IBS-ZINC03882829 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.0190 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 1.5480 1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6460 1.9000 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -2.6080 1.2200 O 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -0.3420 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -0.3330 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.7040 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 3.1450 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 3.0660 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 2.0570 1.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 1.6840 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.7050 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -3.6700 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 14 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 15 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 M END