PUBCHEM-ZINC05134383 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 1 0 0 0 0 0999 V2000 0.0000 1.3680 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.1380 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -0.6380 1.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.0100 2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 1.4890 2.6410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3630 1.8400 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 1.9330 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2000 1.2330 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 3.2030 -0.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 4.2660 -0.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 1.7280 3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 2.3430 3.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 1.5420 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 1.8970 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.5070 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.6600 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -0.5710 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 -0.2900 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 2.3270 1.4240 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2230 3.2940 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 2.5490 1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 3.0150 -2.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3010 1.3280 4.8360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 22 -1 M CHG 1 23 -1 M END