PUBCHEM-ZINC00174175 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.3810 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0030 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6850 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0120 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4090 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0900 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.1620 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 1.5660 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 3.5100 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7990 4.1960 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 3.3570 -0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 5.5440 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 6.2520 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 7.5410 0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2830 8.0490 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 7.1460 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 5.5500 0.0870 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -0.9220 -0.0160 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5530 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -1.7650 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1700 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 3.9850 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 6.0200 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4670 9.1080 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3220 7.3570 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 M END