PUBCHEM-ZINC03703937 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.3000 1.6100 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 0.1020 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -0.4930 0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -1.8620 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -2.7240 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -4.1190 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -4.6650 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -3.7900 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -2.4000 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -1.4900 0.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -1.9770 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -0.7790 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -6.1760 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3360 -6.4550 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 -6.4140 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -5.0040 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -6.6460 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4010 -7.2320 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2020 -7.5440 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -7.1880 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -6.5000 -2.6070 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -7.4480 -4.5670 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 2.1170 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 1.9350 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 1.9270 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.1880 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.1960 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -2.3330 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -4.2110 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 -2.5470 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -2.6030 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 -0.1800 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8970 -0.1250 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 -1.0990 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -7.0870 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -6.4410 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -5.0410 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -4.5720 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -7.4250 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1840 -7.9990 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -6.9500 -0.2850 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.9780 -7.9360 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -6.9330 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 41 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 M CHG 1 41 1 M END