PUBCHEM-ZINC05445094 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.4360 0.9750 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.5020 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -0.7570 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -0.7540 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -1.0300 -0.5990 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -1.2020 0.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -1.0520 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -1.2010 2.7540 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -1.5960 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -1.7720 5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -1.6440 5.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -2.0730 5.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 -2.2370 7.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -2.6230 8.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -2.8310 9.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 -2.8550 7.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -2.6500 8.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -2.9990 7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4900 -3.3950 6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1590 -3.3020 6.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -0.4900 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -0.8670 -3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -0.6170 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 0.0050 -5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 0.3810 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 0.1420 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 1.1640 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 1.5920 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.2200 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -0.7470 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.1190 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -0.7830 3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -2.5180 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -2.1760 5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 -1.9000 10.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9550 -3.6060 9.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -3.1390 9.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -2.2910 9.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1490 -2.9580 7.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9990 -3.7280 5.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -1.3530 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0080 -0.9090 -5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 0.1970 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 0.8660 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 0.4400 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 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 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M END