PUBCHEM-ZINC02729459 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -3.6530 1.9410 1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 0.4850 1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 0.0740 2.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -0.4470 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 0.0230 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -0.8790 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 -2.2470 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -2.7320 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -1.8260 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -4.1270 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -4.8630 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -4.3920 2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -6.3910 0.8610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5520 -6.5690 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -7.0990 2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -8.6140 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 -9.1410 1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -8.4930 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -6.9550 -0.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5910 -6.6280 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -6.5030 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 -5.7150 -1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 2.4150 2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 2.4420 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 2.0550 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 1.0810 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -0.5200 -2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -2.9390 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -2.1720 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -4.7000 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -6.7450 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -6.8360 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 -8.8990 1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7830 -9.0700 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -10.2280 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -8.9450 1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -8.8240 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -8.8750 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -6.9230 -2.4950 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 39 -1 M END