| 6YYO_Q1K_BBB_323 |
| RDKit 3D |
|
|
| 33 35 0 0 0 0 0 0 0 0999 V2000 |
| 2.3331 0.7962 1.7927 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.3395 0.5474 -1.5222 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.9188 0.4028 0.8549 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.0623 -0.0066 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.5160 -0.1467 1.1655 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.6343 0.7173 2.0966 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.8409 0.2430 0.4781 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.0178 -0.8242 -0.7177 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7660 -0.0592 0.2342 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.9630 0.4305 -0.8657 S 0 0 2 0 0 0 0 0 0 0 0 0 |
| -3.9942 1.8228 -1.2556 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.3232 -0.5806 -2.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3417 0.0221 -0.5354 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.4813 0.3136 0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.6595 -0.2813 -0.4023 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.5091 0.1259 1.1701 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.8055 -0.0992 1.1746 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.1283 -0.7031 -0.0235 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.9636 -0.3193 -0.0118 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.6280 1.2810 2.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.6159 0.2425 -2.5353 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.3188 1.6429 -1.4789 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.9236 1.4952 0.9528 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.6163 -0.0182 1.5863 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.7602 0.4375 -1.9359 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.0748 -1.0947 -1.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.2470 0.1703 2.1773 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.5364 -1.2439 1.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.0336 1.1130 3.0228 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.9112 -1.2545 -1.7008 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.7339 -0.2412 -3.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.1067 -1.6223 -2.0442 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.3864 -0.4691 -2.5133 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2 4 1 0 |
| 3 5 1 0 |
| 1 6 2 0 |
| 1 7 1 0 |
| 9 10 2 0 |
| 10 11 2 0 |
| 10 12 1 1 |
| 2 13 1 0 |
| 10 13 1 0 |
| 3 13 1 0 |
| 4 14 1 0 |
| 7 14 1 0 |
| 5 14 1 0 |
| 7 15 2 0 |
| 6 16 1 0 |
| 16 17 2 0 |
| 8 18 2 0 |
| 17 18 1 0 |
| 8 19 1 0 |
| 15 19 1 0 |
| 16 19 1 0 |
| 1 20 1 0 |
| 2 21 1 0 |
| 2 22 1 0 |
| 3 23 1 0 |
| 3 24 1 0 |
| 4 25 1 0 |
| 4 26 1 0 |
| 5 27 1 0 |
| 5 28 1 0 |
| 6 29 1 0 |
| 8 30 1 0 |
| 12 31 1 0 |
| 12 32 1 0 |
| 12 33 1 0 |
| M END |
| $$$$ |
|
|
