CHEMDIV-ZINC04668420 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.5340 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.0100 -1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 0.1540 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -0.1370 -3.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 0.6650 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8180 0.8160 -3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 1.2940 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 1.6240 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 1.4780 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 1.0060 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 2.1460 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1290 3.6060 -2.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 4.4800 -2.2550 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1670 5.8430 -2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9850 3.9990 -1.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7010 4.0460 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 4.7590 -4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7260 4.4200 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5920 3.3650 -5.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5110 2.6520 -4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5690 2.9960 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5160 3.0320 -6.2920 F 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 1.7650 -0.1340 1.2340 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 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.1570 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.3790 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.2420 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 0.5580 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6420 1.4110 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5540 1.7370 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 0.8960 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 1.8590 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6840 1.7220 -3.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 4.0610 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1050 5.5810 -4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7880 4.9760 -6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1860 1.8290 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5080 2.4420 -2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END