IBS-ZINC04940542 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.2990 1.7440 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 0.2530 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.3690 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -1.7590 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -2.5480 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.9320 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.5390 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.0230 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -4.4680 1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -4.9230 -0.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5530 -5.3500 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -6.7840 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7740 -7.3170 -1.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -7.2690 -1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -6.2900 -0.9410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9030 -6.5750 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -6.2710 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -6.4190 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 -6.3960 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -6.2250 -3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -6.0770 -4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -6.0990 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -6.2060 -4.1960 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -8.6550 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -9.4720 -0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -9.1500 0.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -4.6500 -0.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 2.0260 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 2.1160 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 2.2390 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 0.2230 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -2.2230 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.5020 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -0.0740 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -6.5660 -0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -6.5180 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -5.9530 -5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -6.0000 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -9.1970 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -8.6210 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -4.4220 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -10.3830 -1.2310 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 27 2 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 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 42 -1 M END