IBS-ZINC05149174 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -2.0580 -0.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7910 -2.4940 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.5880 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -4.0310 -0.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7660 -4.6150 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 -4.0660 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0200 -2.6740 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -1.9330 0.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -2.2330 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -0.9810 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1950 -0.8130 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9040 -1.8960 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8240 -3.2340 -0.3160 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -4.4450 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -5.6350 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -6.0450 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -5.2600 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -4.0700 -3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -3.6430 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -2.4320 -1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -4.2620 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -4.8150 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -0.1880 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6600 0.1260 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9820 -1.9420 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -6.2480 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -6.9750 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -5.5800 -4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -3.4630 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 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 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 M END