PUBCHEM-ZINC03686840 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.0220 1.4530 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0540 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.5440 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 0.1380 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -0.5550 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -1.9350 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -2.6320 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -1.9430 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.7120 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.8580 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -3.7500 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -4.2850 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -5.1570 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 -5.5030 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -4.9860 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -4.1140 -0.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -3.4650 -0.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -3.5380 -1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -5.3840 -3.1000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -6.5860 -1.8680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.2210 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -3.0260 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.3510 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -3.1390 5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -2.7830 0.5440 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 1.7510 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.6980 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 2.0130 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 1.2130 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -0.0100 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -3.7090 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -4.0260 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -5.5630 0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -2.1270 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -1.1990 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -3.1430 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.0380 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -2.2690 5.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -1.3300 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -3.1960 5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -4.1470 5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -2.4510 7.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.9510 7.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -1.4900 7.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -2.4020 7.5110 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END