PUBCHEM-ZINC03873057 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 1.1840 0.9880 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -0.4260 -0.7190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3080 -1.1340 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -0.8040 0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0730 -1.1620 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -1.8910 1.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0970 -1.4890 0.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -0.6690 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.2650 -1.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -3.3240 0.7230 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4750 -3.4420 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -4.5330 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -4.6020 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -5.8490 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -3.4320 -0.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -3.3610 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -1.8490 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.1710 3.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -1.3740 3.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -0.7000 4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 0.0750 5.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7270 -0.5100 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 0.2890 6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 1.4400 7.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0190 1.3650 4.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 1.5780 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 0.7350 3.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 2.9960 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 0.3470 1.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 0.9090 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 1.1800 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.1380 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 1.7390 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -1.7420 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -4.4830 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -4.5920 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -5.5240 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -3.7760 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -5.8510 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -6.7020 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -6.0140 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -1.5480 5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -0.0420 4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 2.1260 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 3.0150 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 3.5950 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 3.4270 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -0.6950 7.5280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 25 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 48 -1 M END