IBS-ZINC00495252 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 1 0 0 0 0 0999 V2000 0.3220 2.2050 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.8460 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -0.0210 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 0.4700 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 1.8280 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 2.6960 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -0.4760 -0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2350 -1.4890 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 -0.1460 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 0.1910 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3860 0.2500 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7440 0.5990 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 0.9350 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9080 1.2590 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4280 1.2610 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 0.9330 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 0.6060 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9770 0.1460 -2.5180 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -0.0380 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -0.3940 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 -0.6830 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -0.9120 -3.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 0.4900 2.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -0.1870 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -0.2200 3.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 2.8830 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 0.4630 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -1.0830 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 2.2120 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 3.7570 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 0.9390 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 1.5150 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4640 1.5170 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0080 0.9310 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1760 0.0300 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9940 1.1600 2.9160 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 3 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 3 0 0 0 0 M END