IBS-ZINC05050347 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.6880 1.5790 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 1.4970 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.6460 3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 2.9080 3.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 3.4980 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 3.2910 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 3.4360 4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 2.9150 5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 3.4230 6.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 4.4610 7.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 4.9930 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 4.4880 5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 4.9630 5.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 5.9820 5.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 6.6680 6.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 6.2050 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 7.1690 5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 7.1260 4.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 6.1280 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 5.2550 3.5100 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 0.5190 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 2.2090 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 1.8090 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.1670 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 0.4630 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 0.8200 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 1.5550 4.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 3.0370 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 4.5750 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 3.5050 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 3.9260 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 2.1070 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 3.0110 6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 4.8610 8.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 5.7970 7.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 4.4730 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 7.8780 5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 7.7930 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 5.8710 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 1.8520 1.4080 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0680 1.2480 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END