PUBCHEM-ZINC04854673 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3530 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6730 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -6.3120 1.7920 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -6.8680 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -6.5350 2.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -6.8210 2.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -7.2190 1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -8.6220 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 -8.6350 3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -8.2900 4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -6.8880 4.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -10.0050 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -10.8840 3.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -10.2530 5.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -11.5850 6.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -11.5980 7.7040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7230 -10.8550 8.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -12.9980 8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -13.4380 9.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -12.0830 9.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -11.3140 8.2850 O 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.6940 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1340 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.2640 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -6.5140 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -7.2280 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -8.8910 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -9.3400 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -7.8990 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -8.3220 5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -9.0110 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -6.6790 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -6.1560 4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -9.5500 6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -11.8300 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -12.3210 5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -12.9420 8.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -13.6830 7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -13.9390 10.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -14.0790 8.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -11.5960 10.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -12.2240 9.7980 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 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 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 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 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END