PUBCHEM-ZINC06614444 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -1.8800 0.7200 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -0.3780 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.7060 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -2.3950 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -1.0670 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -0.7210 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7710 -2.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.1140 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -4.9790 -0.9490 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -4.7740 -3.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -6.0590 -3.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -6.7150 -4.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -8.1740 -4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -9.2540 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -10.5330 -4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -10.7420 -5.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -9.6800 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -8.3840 -6.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -7.1510 -6.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -7.0160 -7.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -6.1600 -6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -4.8440 -6.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -12.0040 -3.3940 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 1.6710 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 0.5060 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 0.7780 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.1610 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 -1.9530 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -3.1810 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 0.0480 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -1.6120 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -0.3500 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -2.2880 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -9.0910 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -11.7470 -6.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -9.8540 -7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -4.3780 -6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 M END