PUBCHEM-ZINC05509114 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.1640 1.4550 -0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 0.1160 -0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.0230 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -1.2000 -1.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.4230 -0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -0.8840 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -1.1110 -1.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -1.7900 -0.9390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1060 -1.8460 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -1.1260 -1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 0.1190 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 1.4200 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 2.2600 0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 3.2680 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 1.5340 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 0.1850 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.7830 2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6650 -0.3690 3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 0.9860 3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 1.9650 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -3.2010 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -3.2680 -2.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 1.6050 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 1.5980 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 2.2260 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 0.6450 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -1.0370 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 0.2440 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -1.6830 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 -1.8140 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -0.8860 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 1.8130 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.8420 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -1.1150 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 1.2880 4.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 3.0190 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -4.0640 -0.8600 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 37 -1 M END