PUBCHEM-ZINC05273678 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.1230 1.4860 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 0.0430 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.3700 -1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.7340 0.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -2.1840 0.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2800 -2.5360 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -2.8540 1.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1020 -2.6460 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -4.3640 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -4.6900 0.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5230 -4.0540 -0.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -2.6230 -0.6190 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3110 -2.2130 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -2.1260 -2.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4850 -2.2820 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -2.8890 -2.9310 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4930 -2.8730 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -2.3120 -4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -3.1850 -5.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -4.0800 -4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -4.2700 -3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -4.6130 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -0.7300 -2.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.2750 -1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -6.2610 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 -6.9200 1.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -4.2530 1.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -4.3750 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -3.8870 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 -3.9260 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 -4.4550 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -4.9490 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -4.9100 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -2.2650 2.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -2.8260 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 1.9420 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 2.0130 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 1.5750 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -0.3170 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -4.7980 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -4.7800 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 -1.3130 -4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -2.2730 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 -3.4750 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0020 -3.5460 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7700 -4.4880 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1090 -5.3690 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -5.3110 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -6.6940 -0.6960 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 44 1 0 0 0 0 30 31 1 0 0 0 0 30 45 1 0 0 0 0 31 32 2 0 0 0 0 31 46 1 0 0 0 0 32 33 1 0 0 0 0 32 47 1 0 0 0 0 33 48 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 49 -1 M END