IBS-ZINC05209353 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0250 1.3580 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 0.4830 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -0.1860 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0210 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 0.9000 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.5660 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.6570 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.0460 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 1.2550 -0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -0.6890 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2560 -0.0360 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 -0.7460 -0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 -0.0590 -0.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5910 0.8990 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 -0.9210 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3340 -1.0500 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1090 -0.7420 -3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3720 -1.0090 -4.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6580 -0.8880 -5.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1720 -1.4720 -4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 -1.4990 -3.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1420 0.1730 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -0.1980 1.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 -2.1520 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 -2.8280 0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -2.7210 0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -1.9880 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -2.5620 0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.8830 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 0.3230 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7640 -0.8700 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 1.0630 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 2.2500 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 1.0430 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3610 -1.7130 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7040 -0.4520 -1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7580 -1.9100 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1170 -0.3570 -3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3600 -1.7750 -4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 -3.6830 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3090 0.7910 1.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 0.9170 2.2040 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 41 42 1 0 0 0 0 M END