PUBCHEM-ZINC05476579 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7350 -0.0640 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.0360 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -2.5100 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -1.8980 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.8480 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.4200 5.3690 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -1.6700 5.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -2.3820 4.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -3.5230 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -3.3450 5.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -4.7690 5.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -1.9310 7.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -1.1670 8.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.2520 7.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -1.4500 9.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.4450 10.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -2.8690 10.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.1280 2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.4900 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.3260 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -3.5970 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -2.1900 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -4.9110 5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -5.5240 5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -2.6620 7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -1.3590 9.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 -0.5360 10.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -0.6500 11.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 0.5660 10.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.5840 9.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -3.0730 11.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -2.9590 9.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.9490 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -0.4270 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 21 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 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END