NCID-ZINC01651912 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.6720 1.5220 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.0540 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.6820 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -2.0540 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.7160 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -2.0330 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.6610 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 0.0140 -2.4110 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.3990 -3.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.9490 -2.7290 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6430 -4.4730 -0.1280 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -4.6130 -1.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -4.6260 0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -0.0300 2.5070 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5880 -0.4590 3.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 0.9030 2.6010 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2350 2.1190 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 1.8040 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 1.7890 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -2.6030 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -2.5650 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -5.0770 0.0830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 22 -1 M END