IFLAB-ZINC04940799 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0470 1.5020 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.7040 -0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -2.0850 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.7720 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.0670 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.6850 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 0.1980 2.0940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1710 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -4.8400 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.2320 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -6.3450 -1.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0180 -6.6540 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -6.9320 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -6.8290 -2.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -6.6490 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -6.0280 -3.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -7.2250 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -7.1920 -6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -7.8080 -7.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 -8.4700 -7.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -8.5130 -6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -7.9020 -4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -7.7250 -3.2240 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -9.0100 -2.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -6.8890 -3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.8470 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 1.8820 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 1.8680 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.1700 -1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.6300 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5980 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -4.6580 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -6.6220 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -6.5710 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -8.0200 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -6.6810 -6.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -7.7740 -8.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -8.9490 -8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -9.0260 -5.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 14 1 0 0 0 0 12 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 M END