| 5SB2_1K2_A_1006 |
| RDKit 3D |
|
|
| 50 54 0 0 0 0 0 0 0 0999 V2000 |
| -5.4922 1.0483 -2.2847 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.8027 -1.7234 1.5644 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3342 -2.7159 2.0497 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.5009 -1.2425 2.1015 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.0094 -1.0878 3.9758 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.9173 -0.3733 3.1945 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.6312 -0.0923 1.8497 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.6289 0.6699 1.0101 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8489 0.4124 0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.8882 1.6837 -0.3788 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.0911 2.0912 -0.9859 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.1539 1.1947 -0.9761 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.8594 3.0461 -2.0232 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 6.5476 3.2606 -1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.9958 -0.3803 0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.3605 -0.9658 0.5507 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.6657 -1.2516 0.0350 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -4.0481 -0.8141 -1.3649 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| -3.8649 -2.2743 -1.0472 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -5.4070 -0.1809 -1.6031 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6203 -0.7454 -1.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.8496 -0.1185 -1.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -7.8973 1.0959 -2.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.7169 1.6806 -2.5216 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.1955 -1.5255 3.4374 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 3.7793 -0.1506 0.8367 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.2114 1.7866 -1.6099 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 7.1777 -0.0416 -0.4481 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.4183 -0.5410 1.3054 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| 1.3818 -1.4224 5.6214 Cl 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.5833 1.5282 -2.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8599 -0.0446 3.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.8819 1.5988 1.5341 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 2.1928 0.9119 0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 4.0442 2.3602 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 8.5694 3.6759 -2.5422 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.9834 4.1656 -1.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 5.9871 -1.3764 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -1.9810 -0.0479 0.3603 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.4324 -1.2064 0.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -3.2452 -0.4008 -1.9747 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -4.7237 -2.9291 -0.9722 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -2.9860 -2.7768 -1.4381 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.6218 -1.6909 -0.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.7677 -0.5817 -1.0509 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -8.8513 1.5841 -2.2584 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -6.7446 2.6298 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| -0.8990 -2.0842 4.0515 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 9.1077 1.3391 -1.7356 H 0 0 0 0 0 0 0 0 0 0 0 0 |
| 0.2116 -0.3673 0.2520 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 1 |
| 18 41 1 6 |
| 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 |
| $$$$ |
|
|
