PUBCHEM-ZINC06761381 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.6370 1.3870 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.1020 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -0.5990 -1.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.8030 -0.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -2.2650 -0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6760 -2.6920 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -2.8190 -0.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1650 -2.2380 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -2.4690 0.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8040 -2.9060 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -2.9420 1.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3100 -4.0370 2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -2.5660 2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -2.5090 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.4660 1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -2.3740 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -2.9360 4.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -2.8720 4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -1.0400 0.6210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -0.8460 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -4.1370 -0.6470 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1910 1.8290 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 1.6290 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.8090 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -0.3250 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9990 -1.2890 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -2.6130 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 21 -1 M END