PUBCHEM-ZINC03748303 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 1.7330 3.9800 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 2.6820 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 3.0910 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 1.9220 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 1.8900 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.6120 -3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 1.9910 -4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 0.6000 -4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -0.1960 -3.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 0.4750 -2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -0.2740 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -0.5390 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -1.7220 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -2.0220 -5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5750 -2.3990 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -2.4200 -2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 2.7900 -5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.3840 -6.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 3.4950 -7.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 4.4720 -6.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 5.4190 -6.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 4.0790 -5.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 3.6850 -8.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 2.7050 -9.6980 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4110 4.7200 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 3.7580 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 4.4820 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 3.6670 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1910 2.2180 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 3.7110 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 1.4810 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 1.1320 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 2.5920 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 3.6960 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 0.1220 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -1.6210 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -0.0980 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -0.1520 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -1.7730 -5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 -3.0890 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -1.4680 -5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 -2.2500 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -3.4800 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -2.0000 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -1.8770 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -3.4410 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -2.5340 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 1.4290 -7.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0910 4.8440 -9.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 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 48 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 49 2 0 0 0 0 M CHG 1 24 -1 M END