CHEMDIV-ZINC00646580 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.7820 -2.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -0.6000 -1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -1.0730 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -1.1050 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -2.2420 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 -2.2340 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9180 -1.1630 -1.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3710 -0.0640 -2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 0.0000 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.6310 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -0.0570 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -0.3200 2.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 0.0990 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 0.8220 4.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 1.0740 3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 0.6220 2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.8490 4.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.9640 5.1990 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 2.5480 3.5600 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 2.7550 5.1960 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -0.1960 3.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -0.9170 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -1.1890 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8440 -0.7480 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 -0.0310 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7010 0.2420 4.8880 C 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 2.5630 -0.3670 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -2.0760 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -0.3990 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -3.1220 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 -3.1160 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9920 0.7940 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 0.9020 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 1.1760 4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -1.2620 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0840 -1.7470 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 -0.9630 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 0.3120 6.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 0.7970 5.5310 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 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 M END