PUBCHEM-ZINC06525069 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 2.4320 1.3050 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -0.0710 -0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.6840 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.0770 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 1.4540 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 2.0790 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 3.5520 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 4.2230 0.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.5880 0.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1920 0.0790 0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -1.8010 0.8380 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0440 -2.1870 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.7210 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -1.8430 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -2.3250 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -3.7030 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -4.5830 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -4.0880 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -5.0190 0.4190 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2300 -6.2180 0.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.5870 -0.6860 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8190 -4.2260 5.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -5.4250 5.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 1.7820 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -0.6710 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 2.0460 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -2.4790 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -2.5960 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.7780 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -1.6390 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -5.6500 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 4.1520 -0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -3.3740 6.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -3.7640 7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6090 5.1190 -0.3250 H 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 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 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M CHG 1 19 1 M CHG 1 21 -1 M END