PUBCHEM-ZINC03746129 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0030 1.5160 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.0040 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.7160 1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -0.3090 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.5080 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 0.3440 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -0.1230 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 -1.4880 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -2.3830 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -1.8820 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -3.6900 -3.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -3.5480 -4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -2.2120 -4.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 -1.8150 -5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -4.5220 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -5.3600 -5.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -6.2880 -6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -6.3860 -7.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -5.5530 -6.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 -4.6240 -5.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -5.6850 -6.5240 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -4.9570 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -5.0150 -2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -4.6880 -2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.8090 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 2.0960 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.8250 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -0.3470 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -1.7990 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -0.5460 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 0.1580 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -1.3830 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 0.0730 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 1.4090 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 0.5610 -3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -2.5840 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -5.2950 -5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -6.9330 -7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -7.1130 -7.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -3.9910 -4.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -5.8390 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -5.0220 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -5.4260 -4.1550 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 43 -1 M END