PUBCHEM-ZINC02047819 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 0.0380 1.4950 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.0330 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.6080 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -2.1410 -0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8150 -2.5060 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -2.6500 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -4.1680 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -4.6800 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -3.8330 -0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 2.0590 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 3.5820 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 4.2170 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 3.4250 0.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 1.8150 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8970 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -0.4330 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3370 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -0.2530 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -0.2100 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -2.3240 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -2.1820 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -4.5040 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -4.6650 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 1.7330 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 1.6490 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 3.9060 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 3.9920 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -5.9070 -0.7590 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.7050 1.1960 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2210 -2.3680 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -2.4420 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -3.7320 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 5.4760 -0.0540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 29 1 M CHG 1 33 -1 M END