PUBCHEM-ZINC04507942 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.3380 1.6030 -1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 0.2690 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -0.3270 -0.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 1.2780 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 2.1150 -0.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 1.6330 -0.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 2.9330 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 3.7940 -0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 3.3180 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 4.7780 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 5.5200 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 5.5390 1.8900 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7260 4.5230 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 6.2410 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6040 7.0200 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 6.6960 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2660 6.3360 1.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 5.4390 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 6.6370 -1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 4.6910 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 5.6770 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 4.9170 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 4.1970 -5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 3.2100 -4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 3.9700 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 2.2140 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.3380 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 0.9450 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 2.9300 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 2.9000 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6450 6.5420 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 5.0360 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 6.9270 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 5.5060 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 8.0910 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1920 6.6700 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 7.5720 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0080 5.8590 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 3.9600 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 6.1900 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 6.4080 -3.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 4.1870 -4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 5.6200 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 3.6550 -6.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 4.9270 -5.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 2.4800 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4220 2.6970 -4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3220 4.7010 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 3.2680 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 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 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 M END