CHEMBRIDGE-ZINC00281162 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.0290 1.5260 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0040 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0210 -0.3860 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.4970 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.0000 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.6170 -0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.6600 -2.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -4.0590 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.7690 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -6.1500 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -6.8260 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 -6.1220 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -4.7410 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -0.5950 1.4640 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.0450 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 0.5580 2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.3100 4.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 1.9090 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8820 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.8780 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.0690 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -0.1890 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.1650 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -4.2410 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -6.7020 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -7.9060 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -6.6540 -3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -4.1920 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -0.8590 4.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 0.6380 4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.9000 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 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 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 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 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 M END