CHEMDIV-ZINC04936401 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0930 1.7160 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.3510 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -0.5900 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -0.8170 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.1180 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -2.3640 -2.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -1.3100 -2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 0.0020 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 0.2380 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 1.1300 -2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -1.0800 1.6550 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -2.4040 1.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -0.8110 2.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 0.0380 2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9970 -0.2240 1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 0.6290 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 1.7150 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 1.9450 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 1.1110 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 3.1540 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 3.6320 4.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 2.7040 3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9530 2.7930 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5930 2.0110 2.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6330 3.9610 3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 4.0310 3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8210 5.2010 4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0790 5.9510 5.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 2.4010 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 2.1560 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 1.6680 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 0.4770 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.1080 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -2.9470 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -3.3800 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -1.5190 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 1.2500 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5230 1.2700 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 2.0630 -2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 0.9280 -3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -1.0870 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0460 0.4220 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 1.2980 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 2.8950 5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 3.9150 3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 3.6340 5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 4.6460 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4500 3.8640 5.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 4.8900 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3270 4.1230 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6110 3.1020 4.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0670 5.2730 4.2330 O 0 5 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 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 M CHG 1 52 -1 M END