PUBCHEM-ZINC03873035 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 47 0 0 1 0 0 0 0 0999 V2000 0.2980 1.1470 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.3360 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -1.1580 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.5990 -0.0990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7800 -1.6800 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 0.0040 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 1.0300 -1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -0.0460 1.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.6750 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -1.8080 2.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 0.1380 3.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6330 1.1770 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 0.0270 3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 1.3240 4.0750 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 1.4080 5.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -0.4470 4.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 0.1840 5.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 1.3230 6.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -0.6700 7.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -0.0930 8.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -0.9590 9.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -0.4720 10.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6750 -0.4040 10.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -1.3550 12.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -0.5850 12.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 1.2900 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.7560 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 1.5390 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.6580 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.2190 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.0760 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -0.8120 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 0.8680 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 0.1000 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -0.9450 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -1.3850 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -1.6870 6.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.7180 6.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.9250 8.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -0.0110 8.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -1.9920 9.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -0.9920 9.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.5940 -2.4590 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3200 -2.5860 12.0670 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0660 0.9220 11.2240 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7910 1.6380 11.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 1.2250 10.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 0.7330 12.2030 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 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 36 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 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 45 48 1 0 0 0 0 M CHG 1 43 -1 M CHG 1 44 -1 M CHG 1 45 1 M END