PUBCHEM-ZINC02506283 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.9400 1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -2.5540 2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -1.8000 3.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -2.4250 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -3.8070 4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.5730 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -3.9530 2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -4.7650 1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -4.1840 0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -4.9560 -0.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -4.3540 -1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -3.1400 -1.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -5.1660 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -6.5610 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -7.3150 -3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -6.6950 -4.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -5.3180 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -4.5440 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -3.1900 -3.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -2.6270 -5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -1.1230 -4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -0.4160 -5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 0.9630 -5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 1.6360 -4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 0.9290 -4.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -0.4500 -4.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -9.2030 -3.6810 Br 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -4.6480 5.8500 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -0.7210 3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -1.8320 5.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -5.6510 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -5.8430 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -5.9250 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -7.0480 -1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -7.2930 -5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -4.8420 -5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -2.9430 -6.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -2.9680 -5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -0.9420 -6.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 1.5150 -5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 2.7130 -4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 1.4540 -3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8070 -1.0020 -3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 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 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END