IFLAB-ZINC01687032 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 0.0070 1.3450 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0480 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -0.7330 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -0.0070 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 1.3990 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 2.0610 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 2.2360 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 2.6770 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 2.4520 -2.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 3.4930 -1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 3.7580 -0.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6590 -0.7800 -0.0650 N 0 3 0 0 0 0 0 0 0 0 0 0 4.4470 -0.5280 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -1.6550 0.7970 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9380 1.8800 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5990 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -1.8210 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 3.1490 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 3.1350 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 1.6960 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 3.8410 -2.8010 O 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 11 -1 M CHG 1 12 1 M CHG 1 14 -1 M END