IFLAB-ZINC02451333 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -2.1940 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -2.3850 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3250 -1.4300 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 -0.2880 -3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.1120 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -1.6280 -3.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 -2.6230 -2.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 -0.7040 -3.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7590 -0.9000 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2140 0.2670 -5.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4470 1.1730 -5.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4750 0.3040 -5.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8890 1.3610 -6.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -0.9410 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -1.6880 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -0.1510 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -2.9320 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -3.2700 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 0.4540 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 0.7690 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8830 0.0900 -4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 -0.9700 -3.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8490 -1.8200 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 -0.4210 -5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7540 2.2330 -5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8510 1.2500 -6.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 M END