PUBCHEM-ZINC04822285 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 31 0 0 1 0 0 0 0 0999 V2000 0.0860 1.3890 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.0420 -0.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -0.7060 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -0.0430 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 1.3440 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.1290 -0.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 1.7230 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 0.5780 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -0.5100 0.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 3.0800 0.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3090 3.7220 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 3.7470 1.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3880 4.3360 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 4.7150 1.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9280 5.5490 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2250 3.6990 0.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6750 2.8480 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 3.1990 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 4.8630 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 5.1510 1.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 2.8810 2.6500 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9590 -2.0810 -0.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 1.9470 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 0.6050 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 4.5960 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 5.7020 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.4880 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -2.6430 -0.1790 H 0 0 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 23 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 22 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 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 19 26 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 M CHG 1 21 -1 M END