PUBCHEM-ZINC02187290 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 0.0280 1.4210 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.0200 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.6560 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 0.0410 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 1.4530 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 2.1470 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.6540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 4.2810 -0.9780 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7710 2.2310 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 2.1980 -1.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9570 -0.9900 0.0360 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -1.0890 -1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.2780 0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.7330 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -2.0050 -0.1490 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9120 1.9740 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.7450 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 4.1810 0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 2.8910 1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -2.2530 0.5980 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.3900 -0.0470 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 14 1 0 0 0 0 3 4 2 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 18 2 0 0 0 0 9 10 1 0 0 0 0 9 19 2 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 14 15 1 0 0 0 0 14 21 2 0 0 0 0 M CHG 1 8 -1 M CHG 1 10 -1 M CHG 1 15 -1 M CHG 1 20 -1 M END