RDKit 3D 50 53 0 0 0 0 0 0 0 0999 V2000 -2.5173 3.1928 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8657 1.9863 2.3012 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3693 1.9710 0.9594 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9605 0.5435 0.6278 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5337 0.3950 -0.8305 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0929 -0.9529 -1.1499 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8947 -2.0777 -1.2269 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -3.1340 -1.4123 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1717 -2.7033 -1.5486 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1733 -1.3971 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5548 -0.3879 -1.6412 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2337 -0.4206 0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 0.5408 0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7776 0.1591 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3661 -1.0818 -0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 -1.2215 -0.5904 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5779 -0.1266 -0.4332 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0421 1.1153 -0.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6478 1.2413 0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8051 2.6714 0.5241 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2905 1.8912 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 2.6837 0.8212 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0438 3.8998 1.1727 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8557 2.0389 0.6942 O 0 0 0 0 0 1 0 0 0 0 0 0 4.6065 -2.1766 -0.5726 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3465 -2.1100 -1.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9468 -2.7284 -0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3384 -2.7630 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1314 -2.1953 -0.8797 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5467 -1.5963 -1.9961 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1551 -1.5536 -2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8453 -2.2434 -0.7374 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.9420 4.0530 2.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9335 3.1571 3.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4294 3.2942 3.0389 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 2.3019 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5318 2.6625 0.8295 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1531 0.2300 1.3005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7963 -0.1248 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7394 1.0999 -1.0834 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3687 0.6285 -1.4998 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5649 -1.4395 0.2669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4586 -0.2127 0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1484 -2.1980 -0.8428 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6485 -0.2311 -0.5696 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6895 1.9778 0.0382 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3257 -3.1710 0.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7911 -3.2264 0.9882 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1649 -1.1646 -2.7789 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -1.0968 -2.9950 H 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 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 22 24 1 0 15 25 1 0 7 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 29 32 1 0 10 6 1 0 21 13 2 0 19 14 1 0 31 26 1 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 4 39 1 0 5 40 1 0 5 41 1 0 12 42 1 0 12 43 1 0 16 44 1 0 17 45 1 0 18 46 1 0 27 47 1 0 28 48 1 0 30 49 1 0 31 50 1 0 M CHG 1 24 -1 M END