PUBCHEM-ZINC05768215 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -0.9640 1.0710 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 0.0430 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.5600 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.2380 -2.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -1.4990 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -2.2590 -2.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7540 -1.6070 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -3.5450 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 -3.2680 -3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -4.8290 -3.7130 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -4.1390 -4.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -2.7330 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -2.7290 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 1.9000 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 0.6250 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 1.4810 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 0.5100 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.7670 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -1.7140 -0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -4.1530 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -4.1430 -1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -2.7940 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -2.6150 -4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -3.6100 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -3.4550 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -4.9510 -4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -3.0440 -3.5340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 M CHG 1 27 -1 M END