PUBCHEM-ZINC04760711 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5140 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.2940 4.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8210 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 -0.3030 3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 0.7400 3.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -1.0200 3.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0680 -1.1100 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -2.4140 3.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -3.1880 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -4.8410 4.3990 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -5.5910 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -0.2600 3.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 -0.3880 3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 -1.1340 2.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8680 0.3110 4.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2740 0.1230 4.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1070 0.9790 5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4370 2.2700 4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2010 3.0550 5.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6360 2.5490 6.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3070 1.2580 7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5470 0.4710 6.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -1.6550 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.9480 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -2.3230 4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 -2.6540 4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 -3.2790 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2560 -6.6050 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0090 -4.9970 4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5120 -5.6220 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 0.3360 4.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4620 0.4110 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5400 -0.9250 4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0970 2.6660 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4580 4.0640 5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2330 3.1620 7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6470 0.8620 8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2930 -0.5390 6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.0060 3.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.2750 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 54 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END