PUBCHEM-ZINC03898027 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 0 0 0 0 0999 V2000 1.8700 -0.2340 2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.0870 1.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -0.9590 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -0.0320 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 0.0980 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -0.6960 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.6230 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -1.7630 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -4.1530 -0.9490 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -4.8880 -0.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.6370 -1.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -3.8080 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -4.0860 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -3.8150 -4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -3.2650 -5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -2.9850 -4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -3.2610 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -2.9920 -1.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -2.4300 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -4.1150 -6.0980 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7620 -4.5990 -5.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -3.8760 -7.2330 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4940 -0.4380 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -0.4180 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 0.8080 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 0.5900 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 0.8220 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 -0.5910 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -2.2420 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -4.5150 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -3.0540 -6.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -2.5540 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -1.4800 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -3.1160 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -2.2640 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.7060 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.5120 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END