PUBCHEM-ZINC06147361 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 57 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.7680 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.7250 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 0.2050 -2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.7300 -2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.7860 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.2980 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 2.0850 -0.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0170 2.7710 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 1.2320 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 0.4390 -2.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 1.2120 -1.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 2.0800 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 2.8800 -0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0190 2.0580 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 1.0680 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 1.0260 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8280 1.9810 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 3.0000 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7440 3.0500 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1040 4.0780 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 5.0140 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2340 4.9800 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9030 3.9740 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3710 3.8960 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0350 4.7250 1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 2.9130 -0.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3020 1.9700 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9050 1.1030 -1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3850 2.8710 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0900 3.4550 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4700 3.4130 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1500 2.7890 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4510 2.2070 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0710 2.2510 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1960 1.5280 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5730 1.6170 1.6890 F 0 0 0 0 0 0 0 0 0 0 0 0 16.8880 2.1550 3.1350 F 0 0 0 0 0 0 0 0 0 0 0 0 16.8200 0.1820 1.9850 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 2.1710 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 0.3180 -2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -0.6080 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 3.1100 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 0.5730 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1470 0.3160 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6020 0.2450 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 4.1280 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3370 5.7990 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7930 5.7340 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5600 3.9420 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0190 3.8660 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2300 2.7570 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5250 1.7990 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 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 45 1 0 0 0 0 17 18 1 0 0 0 0 17 27 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 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 32 33 2 0 0 0 0 32 51 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 52 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 M END