IBS-ZINC02217885 MOE2007 3D CORINA 3.40 0006 02.08.2006 16 17 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 1.5000 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7090 2.5720 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 0.8030 1.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 0.9870 2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 0.8130 3.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.3940 1.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 0.8940 -1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 1.0960 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 0.9650 -3.7730 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 1.4070 -1.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 0.3170 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 1.7970 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.4450 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 1.7760 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 16 1 0 0 0 0 M END