IBS-ZINC04620078 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9740 -0.1130 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.0630 0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.5440 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -1.9520 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -0.8430 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -0.3450 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -0.9810 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -0.6510 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 -1.4830 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5040 -2.7240 -1.9870 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -2.1020 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -2.5340 -0.7870 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0160 -1.3640 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1440 -0.4680 -4.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0180 -2.2430 -3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2620 -2.1200 -4.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2260 -3.2340 -4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5050 -3.1080 -4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6380 -3.7590 -6.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8100 -3.6430 -6.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8520 -2.8760 -6.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7190 -2.2250 -5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5480 -2.3460 -4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3250 -2.7300 -7.2190 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 0.4210 -4.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -0.1460 -1.2880 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -2.4900 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -2.3680 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -3.6310 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -2.2400 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 0.5230 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9160 -2.9570 -3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7180 -1.1510 -4.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0430 -2.2050 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7700 -4.2030 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4450 -3.1500 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8240 -4.3570 -6.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9140 -4.1520 -7.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5320 -1.6260 -4.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4460 -1.8410 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 0.9890 -4.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4990 0.6020 -4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 0.9320 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.4310 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 29 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 15 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END