ENAMINE-ZINC04485291 MOE2007 3D Structure written by MMmdl. 39 41 0 0 0 0 0 0 0 0999 V2000 1.5320 16.1340 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 14.8460 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 13.6250 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 12.3920 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 12.3860 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 13.5900 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 14.8120 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 16.3970 -0.2340 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 11.2240 0.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 9.9080 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 9.5230 0.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 8.9180 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 7.5930 0.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 6.5800 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8340 6.7350 0.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 5.3850 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 4.0850 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 3.2490 0.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 1.8690 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 1.2910 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 2.0790 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 3.4230 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 4.0120 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 16.7140 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 16.7260 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 15.9530 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 13.6450 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 11.4630 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 13.5570 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 11.3810 0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 9.0870 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 9.0700 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 3.6520 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 1.3160 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.2100 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 1.5530 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 4.0500 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 5.2880 0.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1150 6.0920 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 30 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 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 2 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END