IBS-ZINC00531759 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -1.6860 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -2.2790 -1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -2.2710 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9370 -3.8540 -1.4960 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -4.2990 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -3.6030 -0.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 -4.2190 -0.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -5.3450 -1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -5.4290 -1.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -6.4340 -2.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -6.3350 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9450 -5.9880 -1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9200 -6.9150 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5640 -8.1880 -2.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 -8.5380 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2450 -7.6180 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7970 -9.3500 -2.8680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -2.4270 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -1.5840 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -7.1500 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -6.8230 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 -4.9960 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9630 -6.6480 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9580 -9.5320 -2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -7.8900 -2.3950 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 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 31 1 0 0 0 0 14 32 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 M END