CHEMBRIDGE-ZINC00075342 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -0.7090 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -2.0880 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -2.0560 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -0.6770 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2520 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -4.9560 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -6.3740 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -7.0270 -2.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -6.9850 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -7.9540 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -6.2480 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -4.9290 1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -7.0780 2.6880 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -5.6540 3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -4.2580 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -3.7050 -3.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.8720 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 1.8750 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.8510 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1780 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -2.6370 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -2.5800 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -0.1210 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -5.0640 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -6.0030 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -5.0390 3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 3 0 0 0 0 M END