PUBCHEM-ZINC04556837 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.5210 1.4840 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 0.0490 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.6960 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -2.1030 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -2.7340 -1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.6680 -0.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -1.9070 -0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.5630 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 0.1270 0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -0.5090 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 -1.8530 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -2.5600 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -2.5710 0.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 -1.8410 0.1150 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8450 -1.1760 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -2.8380 -0.1840 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9880 -2.2680 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4030 -3.6830 1.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6150 -4.4270 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5730 -2.8030 2.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6310 -3.4310 3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -1.7690 2.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5090 -2.2700 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -1.0320 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -0.7570 3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -0.0210 3.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 -0.4020 5.3210 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 0.4120 5.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -0.0210 6.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8530 -2.1550 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4440 -2.8680 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6580 -4.3830 0.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8200 -4.5480 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -3.6750 -1.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7210 -4.4330 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8630 -4.5670 -1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -5.1410 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 1.8020 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 2.1460 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 1.6380 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -0.2900 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0780 1.1710 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 0.0720 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -3.6120 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -0.0260 3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2230 -1.2560 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -3.6850 -1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 -6.1290 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0370 -5.2480 -3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 -4.5750 -3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -1.8400 5.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 32 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 51 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 34 47 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 48 1 0 0 0 0 37 49 1 0 0 0 0 37 50 1 0 0 0 0 M CHG 1 51 -1 M END