5° |
| CL33 | C31 | H31 | 108.5° | 109.5° |
| N8 | C12 | O13 | 127.6° | 123.1° |
| C12 | N8 | C4 | 123.8° | 125.5° |
| N8 | C4 | C3 | 119.6° | 120.0° |
| N8 | C4 | C5 | 120.6° | 120.0° |
| C3 | C4 | C5 | 119.8° | 120.0° |
| C4 | C3 | C2 | 120.2° | 120.0° |
| C4 | C3 | H3 | 119.9° | 120.0° |
| C4 | C5 | C6 | 120.0° | 120.0° |
| C4 | C5 | H5 | 120.0° | 120.0° |
| C3 | C2 | F7 | 120.3° | 120.0° |
| C3 | C2 | C1 | 119.9° | 119.9° |
| C2 | C3 | H3 | 119.9° | 120.0° |
| C5 | C6 | C1 | 120.0° | 120.0° |
| C5 | C6 | H6 | 120.0° | 120.0° |
| C6 | C5 | H5 | 120.0° | 120.0° |
| F7 | C2 | C1 | 119.9° | 120.0° |
| C2 | C1 | C6 | 120.2° | 120.0° |
| C2 | C1 | N14 | 119.8° | 120.0° |
| C6 | C1 | N14 | 120.0° | 120.0° |
| C1 | C6 | H6 | 120.0° | 120.0° |
| C1 | N14 | C19 | 119.9° | 111.0° |
| C1 | N14 | C15 | 117.9° | 111.0° |
| C19 | N14 | C15 | 122.1° | 110.7° |
| N14 | C19 | C18 | 104.3° | 109.3° |
| N14 | C19 | H191 | 110.7° | 109.5° |
| N14 | C19 | H19 | 110.8° | 109.5° |
| N14 | C15 | C16 | 110.7° | 109.3° |
| N14 | C15 | H15 | 109.2° | 109.5° |
| N14 | C15 | H151 | 109.2° | 109.5° |
| C19 | C18 | O17 | 107.8° | 109.3° |
| C19 | C18 | H18 | 109.9° | 109.5° |
| C19 | C18 | H181 | 109.9° | 109.5° |
| C18 | C19 | H191 | 110.7° | 109.6° |
| C18 | C19 | H19 | 110.7° | 109.5° |
| C15 | C16 | O17 | 112.4° | 109.2° |
| C16 | C15 | H15 | 109.2° | 109.5° |
| C16 | C15 | H151 | 109.2° | 109.5° |
| C15 | C16 | H16 | 108.7° | 109.5° |
| C15 | C16 | H161 | 108.7° | 109.5° |
| C18 | O17 | C16 | 111.3° | 113.8° |
| O17 | C18 | H18 | 109.9° | 109.5° |
| O17 | C18 | H181 | 109.9° | 109.5° |
| O17 | C16 | H16 | 108.7° | 109.5° |
| O17 | C16 | H161 | 108.7° | 109.5° |
| H15 | C15 | H151 | 109.5° | 109.5° |
| H16 | C16 | H161 | 109.5° | 109.6° |
| H18 | C18 | H181 | 109.5° | 109.5° |
| H191 | C19 | H19 | 109.5° | 109.5° |
| H20 | C20 | H201 | 109.5° | 109.5° |
| H311 | C31 | H31 | 109.4° | 109.5° |
| H91 | C9 | H9 | 109.5° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C30 | N29 | C20 | 2.0° | 0.1° |
| O32 | C30 | N29 | C31 | 179.9° | 179.9° |
| O32 | C30 | C31 | CL33 | 132.4° | 0.0° |
| O32 | C30 | C31 | H311 | 11.8° | 120.0° |
| O32 | C30 | C31 | H31 | 107.0° | 120.0° |
| O32 | C30 | N29 | HN29 | 178.0° | 180.0° |
| C10 | C20 | N29 | H20 | 121.0° | 120.0° |
| C10 | C20 | N29 | H201 | 121.0° | 120.0° |
| C20 | C10 | O11 | C9 | 124.4° | 118.6° |
| C20 | C10 | O11 | H10 | 118.9° | 122.8° |
| C20 | C10 | C9 | H10 | 119.4° | 122.7° |
| C10 | C20 | N29 | C30 | 167.4° | 180.0° |
| C20 | C10 | O11 | C12 | 113.1° | 118.6° |
| C20 | C10 | C9 | N8 | 104.5° | 118.7° |
| C10 | C20 | H20 | H201 | 117.0° | 120.0° |
| C20 | C10 | C9 | H91 | 137.1° | 122.8° |
| C20 | C10 | C9 | H9 | 13.8° | 0.1° |
| C10 | C20 | N29 | HN29 | 12.6° | 0.0° |
| N29 | C20 | C10 | O11 | 79.1° | 61.5° |
| N29 | C20 | C10 | C9 | 41.9° | 176.0° |
| C20 | N29 | C30 | HN29 | 180.0° | 179.9° |
| C20 | N29 | C30 | C31 | 178.1° | 180.0° |
| N29 | C20 | C10 | H10 | 161.3° | 61.3° |
| N29 | C20 | H20 | H201 | 117.0° | 120.0° |
| O11 | C10 | C9 | H10 | 117.4° | 118.6° |
| O11 | C10 | C9 | N8 | 18.6° | 0.0° |
| C10 | O11 | C12 | N8 | 1.7° | 0.0° |
| C10 | O11 | C12 | O13 | 177.7° | 180.0° |
| O11 | C10 | C20 | H20 | 159.9° | 58.5° |
| O11 | C10 | C20 | H201 | 41.8° | 178.6° |
| O11 | C10 | C9 | H91 | 99.7° | 118.6° |
| O11 | C10 | C9 | H9 | 137.0° | 118.6° |
| C9 | C10 | O11 | C12 | 11.3° | 0.0° |
| C10 | C9 | N8 | H91 | 118.4° | 118.5° |
| C10 | C9 | N8 | H9 | 118.4° | 118.6° |
| C10 | C9 | N8 | C12 | 21.2° | 0.0° |
| C10 | C9 | N8 | C4 | 158.4° | 180.0° |
| C9 | C10 | C20 | H20 | 79.1° | 56.0° |
| C9 | C10 | C20 | H201 | 162.8° | 64.0° |
| C10 | C9 | H91 | H9 | 124.6° | 122.8° |
| N29 | C30 | C31 | CL33 | 47.7° | 180.0° |
| C30 | N29 | C20 | H20 | 46.5° | 60.0° |
| C30 | N29 | C20 | H201 | 71.6° | 60.1° |
| N29 | C30 | C31 | H311 | 168.3° | 60.0° |
| N29 | C30 | C31 | H31 | 72.9° | 60.0° |
| C30 | C31 | CL33 | H311 | 120.6° | 120.0° |
| C30 | C31 | CL33 | H31 | 120.6° | 120.0° |
| C30 | C31 | H311 | H31 | 118.3° | 120.0° |
| C31 | C30 | N29 | HN29 | 1.9° | 0.1° |
| O11 | C12 | N8 | C9 | 15.5° | 0.0° |
| O11 | C12 | N8 | O13 | 179.4° | 180.0° |
| O11 | C12 | N8 | C4 | 164.1° | 180.0° |
| C12 | O11 | C10 | H10 | 128.0° | 118.6° |
| C9 | N8 | C12 | C4 | 179.5° | 180.0° |
| C9 | N8 | C12 | O13 | 163.9° | 180.0° |
| C9 | N8 | C4 | C3 | 46.6° | 180.0° |
| C9 | N8 | C4 | C5 | 133.1° | 0.0° |
| N8 | C9 | C10 | H10 | 136.0° | 118.6° |
| N8 | C9 | H91 | H9 | 124.6° | 122.8° |
| CL33 | C31 | H311 | H31 | 118.3° | 120.0° |
| C12 | N8 | C4 | C3 | 133.9° | 0.0° |
| C12 | N8 | C4 | C5 | 46.4° | 180.0° |
| C12 | N8 | C9 | H91 | 97.2° | 118.5° |
| C12 | N8 | C9 | H9 | 139.6° | 118.6° |
| O13 | C12 | N8 | C4 | 16.6° | 0.0° |
| N8 | C4 | C3 | C5 | 179.7° | 180.0° |
| N8 | C4 | C3 | C2 | 179.6° | 180.0° |
| N8 | C4 | C5 | C6 | 179.8° | 180.0° |
| N8 | C4 | C5 | H5 | 0.2° | 0.0° |
| N8 | C4 | C3 | H3 | 0.4° | 0.0° |
| C4 | N8 | C9 | H91 | 83.2° | 61.5° |
| C4 | N8 | C9 | H9 | 40.0° | 61.4° |
| C4 | C3 | C2 | H3 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 0.4° | 0.0° |
| C4 | C3 | C2 | F7 | 179.7° | 180.0° |
| C4 | C3 | C2 | C1 | 0.6° | 0.0° |
| C3 | C4 | C5 | H5 | 179.5° | 180.0° |
| C5 | C4 | C3 | C2 | 0.7° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C1 | 0.1° | 0.0° |
| C4 | C5 | C6 | H6 | 179.9° | 179.7° |
| C5 | C4 | C3 | H3 | 179.3° | 180.0° |
| C3 | C2 | F7 | C1 | 179.7° | 179.9° |
| C3 | C2 | C1 | C6 | 0.3° | 0.0° |
| C3 | C2 | C1 | N14 | 179.8° | 179.7° |
| C5 | C6 | C1 | C2 | 0.1° | 0.0° |
| C5 | C6 | C1 | H6 | 180.0° | 179.7° |
| C5 | C6 | C1 | N14 | 179.6° | 179.7° |
| F7 | C2 | C1 | C6 | 180.0° | 180.0° |
| F7 | C2 | C1 | N14 | 0.5° | 0.2° |
| F7 | C2 | C3 | H3 | 0.3° | 0.1° |
| C2 | C1 | C6 | N14 | 179.5° | 179.8° |
| C2 | C1 | N14 | C19 | 76.4° | 120.2° |
| C2 | C1 | N14 | C15 | 104.9° | 116.2° |
| C2 | C1 | C6 | H6 | 180.0° | 179.8° |
| C1 | C2 | C3 | H3 | 179.4° | 180.0° |
| C6 | C1 | N14 | C19 | 104.1° | 60.0° |
| C6 | C1 | N14 | C15 | 74.6° | 63.6° |
| C1 | C6 | C5 | H5 | 179.8° | 180.0° |
| C1 | N14 | C19 | C15 | 178.7° | 123.8° |
| C1 | N14 | C19 | C18 | 132.0° | 177.6° |
| C1 | N14 | C15 | C16 | 144.4° | 177.6° |
| N14 | C1 | C6 | H6 | 0.4° | 0.0° |
| C1 | N14 | C15 | H15 | 95.4° | 62.4° |
| C1 | N14 | C15 | H151 | 24.2° | 57.6° |
| C1 | N14 | C19 | H191 | 12.8° | 57.6° |
| C1 | N14 | C19 | H19 | 108.9° | 62.4° |
| N14 | C19 | C18 | H191 | 119.1° | 119.9° |
| N14 | C19 | C18 | H19 | 119.2° | 120.0° |
| C19 | N14 | C15 | C16 | 36.9° | 58.6° |
| N14 | C19 | C18 | O17 | 62.8° | 56.9° |
| C19 | N14 | C15 | H15 | 83.3° | 61.3° |
| C19 | N14 | C15 | H151 | 157.1° | 178.6° |
| N14 | C19 | C18 | H18 | 57.0° | 176.8° |
| N14 | C19 | C18 | H181 | 177.5° | 63.1° |
| N14 | C19 | H191 | H19 | 122.4° | 120.1° |
| C15 | N14 | C19 | C18 | 49.3° | 58.6° |
| N14 | C15 | C16 | H15 | 120.2° | 120.0° |
| N14 | C15 | C16 | H151 | 120.2° | 120.0° |
| N14 | C15 | C16 | O17 | 36.3° | 56.8° |
| N14 | C15 | H15 | H151 | 119.4° | 120.1° |
| N14 | C15 | C16 | H16 | 156.7° | 63.0° |
| N14 | C15 | C16 | H161 | 84.2° | 176.8° |
| C15 | N14 | C19 | H191 | 168.5° | 178.6° |
| C15 | N14 | C19 | H19 | 69.8° | 61.4° |
| C19 | C18 | O17 | H18 | 119.7° | 120.0° |
| C19 | C18 | O17 | H181 | 119.7° | 120.0° |
| C19 | C18 | O17 | C16 | 71.2° | 58.7° |
| C19 | C18 | H18 | H181 | 120.8° | 120.1° |
| C18 | C19 | H191 | H19 | 122.4° | 120.1° |
| C15 | C16 | O17 | C18 | 56.3° | 58.7° |
| C15 | C16 | O17 | H16 | 120.5° | 119.9° |
| C15 | C16 | O17 | H161 | 120.4° | 119.9° |
| C16 | C15 | H15 | H151 | 119.5° | 120.1° |
| C15 | C16 | H16 | H161 | 118.6° | 120.1° |
| C18 | O17 | C16 | H16 | 176.8° | 61.2° |
| C18 | O17 | C16 | H161 | 64.1° | 178.6° |
| O17 | C18 | H18 | H181 | 120.8° | 120.1° |
| O17 | C18 | C19 | H191 | 178.1° | 176.8° |
| O17 | C18 | C19 | H19 | 56.4° | 63.1° |
| O17 | C16 | C15 | H15 | 83.9° | 63.1° |
| O17 | C16 | C15 | H151 | 156.5° | 176.8° |
| O17 | C16 | H16 | H161 | 118.6° | 120.1° |
| C16 | O17 | C18 | H18 | 48.5° | 178.7° |
| C16 | O17 | C18 | H181 | 169.0° | 61.3° |
| H6 | C6 | C5 | H5 | 0.1° | 0.3° |
| H10 | C10 | C20 | H20 | 40.4° | 178.7° |
| H10 | C10 | C20 | H201 | 77.7° | 58.7° |
| H10 | C10 | C9 | H91 | 17.7° | 0.0° |
| H10 | C10 | C9 | H9 | 105.6° | 122.8° |
| H15 | C15 | C16 | H16 | 36.6° | 177.0° |
| H15 | C15 | C16 | H161 | 155.7° | 56.8° |
| H151 | C15 | C16 | H16 | 83.1° | 56.9° |
| H151 | C15 | C16 | H161 | 36.0° | 63.2° |
| H18 | C18 | C19 | H191 | 62.2° | 63.3° |
| H18 | C18 | C19 | H19 | 176.1° | 56.8° |
| H181 | C18 | C19 | H191 | 58.3° | 56.8° |
| H181 | C18 | C19 | H19 | 63.4° | 176.9° |
| H20 | C20 | N29 | HN29 | 133.5° | 119.9° |
| H201 | C20 | N29 | HN29 | 108.4° | 120.0° |
