PUBCHEM-ZINC05757329 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 -0.3160 2.6230 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.4530 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.3450 -2.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 0.4110 -1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 1.5310 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 2.6650 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 3.8910 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 4.9050 2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 4.7000 3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 4.3840 4.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 3.2530 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 3.4580 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 5.0920 5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 5.5140 5.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 6.2090 6.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 6.4950 7.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 7.1960 8.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 7.4490 9.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 7.0350 9.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 6.3460 8.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 6.0660 7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 7.3820 10.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 8.0640 11.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 8.1090 10.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 5.3420 4.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 5.1870 3.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 3.4730 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 1.3730 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.4930 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 1.5080 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 4.1390 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 4.7570 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 5.7930 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 4.9950 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 3.8770 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 5.6120 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 2.3460 3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 3.0600 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 2.5560 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 4.3230 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 6.5450 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 7.5340 9.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 6.0280 7.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 7.5490 12.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 9.0910 11.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 3.7160 1.3630 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1720 2.8850 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 5.3980 6.1180 N 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 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 31 1 0 0 0 0 7 32 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 48 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 25 26 3 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END