PUBCHEM-ZINC00690319 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.2150 2.3040 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 0.9710 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -0.0050 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 0.3520 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.6850 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 2.6600 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 2.0740 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 2.1340 -1.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 3.3310 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2850 4.2960 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5520 4.2390 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5060 5.1470 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 6.0730 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9510 6.0990 -0.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 5.2540 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 1.0670 -1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 0.0230 -1.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -1.0360 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -0.7030 -2.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3170 -1.4400 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9210 0.9260 -3.2570 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1810 -0.6260 -2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8420 -0.1990 -4.6780 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -0.8740 -0.4370 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 3.0660 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.6930 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -1.0460 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 3.7010 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 3.0510 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 1.3340 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 3.0490 -3.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 3.8040 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 3.5040 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5030 5.1310 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 6.7840 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 5.3080 -0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9410 -1.1740 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -1.9610 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4950 0.1520 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5890 -1.5850 -2.5580 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END