IFLAB-ZINC04850462 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0010 1.3620 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 0.2110 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -0.4610 -0.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 0.0220 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.1840 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 1.8460 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.6940 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -1.9070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 -0.0020 -0.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 -0.7020 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -0.1810 -1.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 1.3420 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 1.9690 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 1.4680 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7490 1.7200 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9290 2.4830 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4970 2.9560 -2.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7230 1.8330 -2.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 1.3620 1.3360 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1160 0.6560 1.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 0.8360 1.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0120 2.8890 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8360 3.5190 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 4.7070 2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 5.0420 3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1740 3.8120 3.0930 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 1.8870 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -0.1620 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.3600 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 1.5620 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 2.7460 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7540 -0.5110 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9800 -1.7730 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 -0.6180 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -0.4570 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 3.0540 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 1.6860 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 1.8280 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 1.8360 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1190 3.3350 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8060 1.8390 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8800 3.8530 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 3.1280 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 3.1310 1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 5.3160 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 5.9310 4.0260 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 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 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 M END