PUBCHEM-ZINC05159461 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 0.5020 0.6490 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 0.1480 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 0.2970 -2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4710 -0.5770 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -1.9550 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.0780 0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -2.9680 -0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -4.3620 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -4.9420 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -6.3320 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -7.1740 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -8.5670 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -9.4180 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -8.9110 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6800 -7.5230 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -6.6160 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -5.1990 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -6.9130 -0.9100 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6810 -6.0850 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -6.1960 -2.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -10.7620 0.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 1.3800 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 1.1430 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.1830 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 0.0100 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -0.6170 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.6980 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -4.3440 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -6.7540 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -9.0040 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -9.5760 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -4.7390 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -11.2250 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -8.1310 -1.0550 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 21 33 1 0 0 0 0 M CHG 1 34 -1 M END