PUBCHEM-ZINC00224974 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.4690 2.3750 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 1.0990 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 0.8340 0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 0.2380 0.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 0.4390 0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6200 0.9890 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -0.9400 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -2.0210 -0.8130 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -1.0170 -0.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1900 -1.5340 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -0.8940 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -1.6070 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -1.5300 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -0.7410 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.0300 -3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -0.1080 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 1.3060 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 2.1410 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 3.0070 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 2.9390 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 2.1450 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -1.3070 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -0.9990 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -2.2260 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -2.0840 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -0.6770 -4.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 0.5900 -4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 0.4560 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 1.1140 -1.4650 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 2 0 0 0 0 17 29 1 0 0 0 0 M CHG 1 29 -1 M END