IFLAB-ZINC01060694 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -1.4200 -0.8100 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -1.2940 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.7250 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -1.1150 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -2.0920 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -2.7040 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -2.3110 -0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -3.1270 -1.9030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 0.2080 2.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 1.2900 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 1.6760 2.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 1.9520 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 1.3720 3.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2940 1.1070 4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 0.1190 2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -0.8070 2.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 2.4780 2.6950 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 2.4160 3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 1.6200 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 1.5530 4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 2.2920 5.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 3.0880 5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 3.1550 5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 4.0250 5.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 3.4750 5.6840 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.6430 -0.7260 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -1.4970 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 0.1990 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -0.6890 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -2.3850 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.4800 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 1.6540 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 3.0400 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 1.0440 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 0.9310 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 2.2520 6.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 3.6690 6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 5.2330 5.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 38 2 0 0 0 0 M CHG 1 25 -1 M END