IBS-ZINC02087242 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.2980 1.2870 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.2450 -0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2060 -0.5490 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -0.5930 0.8490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5940 -1.4830 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 0.5470 0.9820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1920 0.8610 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 1.9100 -0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 0.1020 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 1.2040 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.7590 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 1.8610 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 1.4230 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 0.3410 -0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.8750 2.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.9430 0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -1.2370 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.9220 -1.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -1.8790 -0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 1.6250 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 1.5790 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -0.8100 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -0.0870 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 2.1160 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 1.3930 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 -0.1530 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7940 0.5700 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5870 2.7730 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 2.0500 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.1860 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -1.1950 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -2.1300 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -2.0900 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3020 2.2350 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1430 1.9110 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 34 35 1 0 0 0 0 M END