ENAMINE-ZINC02617584 MOE2007 3D Structure written by MMmdl. 31 31 0 0 1 0 0 0 0 0999 V2000 4.7900 -4.3430 -4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -4.7980 -2.9990 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -4.2500 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -4.5720 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -4.2660 0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5490 -4.7470 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -4.8640 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -3.9990 2.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -2.8240 0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -2.0710 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -2.5240 -1.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -0.6250 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 0.0650 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 1.4290 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 2.1030 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 1.4290 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 0.0640 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 3.9500 0.2430 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -4.8900 -5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -3.2670 -4.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 -4.5990 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -4.7590 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -3.1730 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -4.0060 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -5.6360 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -2.4420 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.4590 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 1.9480 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 1.9540 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -0.4360 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 -6.1110 1.5510 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 M CHG 1 31 -1 M END