IBS-ZINC04815703 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0300 1.2610 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0880 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.7280 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 -0.0230 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.3450 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.9760 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 1.7610 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 2.6540 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 0.6710 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -0.3710 0.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 0.6690 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5890 -0.3180 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 -0.4430 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7320 0.3250 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6410 -1.4350 -1.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 -2.2890 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 -3.1590 -2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 -2.2370 -2.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -1.3040 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 -1.2700 -1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.7500 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -0.6340 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -1.7760 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 3.0230 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 1.4420 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6060 -1.5320 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -2.8890 -2.7810 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 2 0 0 0 0 M END