IBS-ZINC02409977 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 -0.4270 1.5520 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 0.1370 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.2540 1.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.6100 -1.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -2.0380 -0.9840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8460 -2.2270 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -2.6860 -2.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7640 -3.7800 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -2.2200 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -1.4780 -3.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -2.7640 -1.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -2.3930 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.2970 -3.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -3.0330 -4.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -3.9740 -4.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.5200 -5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -2.7070 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -1.9660 -0.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 1.9960 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 1.5790 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 2.1310 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -2.7360 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -1.3100 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -2.8810 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -1.4820 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -3.1220 -6.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -2.6010 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -3.9470 -0.4710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 M CHG 1 28 -1 M END