IFLAB-ZINC04518750 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 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 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.3260 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -3.6920 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.5510 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -4.0350 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6680 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9400 -1.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -6.9000 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -8.1500 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -9.3060 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -9.1780 0.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -7.9830 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -6.8610 0.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -7.8940 2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -9.0530 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -8.9160 3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -7.6490 4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -6.5730 3.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -6.6540 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -10.6460 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -10.7470 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -11.7520 -0.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -7.8980 -2.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -8.5680 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -6.5640 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -6.0060 -3.8210 O 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 -1.6580 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -4.0940 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -4.7020 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.2660 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -10.0300 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -9.7890 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -7.5380 5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -5.7500 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -11.6710 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -12.6300 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 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 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 M END