PUBCHEM-ZINC06095189 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 1.4050 -0.2570 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.4470 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 0.2430 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 1.1390 -1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 1.3060 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.6160 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 2.1420 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 1.7800 -0.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 3.2450 0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 4.2660 0.7390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9470 3.7880 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 5.3940 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 5.0620 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6720 5.8490 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 6.9430 -3.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 5.2550 -3.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0100 5.7020 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 4.3110 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 4.9390 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 4.8140 2.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 1.8860 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 3.0830 -2.6000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1860 -0.7940 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.1310 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 0.0920 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 0.7450 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 3.4250 1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 5.6260 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2490 6.3230 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 5.2990 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 4.0020 -1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 5.5120 2.5470 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9000 1.2810 -3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 2 0 0 0 0 M CHG 1 22 -1 M CHG 1 32 -1 M END