| 5SB2_1K2_A_1006 |
| RDKit 3D |
|
|
| 50 54 0 0 0 0 0 0 0 0999 V2000 |
| -6.7422 0.3528 -1.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.7804 0.3317 1.1072 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8775 1.5519 1.1805 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.4867 -0.3259 1.4351 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.8104 -2.1901 2.2441 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.9891 -1.4714 2.0442 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.9436 -0.1609 1.5461 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.2175 0.6247 1.3466 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.2416 0.4725 0.1022 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.7726 1.6465 0.6399 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.0519 2.0451 0.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.6974 1.2409 -0.7237 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 9.0659 2.9569 -0.2696 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.9272 3.1299 0.4901 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.0077 -0.2322 -0.8276 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.8037 -0.5035 0.7001 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.0732 0.0141 0.2848 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -5.3152 -0.8511 0.3476 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -5.1464 0.3065 1.2966 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.3342 -0.8237 -0.7783 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.9217 -2.0251 -1.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.8630 -2.0538 -2.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.2436 -0.8724 -2.8778 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.6829 0.3325 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.4288 -1.6258 1.9479 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.0232 -0.0718 0.3976 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.9114 1.8063 -1.0011 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.2431 0.1035 -1.2782 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.6959 0.4059 1.2486 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.8853 -3.7911 2.8717 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.3237 1.3132 -1.1413 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.9493 -1.9288 2.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.9842 1.6296 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.7308 0.7033 2.3132 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.2489 2.2560 1.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 9.9675 3.5488 -0.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.7453 3.9492 1.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.6137 -1.1495 -1.2612 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.5914 -1.4628 0.4564 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.9815 0.7142 -0.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.1863 -1.8267 0.8157 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.7345 1.2058 1.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.9397 0.0847 2.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6428 -2.9646 -0.7445 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.2969 -2.9999 -2.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.9748 -0.8899 -3.6812 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.9748 1.2610 -2.9529 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.3337 -2.1922 2.1456 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 9.5741 1.4126 -1.6529 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.6353 1.4236 0.8628 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2 3 2 0 |
| 2 4 1 0 |
| 5 6 2 0 |
| 6 7 1 0 |
| 7 8 1 0 |
| 9 10 2 0 |
| 10 11 1 0 |
| 11 12 2 0 |
| 11 14 1 0 |
| 13 14 2 0 |
| 9 15 1 0 |
| 2 16 1 0 |
| 17 16 1 0 |
| 17 18 1 0 |
| 17 19 1 0 |
| 18 19 1 0 |
| 18 20 1 0 |
| 1 20 2 0 |
| 20 21 1 0 |
| 21 22 2 0 |
| 22 23 1 0 |
| 23 24 2 0 |
| 1 24 1 0 |
| 4 25 2 0 |
| 5 25 1 0 |
| 8 26 1 0 |
| 9 26 1 0 |
| 12 27 1 0 |
| 13 27 1 0 |
| 12 28 1 0 |
| 15 28 2 0 |
| 4 29 1 0 |
| 7 29 2 0 |
| 5 30 1 0 |
| 1 31 1 0 |
| 6 32 1 0 |
| 8 33 1 0 |
| 8 34 1 0 |
| 10 35 1 0 |
| 13 36 1 0 |
| 14 37 1 0 |
| 15 38 1 0 |
| 16 39 1 0 |
| 17 40 1 6 |
| 18 41 1 1 |
| 19 42 1 0 |
| 19 43 1 0 |
| 21 44 1 0 |
| 22 45 1 0 |
| 23 46 1 0 |
| 24 47 1 0 |
| 25 48 1 0 |
| 27 49 1 0 |
| 29 50 1 0 |
| M END |
| $$$$ |
|
|
