IFLAB-ZINC04393150 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 1.4630 -0.7510 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.3230 0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.0450 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.9760 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 1.5570 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 0.1840 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 2.4350 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 3.8210 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 4.5460 0.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 4.3920 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 5.9220 -0.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3410 6.2920 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 6.4350 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 7.9430 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 8.1870 -1.8030 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 9.1950 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8650 8.2860 -3.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 6.5660 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 1.5060 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 2.7600 1.2520 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6730 -1.8140 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -1.0580 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 3.0320 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -0.1770 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 1.9900 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 3.9960 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 4.0130 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 6.1810 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 5.9880 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8440 8.4370 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8340 8.3760 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 6.0120 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 6.6810 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 0.6040 1.4760 O 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 2 0 0 0 0 M CHG 1 20 -1 M END