PUBCHEM-ZINC06503356 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -2.0170 -1.2800 1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -1.0760 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.7660 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -2.2950 0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -2.9510 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -3.4900 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -4.1560 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -4.2910 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -3.7470 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -3.0780 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 -5.0020 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 -4.7760 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -3.6990 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -2.9010 -0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8830 -3.5600 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -2.4530 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -2.4610 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9380 -3.4500 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0280 -3.4580 -3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1620 -2.4750 -4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2080 -1.4820 -4.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1100 -1.4770 -4.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 -0.5140 -4.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5050 0.6570 -4.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 0.2520 -6.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3690 -0.4110 -5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0530 -4.5190 -3.7130 N 0 3 0 0 0 0 0 0 0 0 0 0 11.9360 -5.3840 -2.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0130 -4.5260 -4.4620 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.0270 -1.9420 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -0.7830 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.4140 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -1.0490 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.5770 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -3.3860 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -4.5750 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -3.8480 3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -2.6530 2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 -5.7050 2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7830 -5.4150 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8760 -2.5320 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 -1.5230 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8360 -4.2170 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0150 -2.4830 -5.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 1.2400 -5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2100 1.2590 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1250 0.3040 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 -0.8660 -6.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END