IFLAB-ZINC04941812 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 1.9140 2.4040 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 1.9600 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 2.0150 2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 3.4110 2.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 4.1510 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 4.0120 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 3.9960 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 3.3590 4.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 5.4270 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 6.0330 3.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 6.0470 5.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 7.3520 5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 7.9490 4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 9.2460 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 9.4420 6.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 8.2650 6.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 8.0640 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 9.0580 7.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 8.8580 8.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 7.6680 9.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 6.6750 8.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 6.8730 8.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 5.1830 9.8620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 10.0730 4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 8.8130 3.5700 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 7.5450 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 1.3390 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 2.8580 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 2.8780 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 2.4960 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 0.9210 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 1.3950 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 1.6560 3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 3.7360 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 5.2040 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 4.4610 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 4.5190 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 5.5840 6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 9.9870 7.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 9.6310 8.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 7.5140 9.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 6.1000 7.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 10.6290 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 10.7480 3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 7.5800 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 6.5510 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 2.5880 0.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 47 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END