CHEMDIV-ZINC00328219 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.2890 0.9170 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -0.3480 0.2150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0700 -1.2180 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -0.3880 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.0180 1.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -1.0350 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -1.5550 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -0.5870 -1.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6410 -1.2640 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 -1.6980 -3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -2.3280 -4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -2.5330 -3.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -2.1030 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -1.4710 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 0.7510 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 0.8570 -2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 1.8160 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 1.0260 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 0.8880 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -0.2840 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -1.8510 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -1.6400 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.5690 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -1.5340 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -2.6490 -5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -3.0190 -3.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8830 -2.2500 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -1.1410 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 1.5870 -2.1200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 M CHG 1 29 -1 M END