IBS-ZINC04729121 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0820 1.7380 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.5110 0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -0.2630 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 0.1860 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.4270 -0.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 2.1990 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 1.9150 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 1.2020 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 -0.5920 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -1.9280 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -2.4650 0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 -2.7490 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 -2.2120 0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -4.0850 0.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 -4.8640 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -4.3680 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9120 -5.1410 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 -6.4070 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -6.9040 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5890 -6.1390 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1260 -7.2330 0.4800 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1480 -6.7960 0.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1160 -8.3480 -0.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9830 2.3330 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 0.1580 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -1.2170 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 3.1560 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -0.1720 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -4.5060 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -3.3790 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -4.7560 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 -7.8940 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -6.5300 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 3.1520 -1.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 3.4270 -2.3160 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END