IFLAB-ZINC04119638 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 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 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.3270 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -3.6940 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5480 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.0360 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.6690 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -6.0400 -1.8470 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6370 -6.2550 -2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -6.6400 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9390 -8.1370 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -8.8170 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -8.1610 -1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -8.8040 -2.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -6.6620 -1.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8340 -6.4040 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -6.1390 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -5.3480 -3.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -6.5500 -3.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -6.0040 -4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -6.5850 -4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -8.8450 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -9.5440 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -10.1380 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -9.9380 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -8.9670 1.4140 S 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 0.5290 -0.3650 0.8850 H 0 0 0 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 1.8260 -1.6600 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -4.0970 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.7040 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.2690 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -6.2360 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -6.3860 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -9.8910 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -4.9190 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -6.2650 -5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -6.1750 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -7.6700 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -6.3240 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -9.6190 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 -10.7250 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4910 -10.3340 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 M END