IFLAB-ZINC00193490 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 0.0110 1.4450 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0750 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.5650 0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -1.8940 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -2.6230 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -2.4610 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -3.7830 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -4.0650 0.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 -2.3450 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -1.7060 0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3600 -1.7610 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 -2.5290 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -3.7320 0.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6810 -1.9620 0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8220 -2.7680 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0330 -2.3250 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1560 -3.1220 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0760 -4.3600 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8720 -4.8040 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -4.0090 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 1.8130 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.6990 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.9050 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.5350 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.3290 1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -4.5420 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -0.8010 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7650 -0.9970 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0960 -1.3580 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0990 -2.7780 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9560 -4.9810 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8120 -5.7710 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -4.3540 -1.0470 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 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 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 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 M END