IFLAB-ZINC05250714 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 5.2550 1.8650 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 2.5610 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 3.6020 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 1.5240 -1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 0.3760 -1.3140 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -0.5470 -0.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 1.0720 -1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -0.5480 -2.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 0.0470 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 0.2610 -4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 0.8480 -6.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 1.2250 -6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 1.0110 -5.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 0.4180 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.8210 -7.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 1.7400 -7.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.1500 -7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 3.8750 -9.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 4.2040 -8.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 2.6490 -8.3650 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 2.8770 -7.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 1.8610 -9.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 1.1230 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 1.3720 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 2.6030 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 3.0540 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 3.1090 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 4.0980 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 4.3400 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 2.0300 -2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 0.9700 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 -1.5020 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4400 -0.0320 -4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 1.0150 -6.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 1.3040 -5.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 0.2480 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 1.2000 -8.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 1.2140 -6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 3.0870 -8.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 3.7100 -6.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 3.2360 -9.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 4.7980 -9.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 4.7450 -9.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 4.8150 -7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 M END