IFLAB-ZINC04497526 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 0.0060 1.3480 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.0390 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -0.7210 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -0.0170 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 1.3860 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0630 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 1.8160 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 0.6580 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -0.4110 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -1.3340 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 4.1210 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 3.4490 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 2.5200 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 4.7160 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6850 4.9700 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2240 4.2020 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 5.0720 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2580 6.1560 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0980 6.3540 -2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 6.8670 -0.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 6.3770 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9550 7.9370 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 8.6880 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4860 9.7430 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5910 10.0530 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8790 9.3070 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0680 8.2470 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6170 11.3800 1.2150 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 1.8690 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.5900 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -1.8000 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.1420 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 0.6180 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 5.4590 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 4.1270 -1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 5.3600 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 7.0340 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 6.3150 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 8.4470 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2640 10.3270 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7410 9.5510 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 7.6620 -1.5950 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 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 21 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END