|
|
| RDKit 3D |
|
|
| 30 34 0 0 0 0 0 0 0 0999 V2000 |
| -6.0589 -0.7164 -0.7342 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.5426 0.6655 -0.6451 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.9980 0.7379 -0.6436 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.4615 -0.0828 0.4647 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.9265 -1.4863 0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.4725 -1.5251 0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.0674 0.0148 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.1693 -0.3019 -0.4033 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.2319 -0.2097 -0.2526 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.7276 0.2185 0.9992 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.1594 0.5297 2.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.5499 0.4244 1.8747 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.4512 0.7907 3.0332 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.8921 2.2457 2.9752 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.1927 0.3602 1.2785 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.5976 0.7348 2.3735 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.0814 0.0291 0.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.6044 -0.3919 -1.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1583 -0.5718 -1.4341 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.8507 0.3504 -2.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.9315 -2.0458 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.6840 -0.6243 -1.8551 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8539 -0.3601 -1.1777 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5037 0.0533 0.1092 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.5320 0.3877 1.0137 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.8688 0.2985 0.6053 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.1919 -0.1181 -0.6882 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1852 -0.4559 -1.6055 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.5671 -0.2028 -1.0873 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 9.6772 -0.2744 -1.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1 2 1 0 |
| 2 3 1 0 |
| 3 4 1 0 |
| 4 5 1 0 |
| 5 6 1 0 |
| 4 7 1 0 |
| 7 8 2 0 |
| 8 9 1 0 |
| 9 10 2 0 |
| 10 11 1 0 |
| 11 12 2 0 |
| 12 13 1 0 |
| 13 14 1 0 |
| 10 15 1 0 |
| 15 16 2 0 |
| 15 17 1 0 |
| 17 18 2 0 |
| 18 19 1 0 |
| 19 20 1 0 |
| 19 21 1 0 |
| 18 22 1 0 |
| 22 23 1 0 |
| 23 24 2 0 |
| 24 25 1 0 |
| 25 26 2 0 |
| 26 27 1 0 |
| 27 28 2 0 |
| 27 29 1 0 |
| 29 30 3 0 |
| 6 1 1 0 |
| 12 7 1 0 |
| 19 9 1 0 |
| 24 17 1 0 |
| 28 23 1 0 |
| M END |
| $$$$ |
|
|
