IBS-ZINC06764235 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2320 1.6770 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 0.1600 -0.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5730 -0.2840 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.3930 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -1.4400 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9580 3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.4530 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -0.4170 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 0.1070 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 0.1130 3.2930 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -1.9990 4.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -2.3950 4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -2.9200 6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 -3.0570 7.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -2.6690 7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.1460 5.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -0.2030 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 -0.3700 -1.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.2880 -2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -0.6000 -3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.6330 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -0.9480 -6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.1320 -6.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 2.2130 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 2.0300 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 1.9700 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -1.8670 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -2.7770 3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 0.8980 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -2.3020 4.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 -3.2200 6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 -3.4630 8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -2.7710 8.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -1.8390 5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -0.1300 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 0.1600 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -1.5660 -3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -1.3860 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 0.3360 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -0.9840 -7.1500 O 0 5 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 1 0 0 0 0 2 4 1 0 0 0 0 2 17 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 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 M CHG 1 40 -1 M END