IBS-ZINC05577633 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.5770 -0.3010 2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -0.8530 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -2.0280 0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -1.3230 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -1.2260 2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -1.8490 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.3460 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -1.4750 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -1.9650 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -3.3420 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 -4.2310 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -3.7160 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -5.5020 0.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -5.5540 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -6.6790 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -7.9970 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -8.9280 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 -10.1660 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -10.4860 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -9.5720 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -8.3340 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -7.1930 -1.7860 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 -8.6170 2.2500 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.6930 -4.1720 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -3.7970 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 0.0390 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.5360 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -1.0840 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.0700 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -2.4210 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -1.6880 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -2.8110 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -0.4090 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 -1.2880 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -4.3830 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 -6.6040 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3560 -10.8850 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -11.4550 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -9.8320 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 24 25 2 0 0 0 0 M END