PUBCHEM-ZINC05908532 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 0.0970 2.0590 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 0.5570 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.1490 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.6730 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -1.3460 3.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -1.4730 3.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -2.1770 4.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -2.5680 4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 -3.2760 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -3.5730 6.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -3.1700 6.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.4620 5.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -1.9030 4.3650 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1740 -1.8910 4.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -3.2550 4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -3.7820 5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -5.0280 5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -5.7780 4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -5.2440 3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -3.9980 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -7.1210 4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -7.5460 5.2480 O 0 5 0 0 0 0 0 0 0 0 0 0 2.9510 -0.9960 2.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -0.3690 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 0.1650 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 0.1200 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 2.5210 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 2.5380 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 2.2790 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 0.1570 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 0.3580 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.5930 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -2.3300 4.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -3.6070 6.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -4.1350 7.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -3.4020 6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -1.5490 5.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -1.1640 4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -3.2300 6.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -5.4190 6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -5.8080 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -3.6220 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -0.4310 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 1.2020 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 0.6950 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0380 -0.9080 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 0.5450 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -7.7220 3.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 13 2 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 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 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 48 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 13 1 M CHG 1 22 -1 M END