PUBCHEM-ZINC03871462 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.0590 1.3390 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0070 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2490 0.1350 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.9690 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.3490 0.3620 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 -1.5750 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -2.5080 1.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 -1.4960 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.5840 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -1.2300 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -0.3810 -0.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 0.2940 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 0.8160 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 -0.3330 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -0.8030 -0.8360 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2020 -0.3390 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -2.3040 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -2.9660 -0.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -2.9110 -0.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -4.3700 -0.5810 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2400 -4.7350 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 -4.7610 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -4.2560 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -2.9980 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 -2.5340 3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -3.3290 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -4.5880 3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -5.0530 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -4.9790 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -4.2670 -2.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.7150 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 2.0510 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 1.2120 1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -1.0430 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -1.9540 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 -0.5800 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4890 -2.3580 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 -1.4920 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 1.1260 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -0.4130 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 1.7500 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 0.9340 -3.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 0.0390 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -1.1410 -2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -2.3810 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2120 -4.3210 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 -5.8470 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 -2.3770 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -1.5510 3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5620 -2.9660 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -5.2080 4.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -6.0380 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -6.3120 -2.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -6.6560 -3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 53 54 1 0 0 0 0 M END