IBS-ZINC05347474 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.3100 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.2050 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.5060 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.5880 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.0260 2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -0.7160 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -1.0020 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -1.2100 2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -1.1320 1.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -0.8460 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -0.6440 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -1.3420 0.9940 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 -0.6690 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 0.1910 -0.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3970 -0.9720 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -0.3640 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5360 -0.9410 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4010 -1.9180 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0850 -1.9170 0.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7030 -2.4880 1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5140 -2.6540 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 -2.4260 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8790 -1.4650 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7920 -0.7210 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9340 0.2170 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2410 0.3840 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.6890 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.5340 -1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.7850 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -0.5840 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -0.6800 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.2900 3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 0.0760 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -2.3250 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.6910 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -2.0870 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -1.0620 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -1.4320 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -0.7860 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -0.4260 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -1.9720 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 0.4200 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -3.4050 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5970 -3.0010 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8460 -1.2980 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2150 1.1630 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9360 0.6710 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5670 -0.5540 -3.2570 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 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 24 2 0 0 0 0 18 19 1 0 0 0 0 18 21 2 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END