PUBCHEM-ZINC05984508 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.6940 2.7880 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 1.2650 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.6290 -0.9510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1940 0.9890 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.8930 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.9850 -2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.0470 -3.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 0.6480 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 0.7090 -4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.1670 -5.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 1.5690 -5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 1.5020 -4.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 2.0590 -6.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 2.4090 -6.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 2.1190 -8.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 2.5660 -9.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 3.0590 -8.9600 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 2.6250 -10.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 3.2000 -11.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 4.3540 -11.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 4.9210 -12.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 4.3370 -13.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 3.1840 -13.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 2.6200 -12.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 2.4540 -15.3020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 4.8950 -14.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 6.3640 -12.1100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 3.0780 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 3.1310 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 3.2410 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 0.9220 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 0.9750 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -1.3460 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.1650 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -1.2530 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 0.2900 -2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 0.3980 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 1.2130 -6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 1.8080 -4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 1.8390 -8.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 2.2690 -10.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 4.8080 -10.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.7250 -12.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 5.5480 -15.1120 H 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 27 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 26 44 1 0 0 0 0 M END