IBS-ZINC01748771 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.4150 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 0.0330 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6600 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0390 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4480 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.1280 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 1.8640 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 3.0090 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 0.7600 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -0.3550 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -1.4940 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 0.7720 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 0.7760 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0670 0.7880 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6630 0.7930 0.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7520 0.7920 2.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1480 0.7060 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8750 1.3120 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2530 1.2250 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9100 0.5340 2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1890 -0.0710 3.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8110 0.0180 3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6680 0.4250 2.4880 S 0 0 0 0 0 0 0 0 0 0 0 0 15.0040 -0.7320 3.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0710 0.6190 1.1390 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2460 1.7220 3.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9840 1.8330 4.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3880 2.8040 5.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0450 2.7490 6.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3180 1.6830 7.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0740 0.7120 5.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.9440 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 -0.5110 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7400 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 3.2070 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 -0.1150 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3880 1.6650 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 1.6620 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -0.1170 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2760 0.8560 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3630 1.8520 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8190 1.6960 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7040 -0.6100 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2480 -0.4510 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7690 2.4040 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3310 3.5070 7.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9410 1.4550 8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 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 12 1 0 0 0 0 10 11 2 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 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 M END