IBS-ZINC06623763 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.1590 1.3870 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.1310 -0.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4950 -0.4560 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -0.7170 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -1.2440 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.5710 0.9410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 -0.4880 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -0.0510 0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 -0.9820 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 -1.0110 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -1.4890 3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1330 -1.6750 3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3970 -1.4550 3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5550 -1.7540 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 -2.2640 5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2300 -2.4890 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -2.1860 5.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7540 -2.3020 5.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4190 -2.6390 6.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -1.8980 4.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -1.8520 4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -1.3770 3.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -2.2930 5.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -3.6410 5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -4.0530 6.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -3.1230 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -1.7790 7.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.3760 6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -0.7710 7.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -1.1210 9.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 1.8750 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.7330 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 1.7400 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.9690 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 -0.6830 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -1.0580 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5290 -1.5860 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3820 -2.4900 5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -2.8850 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -4.3830 5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -5.1000 7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -3.4810 8.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -0.3260 5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -1.5240 9.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -0.2080 9.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -1.8210 8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.6070 -1.2870 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 6 7 1 0 0 0 0 6 34 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 22 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 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 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 M CHG 1 47 -1 M END