NIH-ZINC00616077 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3860 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.0640 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.1400 1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -0.5400 0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -1.8240 -0.9130 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -2.0740 -0.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -1.5460 -2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -3.2300 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -3.8460 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -4.9600 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -5.4450 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -4.8210 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -3.7130 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -2.9290 1.8460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -5.6240 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -5.2010 -2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.7410 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.4400 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 2.0100 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.6870 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 0.4840 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -1.1720 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.2150 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1040 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -3.4660 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -6.3070 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -5.1950 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -6.6990 -0.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1110 -7.1000 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 28 29 1 0 0 0 0 M END