PUBCHEM-ZINC06520166 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.3940 0.6310 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.7900 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -1.7680 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -1.4730 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -3.0340 0.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -3.7100 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -3.3680 0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -4.5160 0.9800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -2.4500 0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -1.1450 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 0.0570 0.3270 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 -0.4650 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -1.4750 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -1.8820 -3.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -1.2850 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 -0.2790 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 0.1280 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 0.3570 -2.8300 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.2480 -0.0050 -3.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 1.2430 -2.1190 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8320 -2.8420 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -3.0220 2.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -1.8020 3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 -2.1140 4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -2.7240 5.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 0.7140 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.9130 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 1.2950 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -1.9410 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -2.6660 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3840 -1.6040 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 0.9100 -0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 -2.0620 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -3.7750 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 -1.1920 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -1.2570 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -1.1900 5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -2.7960 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -2.9500 6.0460 H 0 0 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 10 2 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 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END