IFLAB-ZINC04078722 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0120 1.3490 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.0240 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -0.6840 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0260 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.4120 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 2.0600 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 1.9450 -0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 1.1490 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -0.5050 0.2020 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 1.5690 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3810 2.9140 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 3.3020 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7110 2.3580 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 1.0190 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 0.6190 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 -0.6890 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0490 2.7590 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9920 1.9400 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 0.8970 -1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4480 2.3200 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2650 1.2730 -1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5940 1.2800 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2660 2.1280 -3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4380 0.0630 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5420 -0.6570 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7500 0.2320 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5790 0.0320 0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8600 -0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -0.5760 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.7530 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 3.1290 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 3.6490 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 4.3420 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 0.2890 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 -1.1960 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 3.6270 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6100 3.2630 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7300 2.4320 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9430 -0.5730 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4260 0.3600 -3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0980 -1.6510 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5810 -0.7180 -1.0330 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 M END