IBS-ZINC05091478 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 1 0 0 0 0 0999 V2000 -1.2500 3.3090 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 1.2900 2.4040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2270 1.4420 3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.1980 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -0.6980 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.0590 2.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 1.7600 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 2.2680 1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.6160 3.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 1.9520 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 2.4570 4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 2.7880 3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3750 2.6180 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 2.1160 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 1.7770 1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 1.9360 0.1610 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3760 2.2300 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5370 1.4930 -0.7530 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3680 3.8810 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 3.0860 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 3.8910 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.3410 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -0.7550 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 1.2790 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 2.5910 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 3.1810 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 2.8780 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 1.3810 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 2.0530 1.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 1.5010 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.9830 2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -2.2560 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 29 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END