PUBCHEM-ZINC04546549 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 1.3570 1.3010 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -0.1800 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.8560 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -2.2190 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -2.9000 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -2.2200 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.8600 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -0.0060 -2.8700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.8860 2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.2880 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -4.8530 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -4.1270 4.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -6.1660 3.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -6.6710 5.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -5.6460 6.3680 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -7.9840 5.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -8.5260 6.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -7.8900 7.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -8.4350 8.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -9.6180 9.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -10.2440 7.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -9.7070 6.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -10.5060 5.3570 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -7.7630 10.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -6.7340 9.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 1.4660 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.7520 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.7550 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -0.3240 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -3.9610 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -2.7500 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -4.4520 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -4.7840 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -6.7460 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -8.5520 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -6.9760 7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -10.0420 10.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -11.1580 8.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -8.2910 11.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -7.8150 12.0020 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 39 40 1 0 0 0 0 M END