CHEMBRIDGE-ZINC00097830 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 0.0280 1.4540 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 0.0820 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.6090 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 0.0760 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 1.4650 0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 2.1440 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 1.8510 0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 2.7520 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 0.7260 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3150 0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 0.6820 0.3650 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -1.0880 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 -1.3700 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 -0.4640 0.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 -2.6300 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 -2.8760 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3740 -4.0610 0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7230 -4.3080 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5540 -3.3660 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0110 -2.1770 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6600 -1.9390 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0010 -3.6270 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4720 -4.6620 -0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8000 -2.7180 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 1.9850 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -0.4470 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.6760 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 3.2120 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -1.6520 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -1.3850 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 -3.3650 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7310 -4.7890 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 -5.2280 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6500 -1.4470 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2390 -1.0210 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4250 -1.8920 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7510 -2.8890 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 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 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M END