CHEMSTAR-ZINC04066580 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.6700 1.6600 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 0.1800 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.6520 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -1.9840 1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -2.6720 0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5750 -2.8250 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -3.8930 0.4360 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2550 -4.0560 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -3.0570 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -3.2540 2.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -5.1630 0.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -6.2980 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -6.3520 1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -7.5080 1.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1190 -7.7380 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -7.2410 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -7.6360 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 -7.4110 3.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -6.8000 4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -6.4140 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -6.6360 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -8.6320 1.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -9.9430 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -10.2320 1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -10.8730 2.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -10.5860 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 -11.9330 3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -12.8780 2.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -12.2670 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -12.8940 1.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -1.8260 -1.4610 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -0.2600 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -0.0760 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -0.1870 3.7390 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5000 1.9770 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 1.9400 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 2.2310 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -5.2120 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 -8.1410 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 -7.7190 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -6.6280 5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -5.9390 5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -6.3300 3.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -8.3820 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -9.9230 3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -10.0770 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -12.0380 4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -12.1340 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -13.8860 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 0.4970 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -0.3520 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 0.4720 2.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 33 52 2 0 0 0 0 M CHG 1 34 -1 M END