COMGENEX-ZINC06777492 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.1740 -1.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.1640 -2.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -0.6370 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.1810 -4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -1.1790 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -1.3500 2.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9560 -0.9680 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -1.2370 3.6430 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -0.7190 2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -0.1700 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 0.5270 0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -2.7700 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -3.5810 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -4.8830 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -5.3730 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -4.5610 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -3.2580 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -6.7920 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -6.8260 -0.9430 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -7.2810 0.0310 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -7.5880 1.2090 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.3830 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -1.1080 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 1.0700 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 0.2460 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -2.0080 -5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -1.1840 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 0.0550 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -1.5740 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -3.1980 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -5.5170 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -4.9440 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -2.6230 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M END