IBS-ZINC05353319 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -2.0160 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -2.7410 2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -2.5790 -0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4700 -2.3430 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.9400 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -4.0970 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.0540 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.2620 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -2.2470 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -2.2630 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -4.3280 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -4.4980 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -4.5450 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -0.0310 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 9 21 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 21 22 1 0 0 0 0 M END