IBS-ZINC02097531 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 0.1100 1.3700 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.1270 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -0.9090 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -0.6400 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.0150 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -0.6510 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -0.0330 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -0.6840 -2.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -0.2830 -3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2640 -0.9690 -4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 -0.6640 -5.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 0.3390 -6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5940 1.0280 -5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 0.7200 -4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7590 0.6670 -7.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.6000 -0.0400 -7.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3310 2.0830 -6.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5120 2.3960 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6380 2.6030 -7.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1850 2.4590 -9.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1120 2.8230 -10.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0440 0.4190 -8.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6620 -0.7650 -8.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.6900 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 1.9640 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.6160 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -0.3070 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.7670 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.9810 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.5840 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.7290 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -0.4520 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 1.0620 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.1470 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -1.7320 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -0.5350 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 1.0390 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -0.1880 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5320 -1.7540 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0590 -1.2210 -5.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 1.8070 -6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 1.2800 -4.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6810 2.2150 -5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5660 2.8520 -7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2010 2.1910 -9.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5800 3.4190 -11.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4840 1.9070 -10.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9500 3.3960 -9.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 1.4310 -9.2890 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 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 M CHG 1 49 -1 M END