PUBCHEM-ZINC00186250 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0230 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -0.0910 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 0.3240 -2.6050 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.6970 -2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.7060 -3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 1.7820 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 3.0260 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 4.1700 -3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 4.0700 -4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 2.8250 -4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.6820 -4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 5.6350 -4.8670 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.4560 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.3260 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -2.3750 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -0.0650 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 3.1040 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 5.1420 -3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 2.7460 -5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 0.7100 -4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 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 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 M END