IBS-ZINC05206891 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.5180 0.7790 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -0.7280 0.3860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0510 -1.2600 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7610 -1.0540 1.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -1.0040 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -0.5840 2.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4140 -1.6110 3.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2560 -2.5990 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -1.6230 4.8350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4760 -1.6810 4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -1.3900 4.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -2.1130 6.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -0.3720 5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 0.6560 5.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -0.3960 6.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 0.7220 6.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 1.9700 6.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 3.0710 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 2.8840 8.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 1.6150 8.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 0.5850 7.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -1.2240 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 0.0830 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 0.4410 3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -0.5120 2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -1.8220 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -2.1740 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 -0.1620 2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.4800 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.1420 0.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -1.1630 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 1.0870 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 1.0140 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 1.3100 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.4940 5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.3420 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 0.3920 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -3.1820 6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -1.5660 6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -1.9020 7.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -1.1900 6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 2.0800 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 4.0530 7.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 3.7220 8.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1670 1.4640 9.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 0.8240 3.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 1.4620 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 -2.5660 2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -3.1920 2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0830 0.1280 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.8560 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -2.2450 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END