IBS-ZINC04026230 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.2080 1.6510 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 0.1480 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.3690 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.8970 -1.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1570 -2.3430 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -2.4380 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.1540 -2.6750 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0600 -1.0730 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -2.6010 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -2.0170 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -2.3410 -0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -2.8060 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -2.6890 -4.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 2.1850 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 1.9190 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.9980 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.0850 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -0.3540 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0940 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 0.1410 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -3.5260 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.0340 -3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -3.6970 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 -2.3090 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -2.4340 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 -0.9310 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 -3.3540 -3.8600 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 M CHG 1 27 -1 M END