PUBCHEM-ZINC05112879 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2490 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.7910 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -3.1200 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -2.6220 2.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.3200 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -1.5450 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -3.8060 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4390 -4.3010 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 -4.3430 -1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -6.1310 -1.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -6.5760 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -8.0780 -3.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -8.5600 -5.2320 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9540 1.6330 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 3.5580 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 4.2420 0.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -3.7040 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -2.3360 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -3.8480 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -4.1470 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -6.0250 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -6.3230 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -8.6290 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -8.3300 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -3.6220 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 1.9510 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -3.9650 1.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5210 -4.0700 0.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -5.0620 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 4.1360 -1.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 1.6690 1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 2.0490 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 5.1030 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -4.1450 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 34 37 1 0 0 0 0 35 40 1 0 0 0 0 36 43 1 0 0 0 0 37 38 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M END