IBS-ZINC04428014 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 7.4090 1.2740 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 1.0950 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 0.4500 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -0.0270 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 0.1530 -1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 0.8090 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -0.3480 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.8340 -2.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -0.6780 0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -2.0640 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -2.6670 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -4.0490 -0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -4.8420 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -4.2660 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -2.8600 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3090 0.4770 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 -3.0420 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 -4.4290 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 -5.0580 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -6.3100 -0.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6810 -6.7780 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9970 -7.0510 0.2400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2930 -1.8340 -0.6460 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2590 -2.3500 -1.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -0.6330 -0.4490 O 0 5 0 0 0 0 0 0 0 0 0 0 8.3550 1.7840 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3870 1.4640 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2340 0.3140 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 0.9510 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -0.1690 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -4.5000 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -2.5590 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9360 -5.0070 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8310 -6.1320 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -0.2670 -3.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -0.6090 -4.5160 H 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 23 1 M CHG 1 25 -1 M END