ASINEX-ZINC04552594 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 0.5330 1.3300 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.1180 0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7780 -0.7590 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -0.5640 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.8170 1.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.3920 0.0420 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0600 0.1780 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -0.0760 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -0.9320 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -1.5370 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -1.2420 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.4540 -2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -3.5450 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -4.4150 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -4.2110 -4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -3.1370 -4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -2.2660 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 1.5370 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 1.5400 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 2.0360 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.8330 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 0.3880 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -1.1210 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -1.6900 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -3.7360 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -5.2540 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -4.8880 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3380 -2.9730 -5.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -1.4270 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 0.3630 2.3580 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 M CHG 1 6 1 M CHG 1 30 -1 M END