IFLAB-ZINC04087074 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0510 0.6360 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.8740 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 1.7620 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 1.9000 3.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 1.5980 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 1.7620 2.8260 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3460 2.2200 4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 2.3120 4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 2.7430 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 2.7100 7.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 3.2510 6.4920 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 2.4650 5.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 2.4370 4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 2.2180 3.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 2.7040 5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 1.7300 6.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 1.9450 8.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4650 3.1260 8.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3360 4.0970 7.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 3.8860 6.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3040 5.1320 4.8300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.5460 3.3890 9.3870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 1.1210 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.4440 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 0.8900 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.0220 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 0.9730 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -0.1810 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.3310 4.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 2.7600 3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 3.3860 5.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 3.5300 7.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 2.6870 6.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 0.8040 6.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8290 1.1880 8.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9140 5.0150 7.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 0.0510 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 1.6810 0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 1.3050 1.3840 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5350 2.3160 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 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 36 1 0 0 0 0 20 21 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END