IBS-ZINC00064872 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.2650 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.1040 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -0.7580 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -0.0340 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.3460 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.9870 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -0.7280 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 -0.1220 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 -1.0060 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 -0.7240 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 -1.7210 -0.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 -2.9620 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -3.2750 -0.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -2.3370 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -2.4550 -0.3210 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8780 0.5720 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2500 0.8220 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7770 2.0070 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1320 2.2590 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9730 1.3360 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4540 0.1430 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 -0.1090 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3510 -0.8460 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8980 -1.8830 1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.7720 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -0.6620 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.8260 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 1.9110 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 3.0560 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 0.9420 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 -3.7470 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 1.3060 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1240 2.7320 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5360 3.1810 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0320 1.5360 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6760 -1.0280 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6730 -0.5980 1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2200 -1.2750 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 16 32 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 37 38 1 0 0 0 0 M END