PUBCHEM-ZINC03871048 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 1.0890 1.6220 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 0.3550 -1.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -0.4490 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.0830 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 1.4040 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 2.2320 -1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 1.6630 0.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 0.5060 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -0.4700 0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 2.9200 0.7170 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0960 3.5790 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 3.5870 2.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2350 2.7930 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 4.2710 2.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9140 4.4730 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5680 3.2890 1.5530 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8490 2.5060 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8060 2.6440 0.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7980 3.9620 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0200 2.7170 0.3870 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 3.7070 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7370 2.7910 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 5.5300 1.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 5.6890 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 4.5310 2.0880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8070 -1.7490 -0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 2.2290 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 0.4380 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5040 4.5660 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 4.6040 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 4.1970 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4680 4.4790 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5420 2.3280 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1540 2.0160 -2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.0620 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.3500 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3980 3.5810 -2.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 11.9610 2.9720 -3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0360 4.2970 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7030 4.0530 -3.4030 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 27 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 26 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 28 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 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 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 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 26 35 1 0 0 0 0 26 36 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 M CHG 1 25 -1 M CHG 1 37 1 M END