PUBCHEM-ZINC05496969 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.1320 1.6820 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 0.1820 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.2580 1.4180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2080 -1.0130 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.9530 1.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.6980 -0.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8610 0.2200 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -0.7000 -1.2920 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0500 -2.0150 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1370 -1.8740 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -1.9570 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 -2.6040 2.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -3.1780 -0.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 -3.1310 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 -4.2900 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -4.3870 -0.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -5.4000 -1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -6.1860 -2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -7.2430 -3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -7.5240 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -6.7530 -2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -5.6930 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 0.9050 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 1.4260 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -0.2880 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 2.0540 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.9080 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 2.2700 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -5.9770 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -7.8500 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -8.3510 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -6.9880 -2.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -5.1290 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.0340 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -1.3730 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 0.1870 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.2210 3.0390 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 2 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 25 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 M CHG 1 37 -1 M END