PUBCHEM-ZINC05503753 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 1.7940 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 2.2600 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 2.4570 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 2.4850 -3.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 2.2590 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 1.8270 -2.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 2.8060 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 2.5560 -4.8830 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 2.1000 -4.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 2.2790 -5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 3.4910 -5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 3.6570 -6.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 2.6090 -7.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 1.3960 -7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 1.2300 -6.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 2.8160 -8.7390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 1.5280 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 2.8290 0.8970 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0150 3.2590 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 2.5380 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 3.7540 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 2.7370 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 1.0580 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 4.3090 -4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 4.6040 -6.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 0.5780 -7.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 0.2820 -6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8490 1.1450 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 0.7920 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 2.1080 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 1.8320 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 3.4640 2.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 4.6030 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 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 18 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END