PUBCHEM-ZINC06506286 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3920 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -1.9100 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -2.2370 -2.9980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2190 -1.7460 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -3.7280 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -4.3510 -4.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -3.9210 -5.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -5.7080 -4.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -6.8320 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -8.0840 -4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -8.2290 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -7.1360 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -5.8560 -2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -4.6070 -2.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -1.7600 -2.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -2.3640 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -0.4810 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 0.2770 -3.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 0.0010 -3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 1.3280 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4270 1.7280 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 0.8140 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0540 -0.4300 -2.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 -0.8570 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 3.5060 -3.7540 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 0.0240 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 0.0400 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.3260 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.3420 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -6.7240 -5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -8.9590 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -9.2170 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -7.2600 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 2.0200 -3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4150 1.1230 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5810 -1.8820 -2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 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 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 26 41 1 0 0 0 0 M END