IBS-ZINC04302467 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.3620 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 0.0980 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -0.5070 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 0.2160 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.4740 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 2.0650 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 1.8400 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 0.7910 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -0.1990 0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 0.8290 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 1.9760 -0.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5880 2.9450 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 2.9650 -1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7860 -0.1620 0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 -1.4310 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6820 -2.2320 0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 -1.1670 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2410 -0.0280 0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5830 0.9280 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8180 -0.1980 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 -1.1570 -2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.8070 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.4260 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -1.4860 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 3.0450 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 3.8180 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -1.2720 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -1.9660 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6900 -2.9090 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 -2.8400 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8550 -0.8180 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7450 -1.5520 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 0.6260 -1.6950 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 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 25 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 33 -1 M END