PUBCHEM-ZINC06272782 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 2.5100 -1.2690 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.3600 0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.6640 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7280 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -1.4020 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -2.6530 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -2.3100 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 0.6750 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -1.5360 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 0.1930 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.2780 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 0.5970 4.8020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1450 1.6520 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 0.3950 5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 0.2860 5.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 1.1730 5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 0.8600 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 1.5710 8.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1800 1.3240 8.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 3.0960 8.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 1.0620 9.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 1.4880 10.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 1.6270 11.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -2.2030 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -1.1050 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -0.4470 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -1.6580 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.6970 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -3.4040 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -3.1070 -1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -1.8580 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -3.2450 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 1.3220 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 0.6100 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 1.1770 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -1.0220 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -1.6790 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -2.5260 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 1.2600 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -1.3510 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5020 1.0420 6.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -0.6410 5.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.6390 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.7200 6.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 2.1790 5.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 1.1380 6.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2220 -0.2250 6.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 3.5920 9.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 3.4860 7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 3.3970 7.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 1.3710 8.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -0.0360 9.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 1.6340 11.0670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 M CHG 1 53 -1 M END