PUBCHEM-ZINC06093326 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 0.0840 1.6320 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.2550 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -0.4320 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.2670 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.6440 -0.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 2.3260 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 3.8020 -0.5450 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2000 4.4040 -0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 4.4140 -0.6590 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3130 -1.7870 -0.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -2.5530 -1.5250 P 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -2.0950 -2.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -4.3500 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -4.7100 -0.5560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.9080 -0.1250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -2.2310 -2.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.5480 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -3.8050 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -4.1240 -5.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -3.1920 -6.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -1.9380 -5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.6120 -4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -3.5360 -7.5840 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1520 -4.6410 -7.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -2.7160 -8.4350 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8550 2.1670 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -0.2870 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -0.2660 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 2.1880 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -4.8680 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -4.5340 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -5.1030 -5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.2110 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.6300 -4.1500 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 23 1 M CHG 1 25 -1 M END