IBS-ZINC05425154 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6340 2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.0380 2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 1.1850 2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.8940 2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 1.6710 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 3.0570 4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 3.3720 5.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 4.7300 5.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8910 5.1950 5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 5.3380 4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 4.3160 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 4.6400 3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 5.9500 2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 6.9610 3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 6.6640 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -0.6060 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 1.6940 4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.9960 5.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 2.6590 5.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 3.8580 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 6.2000 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 7.9910 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 7.4580 4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.4280 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.6760 0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -3.6420 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 8 9 1 0 0 0 0 8 26 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 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 35 36 1 0 0 0 0 M END