PUBCHEM-ZINC03606156 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 0.4400 2.2200 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 0.8510 0.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 0.0190 1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.4010 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -1.2180 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -1.6350 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -1.2740 2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -0.4410 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -0.0660 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -0.5050 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -1.3870 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.7140 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -2.4660 2.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -2.9190 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -2.7020 1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -1.9700 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8990 -1.9540 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -2.1770 -1.7270 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5940 -3.6150 3.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -3.5540 4.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -2.8370 4.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 0.1910 -1.1730 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8860 0.8470 -0.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 0.2080 -2.2920 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3030 -0.0220 2.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 2.4410 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 2.8420 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 2.4790 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.5460 4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -2.2900 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 0.6000 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7900 -3.1150 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -4.5750 4.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7910 -3.0610 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 0.4280 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 -1.7670 -0.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 22 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 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 35 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 22 1 M CHG 1 24 -1 M END