PUBCHEM-ZINC06169232 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 3.4490 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 3.5680 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 3.9600 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 4.2320 -1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 4.1180 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 3.7270 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 3.6180 -1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 4.4080 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 4.3080 -3.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 4.8320 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 5.0560 -5.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 5.4470 -6.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 5.6110 -6.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 6.0080 -8.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 6.2420 -9.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 6.0790 -9.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 5.6870 -8.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 5.4720 -8.2130 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 3.3010 1.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 4.0490 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 4.5350 -2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 2.7410 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 4.0480 -4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 5.7520 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 5.4270 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 6.1360 -7.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 6.5520 -10.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8940 6.2620 -10.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 4.0690 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 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 1 41 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 41 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 22 40 1 0 0 0 0 M END