PUBCHEM-ZINC00677228 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.8500 1.5610 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 0.1120 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.7460 -0.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -1.2480 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -1.4300 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -1.9270 -3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5140 -2.2430 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -2.0640 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -1.5720 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -1.1210 1.3460 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -2.3390 1.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.9570 2.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 0.1100 1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -0.1280 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 0.8350 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 2.0440 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 2.2800 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 1.3110 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 3.0210 2.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 2.6650 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 1.0360 3.8760 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2190 3.5920 3.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3710 3.2360 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5550 2.0830 4.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4310 4.2730 4.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 2.1990 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 1.6270 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 1.8880 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.2150 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.0460 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -1.1820 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -2.0680 -4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -2.6320 -4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -2.3120 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1270 -1.4360 -0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -1.0680 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 0.6480 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 3.2190 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 1.4920 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 3.9550 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0720 4.5150 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0900 5.2440 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3500 3.9970 4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6220 4.3270 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 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 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END