PUBCHEM-ZINC05141065 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 0.8820 1.4610 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 0.1400 -0.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -0.7310 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -0.5420 -0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.0200 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -2.7980 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -4.0740 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -4.5570 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -3.7800 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -2.4970 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -1.6990 -3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -0.4340 -3.5350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5320 -4.9310 0.9610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4640 -4.3280 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -5.5080 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -6.8870 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -7.3960 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -6.5310 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -5.1530 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -4.6530 1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 -4.2960 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 -5.9640 1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 1.4710 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 1.8590 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 2.0980 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -2.4040 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -5.5500 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.1830 -3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -7.5770 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -8.4680 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 -6.9440 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -3.5800 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -4.6540 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 -3.2950 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -5.6780 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.3590 -4.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M CHG 1 12 -1 M END