IBS-ZINC00217452 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -2.5060 -0.9580 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -1.0720 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.7110 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.9980 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.8560 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -1.2280 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -1.7410 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -1.8860 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.5160 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -1.5480 -0.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -1.8670 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1730 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.9080 3.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 1.3100 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 1.7020 4.3630 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 3.4470 4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 4.2280 2.8250 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 4.1670 5.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 5.6250 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 5.9880 6.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 3.9660 7.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 3.5160 6.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 5.8980 8.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 0.0500 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -1.6780 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -1.1630 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -0.4570 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -1.1200 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -2.0290 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.2850 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 1.8440 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 1.6130 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 6.1230 5.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 5.9370 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 7.0720 6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 5.5740 6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 3.5840 7.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 3.5800 8.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 2.4330 6.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 3.8070 7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 5.5860 8.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 6.9860 8.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 5.4700 9.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 5.4300 7.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 44 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END