PUBCHEM-ZINC01097266 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7800 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.4080 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.5590 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.5080 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2990 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1140 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4480 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3110 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.1720 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 0.2850 4.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 0.8760 5.1040 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 1.1970 6.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 1.8220 4.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -0.4520 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -0.9370 6.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -1.9800 6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7600 -2.5400 5.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 -2.0580 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -1.0070 3.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 -0.5280 2.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -1.1480 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8550 -2.6420 8.1220 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.4550 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -5.5150 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.4260 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2700 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -1.0360 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 0.6550 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 0.5540 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -1.1380 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 0.2400 4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -0.5020 7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -3.3540 5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.4950 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -2.2070 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -1.0380 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -0.6710 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END