IFLAB-ZINC04159257 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.8980 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.0090 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 -0.7620 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.1890 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1970 0.8960 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -0.6080 -0.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9560 -0.6220 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 0.1720 0.7340 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4220 0.5430 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 1.3480 1.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8800 2.2340 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3680 0.8940 1.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 1.6350 2.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4690 1.1580 3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 1.6160 4.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 2.4100 4.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1320 2.4260 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0780 3.1420 2.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9640 3.8220 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9820 3.8460 4.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6570 4.3650 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0580 3.1590 5.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0650 3.1730 6.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0390 -0.6540 1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4180 -1.9400 0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9890 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -1.3950 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -1.3860 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 0.5000 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7100 4.3850 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5230 -1.4400 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2150 -2.4850 0.2740 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 31 42 1 0 0 0 0 32 43 1 0 0 0 0 M END