PUBCHEM-ZINC06453251 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -1.6530 -1.4920 5.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -2.2180 4.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -2.3190 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -1.8470 3.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -3.0630 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -3.6680 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -4.2980 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -4.1690 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -3.2710 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -2.8170 0.8810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -2.9930 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -3.6050 -1.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6990 -2.4060 -0.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6560 -1.5940 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 -3.4810 0.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6110 -3.7100 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -4.7320 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 -4.1980 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -2.7510 -1.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4140 -2.3460 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0530 -2.8750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -1.8450 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7990 -0.8560 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5570 -1.4800 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -1.8460 -3.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -1.4850 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -0.4580 5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -1.9820 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -3.6400 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -4.8280 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -2.2920 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -5.2090 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 -5.4900 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 -4.2570 -2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1150 -4.7830 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 -3.5480 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2610 -1.9130 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -0.7760 -2.3150 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 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 9 2 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 38 -1 M END