PUBCHEM-ZINC02827564 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.6780 1.9200 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 0.4010 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.1790 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -1.6980 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.2520 -3.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -3.7980 -3.4780 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -4.0470 -4.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -3.9130 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -4.8820 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -5.3700 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -6.2200 -4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -6.5840 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -6.0920 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -5.2470 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -7.4440 -2.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -8.3350 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 -8.3330 -1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2650 -9.3120 -1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 -9.1640 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -10.3190 -1.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 -11.1430 -2.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -10.6920 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -11.4120 -3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -11.3860 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -12.0570 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -12.7560 -4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -12.7860 -4.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -12.1220 -4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 -12.1660 -4.8350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 -7.9380 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 2.3520 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 2.1560 -2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 2.3330 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.1640 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -0.0310 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 0.0580 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 0.2530 -2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -1.9340 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.1300 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -1.7140 -4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -5.0870 -5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -6.6000 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -6.3720 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -4.8680 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -7.3980 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -10.8410 -1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -12.0370 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -13.2800 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -13.3320 -5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -7.2940 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -8.2370 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2010 -7.3960 -0.0930 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END