PUBCHEM-ZINC06160592 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.8090 0.8060 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -0.8260 -0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -1.1340 1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.3200 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -2.5650 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -1.6200 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -0.4300 3.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -0.1940 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -1.8790 5.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -2.9990 5.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -2.9860 7.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -1.6490 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -0.8710 6.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4730 -0.5440 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -0.1240 7.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4260 -1.1600 7.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 0.7780 7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.5550 5.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.4040 5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -0.2590 4.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 0.7520 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 1.2910 4.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 2.0570 4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 0.0070 8.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 0.6910 9.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 0.7590 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 1.1040 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 1.5350 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -3.0500 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -3.4860 3.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 0.3020 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 0.7230 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 -3.7360 7.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -1.1880 8.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -1.7050 7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 0.5380 7.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 1.8210 7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.1560 6.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.1020 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 0.2780 6.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 1.0210 6.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -0.6350 9.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -0.5200 10.6790 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END