IBS-ZINC02138609 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.5450 1.0410 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.9020 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 1.0690 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 2.5130 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 2.9390 4.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 4.2680 4.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 5.1750 3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 4.7880 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 3.4200 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 2.9200 1.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3660 3.3710 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 3.4740 0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 3.3400 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 4.1370 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 4.3640 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 5.0440 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 5.5080 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 5.3150 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 4.6290 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 5.8460 -4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 6.4290 -5.0770 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8660 6.1690 -4.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 5.7200 1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 6.5140 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 6.4350 4.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 6.2070 5.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 4.8380 5.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -0.0500 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 1.4660 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 1.3360 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 1.3900 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.1710 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.4770 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 0.6950 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 2.2450 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 4.0120 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 5.2050 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 4.4820 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 6.4080 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 7.0890 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 7.2220 3.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 5.8910 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 6.8450 6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 6.4900 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.4430 1.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 5.6830 -4.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 45 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 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 46 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 21 -1 M END