PUBCHEM-ZINC06269947 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.6690 0.4100 4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -1.1030 4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -1.3760 3.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -2.6820 3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -3.0170 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -4.3420 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -5.3450 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -5.0060 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -3.6790 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -6.7710 2.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -7.7900 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -9.2810 2.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -8.4340 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -7.1440 1.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -9.0530 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -10.4290 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 -11.2310 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -11.8680 2.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -11.0710 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -12.3240 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -12.9470 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -14.2750 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -14.8520 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -14.1190 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -12.8030 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 -12.2140 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0760 -10.1400 0.0660 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 0.6190 5.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.8330 3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 0.8580 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -1.5500 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -1.5250 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 -2.2390 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -4.6020 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -5.7810 4.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -3.4160 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -7.6750 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -8.4480 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -12.8710 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -14.8480 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -15.8780 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -14.5760 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -12.2370 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -11.1890 -0.8720 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 2 31 1 0 0 0 0 2 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 3 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 39 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 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 M END