IFLAB-ZINC04941775 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.0790 1.3690 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.0100 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -0.6600 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 0.0710 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 1.4500 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 2.1040 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 3.5040 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 4.3030 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 5.6050 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 5.5860 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 4.3260 -0.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 6.9490 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 8.1120 -0.3180 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 6.9840 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 3.8820 1.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 4.6420 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 5.6430 2.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5530 4.2530 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 3.2080 3.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 5.0630 4.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 4.8590 5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 6.0180 6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7450 6.5000 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 6.3040 4.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -2.3930 -0.2830 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 1.8750 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.5830 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -0.4380 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 2.0200 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 7.0050 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 7.1540 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 7.1990 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 7.0610 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 3.0420 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 3.9070 5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 4.8730 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 5.6590 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8710 6.8140 5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 5.8800 7.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 7.5500 6.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 7.1440 4.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 6.1900 4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END