IBS-ZINC06163803 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5130 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -1.9690 1.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.4940 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.8890 -1.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1900 -2.1550 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -2.4310 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -2.9870 2.3490 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -4.1750 2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -2.2120 3.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -3.4330 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -4.5480 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -4.9040 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 -4.1460 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -3.0210 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -2.6710 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -2.2030 3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -2.4910 2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -1.4880 3.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9320 -1.2630 3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3200 -0.1690 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 0.7550 5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 0.5440 4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -0.6030 4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -1.0540 3.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0060 0.0970 4.9180 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 1.7220 -0.0340 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.2870 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.2140 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -3.5800 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -2.1630 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -2.0000 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -3.5160 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -5.1440 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -5.7760 0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -4.4240 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -1.8020 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 -3.3520 2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -1.9680 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6800 1.6300 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 1.2470 5.1530 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 M END