OTAVA-ZINC05463575 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 -1.6960 1.9650 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.4280 -0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 0.4010 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.9420 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.8840 -2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -1.4870 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -0.1460 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 0.8040 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 2.1630 -2.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 2.6670 -1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 1.9270 -1.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 4.1490 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 4.5100 -0.7240 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 6.3110 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7490 6.7740 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 5.9680 0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 8.0830 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 8.5260 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2320 7.7360 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2560 8.1750 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1590 9.4020 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 10.1910 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 9.7590 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4480 9.9510 3.4670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.2860 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -0.9450 -4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 2.4260 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 1.1440 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 2.7080 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 2.2480 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 0.9670 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -1.2550 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -2.9330 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 -2.2260 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 2.7440 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 4.4720 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 4.6810 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 6.5800 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 6.7890 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 8.7190 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3070 6.7780 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1320 7.5600 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 11.1480 2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 10.3770 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 0.8140 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 0.9480 -3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -1.4780 -3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -1.6030 -4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 -0.6320 -4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END