IBS-ZINC04863181 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.3970 1.3610 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.1450 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -2.0110 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -2.3670 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -0.5860 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -0.1730 1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -2.3920 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -2.4200 2.4210 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6520 -1.4060 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 -2.9850 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 -4.2770 2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7320 -4.3820 2.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2750 -5.2170 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2590 -3.1840 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 -2.2860 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4820 -0.9680 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -0.5890 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8350 -1.5170 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5820 -2.8310 1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9420 0.7160 0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2620 1.1690 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 -3.1720 3.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 1.6140 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.7670 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 1.8680 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -0.6140 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.5520 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -2.5710 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.2050 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -1.8570 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -3.4460 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -0.3420 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 0.0240 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.9090 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -0.6860 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 -3.4080 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -1.7330 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7870 -5.1240 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -0.2380 1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8660 -1.2520 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3930 -3.5460 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6960 0.6210 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8990 1.1020 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1990 2.2230 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -3.0310 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -0.5300 0.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.0160 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.0240 1.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 46 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 48 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END