PUBCHEM-ZINC05141268 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0110 1.6050 -0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.1840 -0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.4470 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 0.2120 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -0.5170 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.9150 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -2.5780 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -1.8550 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.4280 -0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -3.8190 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -2.6980 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -2.9320 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 -4.3680 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2950 -5.3330 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4170 -4.7090 -1.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1210 -4.0940 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9400 -3.1190 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7060 -4.7640 -2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6160 -3.7070 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9220 -3.7650 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3460 -4.8930 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4730 -5.9570 -3.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1700 -5.8870 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9490 -4.9720 -3.8360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.9320 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.9830 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 2.0230 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 1.2950 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 0.0220 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -3.6640 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -4.0760 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -4.0720 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -4.4060 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -3.6550 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -2.1500 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -1.9970 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -3.4500 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 -4.8890 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 -3.5060 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5600 -5.6220 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 -6.2440 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9770 -3.5690 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8660 -4.8940 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1810 -2.2620 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 -2.7700 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3160 -2.7960 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5940 -2.9240 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7960 -6.8480 -3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5250 -6.7510 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 -3.8180 -1.1140 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.5010 -4.6300 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END