IFLAB-ZINC00671001 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0720 1.5020 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.0240 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -0.6050 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.1340 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.5380 0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -1.9670 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -0.4390 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -3.6150 -0.0330 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -3.3810 -1.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -3.5460 1.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -5.2270 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -5.7800 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -7.0440 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -7.7600 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -7.2030 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -5.9400 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -9.0400 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -9.4670 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -8.7060 1.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -10.8490 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -11.3700 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -12.7160 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -13.5370 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -14.8300 2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -15.3700 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -14.5980 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -13.2640 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -12.0430 -0.1970 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -10.4440 3.4730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 1.8800 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.9160 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.7980 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.4010 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.2480 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.2890 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -2.5500 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.4980 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.2720 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -2.3170 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0060 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -0.0840 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -5.2220 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -7.4740 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -7.7580 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -5.5080 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -9.6210 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -13.1330 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -15.4450 3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8880 -16.3990 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -15.0220 -0.5300 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 7 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 29 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 M END