IFLAB-ZINC04134543 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.1750 1.7000 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 0.3210 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -0.4500 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 0.1520 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 1.5540 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 2.3160 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 2.1580 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 1.3760 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -0.0010 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -0.6140 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -1.9610 -0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 3.5390 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 4.3690 -0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 5.7470 -0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 3.7100 -0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6650 4.1400 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 5.0260 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 4.8480 -4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 3.7810 -5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 2.8950 -4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2960 3.0780 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 1.7540 -5.1250 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4960 0.9740 -4.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7150 1.5950 -6.3270 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2390 3.5560 -6.9200 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 2.2890 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -0.1440 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -1.5170 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 3.3860 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 1.8370 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -0.5940 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -2.2390 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 4.0120 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 5.8580 -2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 5.5400 -5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 2.3890 -2.5170 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 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 2 0 0 0 0 13 16 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 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END