PUBCHEM-ZINC03872239 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -1.8280 0.5660 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.5490 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 2.6270 1.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9220 2.8330 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 3.2670 2.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4850 2.8210 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 4.7720 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 5.3830 3.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5740 4.8730 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 6.8700 2.7700 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2180 6.9940 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 7.5020 3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 8.6720 3.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2360 9.2770 4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 8.7240 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 7.5500 5.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 6.9330 5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 5.6840 5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 5.2160 4.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8620 3.7490 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 3.1810 5.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 3.0280 3.7700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4370 3.5730 3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 3.9620 4.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 3.6380 2.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 4.1480 2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 4.4260 4.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 4.3600 1.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 3.1950 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 3.2720 0.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 1.6290 4.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 5.0600 6.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 7.0020 7.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 9.3880 1.8840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 7.5190 2.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -0.4970 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.6970 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 1.0490 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 0.7030 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -0.5200 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 0.9990 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 5.2330 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 4.9480 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 10.1910 4.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 9.2050 6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 3.8930 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 5.1580 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 4.7120 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 1.4130 4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 5.8060 4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 6.3720 7.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 8.4700 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.1750 1.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 53 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 29 1 0 0 0 0 3 53 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 2 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 31 49 1 0 0 0 0 33 51 1 0 0 0 0 35 52 1 0 0 0 0 M END