PUBCHEM-ZINC06707256 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0970 2.4910 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.9780 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 0.3950 0.2290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9390 0.8960 1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -1.1110 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 0.6340 -0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 0.8820 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 0.6120 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 0.9090 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 1.4630 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4880 1.7120 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 1.4300 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 2.3030 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 3.1780 -3.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2370 1.7490 -3.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0550 2.0740 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 3.2350 -6.0490 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2300 1.3190 -4.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1110 0.8760 -5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7660 0.8250 -7.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 0.3350 -8.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9310 -0.1100 -7.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2820 -0.0910 -6.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3740 0.3880 -5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8500 0.3670 -3.8080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.2730 0.2700 -9.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0880 0.6210 -9.9400 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9240 2.8720 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 2.7780 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 2.9830 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 0.5340 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 0.7340 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -1.6150 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -1.3330 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -1.5570 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 0.1670 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3840 0.7080 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 1.7160 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 1.6370 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5770 0.9710 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 1.0600 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7770 1.1200 -7.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6380 -0.4900 -8.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2600 -0.4550 -6.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1560 -0.1370 -10.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 45 2 0 0 0 0 M CHG 1 27 -1 M END