IBS-ZINC04956132 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.2800 0.8700 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 1.4020 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 2.5730 -1.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 0.4720 -2.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2400 0.4170 -3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 0.9150 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 1.0070 -5.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 1.2470 -4.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 1.0210 -3.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8960 1.9600 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 0.0170 -3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -0.8670 -4.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -1.7890 -4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 -1.8290 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -0.9440 -1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 -0.0230 -1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4260 0.8430 -0.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 0.7450 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 -2.7360 -2.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -3.6170 -4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 1.7460 -5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 2.1790 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 2.6710 -6.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 2.7340 -7.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 2.3030 -7.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 1.8150 -6.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2740 3.2150 -8.4470 F 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 0.0430 -3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.1990 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 1.3820 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.0440 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -0.8370 -4.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 -2.4780 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 -0.9740 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 1.4910 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 0.9200 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -0.2510 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6960 -4.2880 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9800 -3.0340 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -4.2020 -4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 2.1300 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 3.0080 -5.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 2.3520 -8.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 1.4830 -6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -0.5250 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 28 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END