PUBCHEM-ZINC04823310 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 1 0 0 0 0 0999 V2000 0.1710 1.5100 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 0.1250 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -0.6430 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -0.1590 -0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 1.1740 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 2.0440 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 3.3380 0.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 3.2590 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 1.9720 0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 1.5260 0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0430 0.5760 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 1.3470 1.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5170 0.5300 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6500 2.6280 1.4900 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5630 2.5210 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9430 2.8960 0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7660 2.2600 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 2.4700 -0.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 4.3530 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 4.4590 -1.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8190 3.9470 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 3.6670 2.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 3.1020 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 1.3200 2.5120 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2230 -0.5250 -0.1900 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2310 0.1910 -0.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -1.7560 -0.3220 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6910 2.1590 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -1.7210 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 4.0920 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 4.9930 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0880 4.7330 0.2460 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 28 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 29 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 24 -1 M CHG 1 25 1 M CHG 1 27 -1 M END