PUBCHEM-ZINC05467521 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.6050 1.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -2.4080 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.0740 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -4.8770 2.2810 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -5.4780 3.7500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8490 -5.0540 4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -7.0040 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -7.4190 4.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -6.5800 4.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -5.0590 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -4.2170 4.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -2.7250 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.6990 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 -2.7570 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -2.7830 3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -7.4240 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 -7.3710 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -8.7200 4.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5690 -5.6210 2.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -5.3200 2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -8.9380 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 M END