PUBCHEM-ZINC05049220 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.3190 1.2820 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -0.0970 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -0.7220 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 0.0430 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 1.4210 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 2.0400 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 3.5450 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 4.0400 1.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 5.3640 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 6.1480 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 5.8200 3.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 7.1860 3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 7.6030 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 8.9520 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 9.8860 3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 9.4740 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 8.1270 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 11.3310 4.1720 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1400 11.6960 5.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 12.1550 3.3450 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0600 -2.1190 0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -3.0150 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.3880 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -4.2970 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -2.8120 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -2.3190 -0.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 1.7680 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -0.6890 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -0.4400 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 2.0170 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 3.9560 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 3.8530 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 3.4150 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 5.2020 3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 6.8740 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 9.2770 5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 10.2060 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 7.8060 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.6540 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -3.0890 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -4.5070 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -5.2000 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -4.7960 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -4.7310 -1.0280 H 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END