PUBCHEM-ZINC05535372 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 36 0 0 0 0 0 0 0 0999 V2000 0.0150 1.1020 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 1.0060 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 2.9710 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 3.5130 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 2.8490 0.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 3.3670 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5550 4.2570 -1.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 2.6800 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1470 3.2830 -1.7530 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6030 2.3490 -3.0770 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.1950 3.1900 -4.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 1.4750 -3.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8930 1.3390 -2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 4.7060 -1.3450 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.3720 4.5240 -1.5630 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 5.1420 -0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 5.8630 -2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 0.0400 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 1.7120 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 1.2590 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.5060 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -0.0790 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 1.2530 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 3.5060 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 3.0800 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 4.5810 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 3.4120 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 1.6170 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 2.7410 0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 1.9690 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 0.6470 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4900 0.7750 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6690 5.5720 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7620 6.8420 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 5.9120 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 1.4880 1.4200 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5700 0.9950 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 36 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 1 M END