PUBCHEM-ZINC06864823 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.9650 2.2920 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 0.9230 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.3080 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 1.1140 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 2.4870 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 3.0850 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 2.9790 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 1.8960 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 0.7830 0.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 -0.1500 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 4.3970 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 4.7230 2.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6570 4.0940 3.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 6.2080 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 7.0380 2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 4.5770 3.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 3.4740 3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 2.4670 4.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 3.5710 4.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 4.7700 5.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 4.9840 5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 4.0030 5.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 2.8060 4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 2.5620 4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.2350 3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.6000 3.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 0.7050 3.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 2.7490 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 0.3230 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -0.7590 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 4.1510 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 1.8280 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 4.5920 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 5.0680 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 5.4040 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 5.5480 5.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 5.9150 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 4.1630 5.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 2.0530 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 1.1850 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -0.1940 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 6.4070 2.6020 O 0 5 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 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M CHG 1 42 -1 M END