PUBCHEM-ZINC04657400 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -1.4620 1.6370 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 0.2510 -1.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -0.4500 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 0.0650 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -0.7650 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -2.1160 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4150 -2.6360 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -1.8030 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -4.0630 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -4.3280 0.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -4.9600 0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -6.3710 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -7.3500 0.1620 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -6.8080 0.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -8.0040 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -8.3160 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -9.4530 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4660 -10.2910 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -9.9940 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -8.8370 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -10.8350 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -12.0810 -2.3970 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.4390 -11.6280 -1.4680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 2.0460 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 1.7960 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 2.1720 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 1.1100 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -0.3500 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -2.7310 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -2.2080 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -4.5440 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -6.1900 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7530 -7.6860 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9690 -9.6730 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -8.5950 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -10.2130 -3.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 2 0 0 0 0 M CHG 1 22 -1 M END