PUBCHEM-ZINC06625966 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 3.4750 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 2.6520 3.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 4.7900 2.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 5.2250 3.9780 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0760 4.5370 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 5.2590 3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 5.5380 5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 6.7380 5.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 7.1730 5.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6350 8.2510 5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 6.6330 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 6.9750 6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 6.1860 6.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 7.6580 7.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 8.6630 7.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 9.7890 8.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 10.8500 8.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9070 10.8160 8.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 9.7050 7.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 8.6130 7.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 7.4620 6.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9610 7.1430 6.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 11.9640 8.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 13.1080 8.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5220 14.0410 8.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8470 13.5050 7.8820 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0200 11.9900 7.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 3.4020 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 3.4180 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 5.4480 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0480 6.0490 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 4.2980 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 5.6790 4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 4.6860 5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 6.6100 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 7.2960 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 7.4350 8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 9.8230 9.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 11.7100 9.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 9.6790 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 13.2270 9.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 14.9880 9.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 11.2010 6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 1.1710 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 49 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 29 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 49 50 1 0 0 0 0 M END