PUBCHEM-ZINC06778754 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 64 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -2.5720 0.0150 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4780 -2.0980 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -2.6050 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -2.1120 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -2.6180 4.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -2.0850 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 -2.5790 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -2.0720 -3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -2.5650 -4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -4.0410 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -4.5700 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -6.1000 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -6.6300 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -8.1600 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -8.6890 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0150 -10.2190 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4500 -10.7490 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4230 -12.7140 0.0140 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -1.0080 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -2.4760 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -3.6950 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -2.2280 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.0220 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -2.4890 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -2.2410 4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -2.2670 5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -3.7080 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 -2.4630 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -0.9950 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -2.2020 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -3.6690 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 -2.4490 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -0.9820 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -2.1880 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -3.6550 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -2.2040 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -4.3920 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -4.4020 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -4.2190 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7330 -4.2090 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -6.4520 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -6.4610 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -6.2780 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -6.2690 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -8.5110 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -8.5210 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5460 -8.3380 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5630 -8.3280 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -10.5710 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -10.5800 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9600 -10.3970 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9770 -10.3880 -0.8580 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 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 56 1 0 0 0 0 17 57 1 0 0 0 0 18 19 1 0 0 0 0 18 58 1 0 0 0 0 18 59 1 0 0 0 0 19 20 1 0 0 0 0 19 60 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 20 62 1 0 0 0 0 20 63 1 0 0 0 0 21 22 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 M CHG 1 5 1 M END