PUBCHEM-ZINC04521632 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.0070 1.2750 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.2350 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4620 -0.7360 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -0.6130 1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.2570 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.0070 1.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7920 -0.4170 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 1.4380 1.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 1.8970 -0.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2650 1.7410 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 2.8320 -1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 3.3230 0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -0.2360 2.4930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9310 -1.2870 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.1320 2.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6170 1.1510 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2460 0.0300 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6370 0.2560 3.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 0.2350 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 -0.7500 1.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 -0.5870 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 0.5780 3.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 1.4160 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.0380 1.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -2.3360 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7480 0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -0.4860 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.5390 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.7070 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 3.6750 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 0.7740 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -0.9730 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 0.6290 -1.9920 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 33 -1 M END