IBS-ZINC01533629 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.1170 1.1130 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.2110 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.7810 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 0.0250 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 1.3570 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 1.9060 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 1.8680 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 0.8270 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -0.2650 1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 -1.1570 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 3.2600 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 4.0810 1.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4280 3.6280 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 5.4430 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 6.3390 0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 4.2610 2.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 3.4490 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 2.5090 3.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 3.8680 4.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2390 4.9210 4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 3.6150 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 2.2150 4.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 2.1230 5.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 1.3260 6.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 3.0850 5.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 1.5380 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.8110 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -1.8110 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 2.9390 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 0.7860 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8720 3.1840 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 3.7850 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 5.0860 2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 4.3360 4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 3.6950 2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 2.0970 4.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 1.4390 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 3.1900 6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 5.4920 0.1900 O 0 5 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 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 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 16 17 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 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 38 1 0 0 0 0 M CHG 1 39 -1 M END