IBS-ZINC03156852 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.5820 1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6400 -2.1230 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -2.4940 1.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4990 -2.3990 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -1.4690 3.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.2360 2.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -3.9050 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -3.9890 3.4750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -4.2940 3.5760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -5.0940 1.1600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -0.0990 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 0.0310 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 0.4740 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 0.7870 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 0.6550 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 0.2080 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 1.2620 1.3240 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6820 1.3780 2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 1.5370 0.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.4400 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -2.5550 1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -1.3370 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -0.2130 3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 0.5770 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 0.9000 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 0.1020 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END