IBS-ZINC04337856 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.3990 -0.2660 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 0.8940 -1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 2.2030 -2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 0.9160 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 0.6960 -0.2000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 1.8660 0.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -0.5910 0.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 0.6630 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -0.5690 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.5750 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 0.6000 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 1.8010 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0830 1.8540 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 3.2180 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 3.6430 0.6970 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3390 -1.9290 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -2.3300 -1.8880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5980 -0.3100 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -1.2230 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -0.1530 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 2.3250 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 3.0680 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 2.2290 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -0.0110 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 1.7440 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 1.0330 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -1.5240 -1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 0.5770 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 2.7210 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 3.8690 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -2.6020 0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 2 0 0 0 0 16 17 1 0 0 0 0 16 31 2 0 0 0 0 M CHG 1 15 -1 M CHG 1 17 -1 M END