ENAMINE-ZINC04869368 MOE2007 3D Structure written by MMmdl. 52 54 0 0 0 0 0 0 0 0999 V2000 12.4310 5.8320 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7090 5.9920 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 5.2510 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0770 4.3750 -0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8100 4.2330 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9790 4.9420 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2470 3.2690 -2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 1.8130 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 1.2740 -1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8520 1.7170 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 0.2980 -2.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 -0.4510 -1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -0.2940 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -1.1000 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -2.0840 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 -2.2340 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -1.4230 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 -1.6640 -4.3290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -0.9640 1.6330 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -0.2310 2.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 -2.2960 2.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 0.0030 1.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -0.5750 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -0.1600 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 1.3510 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 1.8710 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 1.4650 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3420 6.4020 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0410 6.6810 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9570 5.3500 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5360 4.8150 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0050 2.5730 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7920 3.8240 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 1.0120 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7510 2.5790 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 0.0570 -3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 0.4350 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -2.7360 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -2.9930 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.2270 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -1.6670 1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -0.5090 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -0.6420 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.6080 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 1.8380 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 1.4800 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 2.9630 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 1.9600 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 1.8100 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1770 2.4480 -1.8070 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7080 3.0860 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5970 1.7560 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 50 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END