PUBCHEM-ZINC02815596 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 -2.5700 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -2.7620 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -2.5910 -2.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -3.1950 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -3.4660 -1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -3.8760 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -4.1810 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0200 -4.5360 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -4.4350 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 -4.0420 -0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5370 -4.7160 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0460 -4.5740 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8580 -4.8340 3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1790 -5.2420 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6700 -5.3840 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8610 -5.1190 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0550 -5.5230 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6280 -5.4010 5.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -3.2850 0.7760 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -2.7810 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -2.6510 2.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5230 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -3.3690 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 -4.1510 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9860 -4.8320 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0260 -4.2600 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4790 -4.7250 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6900 -5.6990 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2410 -5.2240 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3280 -5.9160 3.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.8640 -6.0890 4.5980 H 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 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 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 39 40 1 0 0 0 0 M END