PUBCHEM-ZINC05577063 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.1580 1.0890 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -0.3710 2.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -1.1580 3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -1.0100 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -0.2600 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -0.8850 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -2.2810 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -3.0310 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -2.3980 2.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 -2.9540 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -4.2860 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9720 -5.1700 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 -4.7690 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -6.4260 -0.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3900 -6.8080 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -5.3710 0.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -8.0780 -0.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -9.1370 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -10.2220 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -11.2680 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 -11.2390 -1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -10.1580 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 -9.1090 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1860 -10.1310 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 1.4050 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.4100 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.5380 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.2790 4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -2.1380 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.6420 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 0.8160 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3760 -0.3020 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 -4.1080 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.9760 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -2.3910 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -8.2420 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -10.2470 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -12.1100 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2250 -12.0580 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3680 -8.2690 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -10.5290 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M END