PUBCHEM-ZINC00234500 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.2010 1.5810 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 0.7120 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 3.0520 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 3.2810 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 4.9750 4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 4.7560 4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 5.6900 4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 5.4850 5.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 4.3470 6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 3.4150 6.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 3.6170 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 5.5650 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 6.9200 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 7.0440 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 8.2810 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 9.4040 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 9.3000 1.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 8.0590 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 10.7010 0.5600 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5470 10.7830 -0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 11.6430 1.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2950 0.5650 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 1.8460 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 2.2440 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 0.9490 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -0.3020 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 0.6740 2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 3.7280 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 3.3310 1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 2.9630 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 2.7350 3.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 4.3210 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 6.0090 4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 6.5930 4.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 6.2150 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 4.1890 7.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 2.5310 7.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 2.8750 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 5.6330 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 5.0160 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 6.1780 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 8.3480 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 10.1680 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 7.9940 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 1.6740 0.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 4.7550 2.5500 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7400 5.1210 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 45 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 45 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 46 1 M END