PUBCHEM-ZINC04698782 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.7810 0.6850 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.7550 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.0860 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -2.4070 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -3.3960 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -3.0640 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -1.7430 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -4.8360 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -5.1440 -0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -6.4100 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -7.3390 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -8.6280 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -9.0040 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -8.0950 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -6.7840 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 -5.8080 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -6.1750 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -7.4340 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -8.3310 -1.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -7.5210 -1.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3450 -6.4980 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4680 -6.4410 -2.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 -5.2450 -0.8500 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.8720 -8.7290 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5250 -9.7060 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6580 -9.4220 -0.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 0.9200 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 0.8440 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 1.3330 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.3140 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.6660 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -3.8370 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -1.4830 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -5.4830 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -4.9950 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -7.0550 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -9.3470 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -10.0140 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -8.3930 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -4.7980 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -8.4650 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 -9.1850 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 -10.8910 -2.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3720 -11.4840 -1.5170 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 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 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 23 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 24 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 43 44 1 0 0 0 0 M END