PUBCHEM-ZINC03020559 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -1.3890 1.0230 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.1600 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -0.7900 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -1.2520 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -1.9100 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -0.8990 4.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -0.4370 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.2210 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.6680 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.7170 -1.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.0490 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.4440 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 2.1070 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.3920 -4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 0.0100 -4.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.6660 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -0.7460 -6.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1010 -0.5250 -6.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -1.5900 -6.3650 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3340 2.2470 -6.4090 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 1.6650 -7.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 3.6330 -6.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 1.8590 -7.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.1440 -8.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 0.8400 -9.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 1.2490 -8.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 1.9640 -7.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 2.2750 -6.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 3.1790 -5.4030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 1.9200 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 1.0590 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 0.9690 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -1.6490 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -0.3930 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -1.9720 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -2.2390 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.7690 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -0.0400 4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -1.3680 5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 0.2830 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.2960 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 0.5500 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.0800 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 2.0020 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 3.1860 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.7450 -3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.8240 -8.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 0.2810 -10.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 1.0100 -9.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 2.2840 -7.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END