| 7BKA_4JC_D_201 |
| RDKit 3D |
|
|
| 23 23 0 0 0 0 0 0 0 0999 V2000 |
| 3.6445 -1.2007 1.3921 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2904 -0.4618 0.2041 S 0 0 2 0 0 0 0 0 0 0 0 0 |
| 3.8668 -0.7452 -1.0903 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.6075 1.1681 0.4914 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.5250 -0.4541 0.0493 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.7382 -0.5342 1.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.6523 -0.5289 1.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.9371 -0.3872 -1.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.4543 -0.3823 -1.3251 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.2594 -0.4563 -0.1786 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.7628 -0.4391 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.3164 0.9769 -0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.1530 1.5379 -0.2889 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.7644 1.7157 0.6598 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.1977 -0.6059 2.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.2624 -0.5894 1.9832 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.5476 -0.3432 -2.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.9103 -0.3275 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.2056 -1.0338 0.5073 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.0625 -0.9280 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.4071 0.9596 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.9173 1.5832 -1.0807 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.0619 1.4762 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1 2 2 0 |
| 2 3 2 0 |
| 2 4 1 6 |
| 2 5 1 0 |
| 5 6 2 0 |
| 6 7 1 0 |
| 5 8 1 0 |
| 8 9 2 0 |
| 7 10 2 0 |
| 9 10 1 0 |
| 10 11 1 0 |
| 11 12 1 0 |
| 4 13 1 0 |
| 4 14 1 0 |
| 6 15 1 0 |
| 7 16 1 0 |
| 8 17 1 0 |
| 9 18 1 0 |
| 11 19 1 0 |
| 11 20 1 0 |
| 12 21 1 0 |
| 12 22 1 0 |
| 12 23 1 0 |
| M END |
| $$$$ |
|
|
