PUBCHEM-ZINC05126165 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.3280 0.5990 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.7500 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -1.1250 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -0.1450 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 1.2270 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 1.5860 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 2.3060 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 1.8980 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 0.4830 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 -0.4430 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -1.6190 -0.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0450 -2.5200 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 -1.5280 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 -0.2310 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 0.2680 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 1.4350 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2890 -0.7350 0.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6130 -0.4970 0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3730 -1.5320 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8310 -1.4720 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5710 -2.6370 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9600 -2.6090 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6260 -1.4230 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8590 -0.2620 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4690 -0.2840 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1310 -1.3980 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7500 -2.4900 0.9200 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3770 0.8820 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -1.5130 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -2.1830 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 2.6330 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 2.5600 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 3.2140 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2160 2.5810 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 2.0000 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 -1.6630 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9500 -2.5160 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0900 -3.5720 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5340 -3.5200 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3530 0.6690 1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9020 0.6290 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6590 -0.2890 1.4430 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 2 0 0 0 0 M CHG 1 27 -1 M END